Reaction Routes of
H7C2NO
Explored by
_
G_ R_ R_ M

at the Level of B3LYP/6-31G*

© 2009 Koichi OHNO


Explored: EQ127 TS1144
[ EQ0 ]
C1 ENERGY= 0.0 kJ/mol ( -210.3893827 Hartree) Energy+ZPE= 0.0 kJ/mol ZPE= 0.0978605 CONNECTIONS: o TS0 ( 14.7) o EQ0 o TS1 ( 5.6) o EQ2 o TS2 ( 9.4) o EQ3 o TS3 ( 18.2) o EQ4 o TS4 ( 19.5) o EQ4 o TS5 ( 24.8) o EQ4 o TS6 (481.3) o EQ61 o TS7 (479.5) o EQ71 o TS8 (552.0) o EQ105 o TS9 (236.3) o DDC0 o TS10 (260.2) o DDC1 o TS11 (333.5) o DDC2 o TS12 (461.0) o DDC3 o TS13 (468.2) o DDC4 o TS14 (470.0) o DDC5 o TS15 (492.3) o DDC6 o TS16 (498.3) o DDC7 o TS17 (503.4) o DDC8 o UDC0 o o UDC1 o o UDC2 o
[ EQ1 ]
C1 ENERGY= 0.8 kJ/mol ( -210.3890686 Hartree) Energy+ZPE= 1.0 kJ/mol ZPE= 0.0979503 CONNECTIONS: o TS18 ( 16.2) o EQ1 o TS19 ( 32.5) o EQ1 o TS20 ( 18.7) o EQ3 o TS21 ( 20.1) o EQ3 o TS22 ( 24.3) o EQ3 o TS23 ( 9.3) o EQ4 o TS24 (538.2) o EQ4 o TS25 ( 22.5) o EQ5 o TS26 ( 24.0) o EQ6 o TS27 (483.7) o EQ100 o TS28 (170.0) o DDC9 o TS29 (324.5) o DDC10 o TS30 (340.7) o DDC11 o TS31 (394.2) o DDC12 o TS32 (448.5) o DDC13 o TS33 (467.2) o DDC14 o TS34 (481.7) o DDC15 o TS35 (483.5) o DDC16 o TS36 (495.3) o DDC17 o UDC3 o o UDC4 o o UDC5 o o UDC6 o
[ EQ2 ]
C1 ENERGY= 1.0 kJ/mol ( -210.3890020 Hartree) Energy+ZPE= 0.8 kJ/mol ZPE= 0.0977720 CONNECTIONS: o TS1 ( 5.6) o EQ0 o TS37 ( 15.9) o EQ2 o TS38 ( 6.1) o EQ3 o TS39 ( 22.8) o EQ5 o TS40 ( 30.3) o EQ5 o TS41 ( 24.2) o EQ6 o TS42 (251.9) o EQ42 o TS43 (487.6) o EQ61 o TS44 (483.9) o EQ71 o TS45 (232.2) o DDC18 o TS46 (234.8) o DDC19 o TS47 (258.5) o DDC20 o TS48 (440.7) o DDC21 o TS49 (479.0) o DDC22 o TS50 (484.3) o DDC23 o TS51 (487.9) o DDC24 o TS52 (490.7) o DDC25 o TS53 (503.0) o DDC26 o UDC7 o o UDC8 o
[ EQ3 ]
C1 ENERGY= 1.1 kJ/mol ( -210.3889549 Hartree) Energy+ZPE= 1.1 kJ/mol ZPE= 0.0978514 CONNECTIONS: o TS2 ( 9.4) o EQ0 o TS20 ( 18.7) o EQ1 o TS21 ( 20.1) o EQ1 o TS22 ( 24.3) o EQ1 o TS38 ( 6.1) o EQ2 o TS54 ( 14.1) o EQ3 o TS55 (251.4) o EQ42 o TS56 (675.0) o EQ118 o TS57 (238.2) o DDC27 o TS58 (330.0) o DDC28 o TS59 (405.4) o DDC29 o TS60 (470.2) o DDC30 o TS61 (481.0) o DDC31 o TS62 (485.8) o DDC32 o TS63 (487.6) o DDC33 o TS64 (502.8) o DDC34 o TS65 (520.9) o DDC35 o UDC9 o o UDC10 o o UDC11 o
[ EQ4 ]
C1 ENERGY= 1.3 kJ/mol ( -210.3888906 Hartree) Energy+ZPE= 1.3 kJ/mol ZPE= 0.0978789 CONNECTIONS: o TS3 ( 18.2) o EQ0 o TS4 ( 19.5) o EQ0 o TS5 ( 24.8) o EQ0 o TS23 ( 9.3) o EQ1 o TS24 (538.2) o EQ1 o TS66 ( 15.6) o EQ4 o TS67 ( 21.7) o EQ5 o TS68 ( 23.6) o EQ6 o TS69 (519.9) o EQ59 o TS70 (491.5) o EQ100 o TS71 (311.7) o DDC36 o TS72 (343.7) o DDC37 o TS73 (389.0) o DDC38 o TS74 (404.8) o DDC39 o TS75 (459.4) o DDC40 o TS76 (461.6) o DDC41 o TS77 (476.5) o DDC42 o TS78 (476.9) o DDC43 o TS79 (490.7) o DDC44 o TS80 (491.0) o DDC45 o UDC12 o o UDC13 o o UDC14 o
[ EQ5 ]
C1 ENERGY= 18.7 kJ/mol ( -210.3822553 Hartree) Energy+ZPE= 17.4 kJ/mol ZPE= 0.0973620 CONNECTIONS: o TS25 ( 22.5) o EQ1 o TS39 ( 22.8) o EQ2 o TS40 ( 30.3) o EQ2 o TS67 ( 21.7) o EQ4 o TS81 ( 33.4) o EQ5 o TS82 ( 26.5) o EQ6 o TS83 (606.5) o EQ28 o TS84 (562.4) o EQ35 o TS85 (309.5) o DDC46 o TS86 (387.1) o DDC47 o TS87 (481.1) o DDC48 o TS88 (487.5) o DDC49 o TS89 (505.1) o DDC50 o UDC15 o o UDC16 o
[ EQ6 ]
C1 ENERGY= 20.6 kJ/mol ( -210.3815484 Hartree) Energy+ZPE= 19.3 kJ/mol ZPE= 0.0973768 CONNECTIONS: o TS26 ( 24.0) o EQ1 o TS41 ( 24.2) o EQ2 o TS68 ( 23.6) o EQ4 o TS82 ( 26.5) o EQ5 o TS90 ( 38.5) o EQ6 o TS91 (313.2) o DDC51 o TS92 (328.7) o DDC52 o TS93 (477.4) o DDC53 o TS94 (493.2) o DDC54 o TS95 (501.8) o DDC55 o UDC17 o o UDC18 o
[ EQ7 ]
C1 ENERGY= 25.7 kJ/mol ( -210.3795834 Hartree) Energy+ZPE= 28.9 kJ/mol ZPE= 0.0990639 CONNECTIONS: o TS96 ( 45.2) o EQ7 o TS97 (219.2) o EQ7 o TS98 (504.3) o EQ7 o TS99 ( 48.9) o EQ14 o TS100 ( 53.3) o EQ17 o TS101 ( 55.5) o EQ17 o TS102 ( 39.0) o EQ18 o TS103 ( 50.5) o EQ19 o TS104 ( 53.7) o EQ19 o TS105 ( 56.5) o EQ19 o TS106 ( 56.0) o EQ22 o TS107 ( 57.8) o EQ24 o TS108 ( 61.5) o EQ24 o TS109 ( 53.3) o EQ30 o TS110 ( 57.2) o EQ30 o TS111 (373.2) o EQ55 o TS112 (313.8) o EQ58 o TS113 (378.9) o EQ80 o TS114 (395.8) o EQ81 o TS115 (523.8) o EQ105 o TS116 (298.7) o DDC56 o TS117 (305.8) o DDC57 o TS118 (337.2) o DDC58 o TS119 (340.9) o DDC59 o TS120 (344.6) o DDC60 o TS121 (353.7) o DDC61 o TS122 (383.5) o DDC62 o TS123 (386.9) o DDC63 o TS124 (388.5) o DDC64 o TS125 (397.3) o DDC65 o TS126 (407.8) o DDC66 o TS127 (440.4) o DDC67 o TS128 (449.6) o DDC68 o TS129 (483.6) o DDC69 o TS130 (493.7) o DDC70 o TS131 (517.8) o DDC71 o TS132 (518.0) o DDC72 o UDC19 o
[ EQ8 ]
Cs ENERGY= 28.4 kJ/mol ( -210.3785719 Hartree) Energy+ZPE= 29.8 kJ/mol ZPE= 0.0983910 CONNECTIONS: o TS133 ( 38.7) o EQ8 o TS134 (473.9) o EQ8 o TS135 ( 38.0) o EQ9 o TS136 ( 55.0) o EQ27 o TS137 ( 56.1) o EQ27 o TS138 (288.0) o EQ45 o TS139 (414.5) o EQ98 o TS140 (495.2) o EQ98 o TS141 (273.8) o DDC73 o TS142 (383.7) o DDC74 o TS143 (409.6) o DDC75 o TS144 (412.1) o DDC76 o TS145 (501.6) o DDC77 o UDC20 o o UDC21 o
[ EQ9 ]
C1 ENERGY= 30.2 kJ/mol ( -210.3778966 Hartree) Energy+ZPE= 32.1 kJ/mol ZPE= 0.0985653 CONNECTIONS: o TS135 ( 38.0) o EQ8 o TS146 ( 38.5) o EQ9 o TS147 ( 52.9) o EQ9 o TS148 ( 48.3) o EQ20 o TS149 ( 56.5) o EQ20 o TS150 ( 60.9) o EQ20 o TS151 (286.4) o EQ45 o TS152 (418.8) o EQ84 o TS153 (496.6) o EQ84 o TS154 (415.5) o EQ85 o TS155 (484.2) o EQ85 o TS156 (322.4) o DDC78 o TS157 (374.3) o DDC79 o TS158 (406.9) o DDC80 o TS159 (407.4) o DDC81 o TS160 (409.5) o DDC82 o TS161 (414.9) o DDC83 o TS162 (504.0) o DDC84 o UDC22 o o UDC23 o
[ EQ10 ]
C1 ENERGY= 32.0 kJ/mol ( -210.3771862 Hartree) Energy+ZPE= 33.3 kJ/mol ZPE= 0.0983517 CONNECTIONS: o TS163 ( 43.6) o EQ10 o TS164 ( 43.9) o EQ11 o TS165 ( 65.5) o EQ12 o TS166 ( 51.9) o EQ13 o TS167 ( 37.1) o EQ15 o TS168 ( 57.4) o EQ29 o TS169 (286.0) o EQ44 o TS170 (483.0) o EQ61 o TS171 (399.2) o EQ63 o TS172 (281.1) o DDC85 o TS173 (319.1) o DDC86 o TS174 (364.1) o DDC87 o TS175 (379.6) o DDC88 o TS176 (381.6) o DDC89 o TS177 (387.1) o DDC90 o UDC24 o
[ EQ11 ]
C1 ENERGY= 32.4 kJ/mol ( -210.3770338 Hartree) Energy+ZPE= 33.6 kJ/mol ZPE= 0.0982996 CONNECTIONS: o TS164 ( 43.9) o EQ10 o TS178 ( 42.1) o EQ11 o TS179 ( 47.5) o EQ12 o TS180 ( 55.9) o EQ13 o TS181 ( 39.1) o EQ15 o TS182 ( 66.5) o EQ26 o TS183 (286.6) o EQ43 o TS184 (281.7) o EQ44 o TS185 (377.8) o EQ75 o TS186 (488.9) o EQ76 o TS187 (414.0) o EQ79 o TS188 (459.2) o EQ84 o TS189 (394.6) o DDC91 o TS190 (395.9) o DDC92 o TS191 (405.7) o DDC93 o UDC25 o o UDC26 o
[ EQ12 ]
C1 ENERGY= 33.0 kJ/mol ( -210.3768294 Hartree) Energy+ZPE= 34.3 kJ/mol ZPE= 0.0983446 CONNECTIONS: o TS165 ( 65.5) o EQ10 o TS179 ( 47.5) o EQ11 o TS192 ( 42.9) o EQ12 o TS193 ( 45.3) o EQ13 o TS194 ( 56.9) o EQ28 o TS195 ( 52.8) o EQ29 o TS196 (414.7) o EQ76 o TS197 (466.6) o EQ79 o TS198 (200.6) o DDC94 o TS199 (355.6) o DDC95 o TS200 (392.4) o DDC96 o TS201 (401.1) o DDC97 o UDC27 o o UDC28 o
[ EQ13 ]
C1 ENERGY= 34.4 kJ/mol ( -210.3762987 Hartree) Energy+ZPE= 35.5 kJ/mol ZPE= 0.0982740 CONNECTIONS: o TS166 ( 51.9) o EQ10 o TS180 ( 55.9) o EQ11 o TS193 ( 45.3) o EQ12 o TS202 ( 46.6) o EQ13 o TS203 ( 49.9) o EQ26 o TS204 ( 55.6) o EQ31 o TS205 (511.2) o EQ34 o TS206 (405.3) o EQ70 o TS207 (405.2) o EQ71 o TS208 (346.2) o DDC98 o TS209 (368.3) o DDC99 o TS210 (387.8) o DDC100 o TS211 (389.1) o DDC101 o UDC29 o
[ EQ14 ]
C1 ENERGY= 34.6 kJ/mol ( -210.3761869 Hartree) Energy+ZPE= 36.4 kJ/mol ZPE= 0.0985531 CONNECTIONS: o TS99 ( 48.9) o EQ7 o TS212 (502.9) o EQ14 o TS213 ( 40.5) o EQ16 o TS214 ( 48.7) o EQ17 o TS215 ( 59.6) o EQ17 o TS216 ( 48.3) o EQ19 o TS217 ( 58.0) o EQ19 o TS218 (527.6) o EQ19 o TS219 ( 56.6) o EQ21 o TS220 (378.3) o EQ55 o TS221 (401.9) o EQ93 o TS222 (519.6) o EQ93 o TS223 (436.5) o EQ108 o TS224 (350.4) o DDC102 o TS225 (383.0) o DDC103 o TS226 (454.1) o DDC104 o TS227 (460.2) o DDC105 o TS228 (463.0) o DDC106 o TS229 (502.4) o DDC107 o UDC30 o o UDC31 o
[ EQ15 ]
C1 ENERGY= 36.0 kJ/mol ( -210.3756608 Hartree) Energy+ZPE= 36.3 kJ/mol ZPE= 0.0979635 CONNECTIONS: o TS167 ( 37.1) o EQ10 o TS181 ( 39.1) o EQ11 o TS230 ( 45.8) o EQ15 o TS231 ( 59.0) o EQ28 o TS232 (283.4) o EQ43 o TS233 (460.3) o EQ85 o TS234 (278.0) o DDC108 o TS235 (400.6) o DDC109 o TS236 (401.6) o DDC110 o TS237 (420.8) o DDC111 o TS238 (422.8) o DDC112 o UDC32 o
[ EQ16 ]
C1 ENERGY= 36.2 kJ/mol ( -210.3755812 Hartree) Energy+ZPE= 37.6 kJ/mol ZPE= 0.0984058 CONNECTIONS: o TS213 ( 40.5) o EQ14 o TS239 ( 57.1) o EQ16 o TS240 ( 49.8) o EQ18 o TS241 ( 61.9) o EQ18 o TS242 ( 41.2) o EQ19 o TS243 ( 57.1) o EQ23 o TS244 ( 57.0) o EQ30 o TS245 (393.8) o EQ62 o TS246 (496.1) o EQ85 o TS247 (395.6) o EQ86 o TS248 (399.3) o EQ88 o TS249 (400.1) o EQ89 o TS250 (382.9) o DDC113 o TS251 (414.0) o DDC114 o TS252 (415.0) o DDC115 o TS253 (431.4) o DDC116 o TS254 (444.0) o DDC117 o TS255 (455.8) o DDC118 o TS256 (458.5) o DDC119 o TS257 (472.1) o DDC120 o UDC33 o o UDC34 o o UDC35 o
[ EQ17 ]
C1 ENERGY= 36.8 kJ/mol ( -210.3753668 Hartree) Energy+ZPE= 38.8 kJ/mol ZPE= 0.0986060 CONNECTIONS: o TS100 ( 53.3) o EQ7 o TS101 ( 55.5) o EQ7 o TS214 ( 48.7) o EQ14 o TS215 ( 59.6) o EQ14 o TS258 ( 43.2) o EQ18 o TS259 ( 56.4) o EQ22 o TS260 (383.9) o EQ56 o TS261 (402.8) o EQ94 o TS262 (334.7) o DDC121 o TS263 (353.9) o DDC122 o TS264 (360.5) o DDC123 o TS265 (368.5) o DDC124 o TS266 (395.9) o DDC125 o TS267 (475.8) o DDC126 o TS268 (590.6) o DDC127 o UDC36 o
[ EQ18 ]
C1 ENERGY= 36.9 kJ/mol ( -210.3753159 Hartree) Energy+ZPE= 38.5 kJ/mol ZPE= 0.0984858 CONNECTIONS: o TS102 ( 39.0) o EQ7 o TS240 ( 49.8) o EQ16 o TS241 ( 61.9) o EQ16 o TS258 ( 43.2) o EQ17 o TS269 ( 56.1) o EQ25 o TS270 ( 54.4) o EQ30 o TS271 (388.8) o EQ57 o TS272 (525.0) o EQ72 o TS273 (411.8) o EQ80 o TS274 (409.6) o EQ82 o TS275 (514.2) o EQ82 o TS276 (397.1) o EQ87 o TS277 (403.7) o EQ96 o TS278 (357.4) o DDC128 o TS279 (380.9) o DDC129 o TS280 (396.2) o DDC130 o TS281 (427.7) o DDC131 o TS282 (447.1) o DDC132 o TS283 (525.8) o DDC133 o UDC37 o o UDC38 o
[ EQ19 ]
C1 ENERGY= 38.7 kJ/mol ( -210.3746253 Hartree) Energy+ZPE= 39.9 kJ/mol ZPE= 0.0983148 CONNECTIONS: o TS103 ( 50.5) o EQ7 o TS104 ( 53.7) o EQ7 o TS105 ( 56.5) o EQ7 o TS216 ( 48.3) o EQ14 o TS217 ( 58.0) o EQ14 o TS218 (527.6) o EQ14 o TS242 ( 41.2) o EQ16 o TS284 ( 57.6) o EQ21 o TS285 (399.0) o EQ56 o TS286 (401.0) o EQ90 o TS287 (519.6) o EQ90 o TS288 (439.1) o EQ108 o TS289 (353.0) o DDC134 o TS290 (367.8) o DDC135 o TS291 (416.3) o DDC136 o TS292 (455.5) o DDC137 o TS293 (460.7) o DDC138 o TS294 (463.3) o DDC139
[ EQ20 ]
C1 ENERGY= 39.2 kJ/mol ( -210.3744468 Hartree) Energy+ZPE= 40.2 kJ/mol ZPE= 0.0982252 CONNECTIONS: o TS148 ( 48.3) o EQ9 o TS149 ( 56.5) o EQ9 o TS150 ( 60.9) o EQ9 o TS295 ( 47.0) o EQ20 o TS296 ( 62.4) o EQ20 o TS297 ( 57.6) o EQ27 o TS298 ( 58.4) o EQ27 o TS299 (432.3) o EQ92 o TS300 (494.8) o EQ92 o TS301 (503.6) o EQ92 o TS302 (783.2) o EQ123 o TS303 (342.3) o DDC140 o TS304 (378.0) o DDC141 o TS305 (386.6) o DDC142 o TS306 (387.0) o DDC143 o TS307 (425.5) o DDC144 o TS308 (426.3) o DDC145 o TS309 (429.2) o DDC146 o TS310 (430.0) o DDC147 o TS311 (493.9) o DDC148
[ EQ21 ]
C1 ENERGY= 40.0 kJ/mol ( -210.3741362 Hartree) Energy+ZPE= 41.2 kJ/mol ZPE= 0.0983194 CONNECTIONS: o TS219 ( 56.6) o EQ14 o TS284 ( 57.6) o EQ19 o TS312 ( 47.3) o EQ21 o TS313 ( 52.9) o EQ22 o TS314 ( 46.1) o EQ23 o TS315 ( 54.2) o EQ24 o TS316 ( 61.8) o EQ24 o TS317 (439.5) o EQ45 o TS318 (401.4) o EQ65 o TS319 (402.1) o EQ67 o TS320 (375.8) o DDC149 o TS321 (377.1) o DDC150 o TS322 (378.5) o DDC151 o TS323 (395.2) o DDC152 o TS324 (421.1) o DDC153 o TS325 (430.8) o DDC154 o TS326 (459.2) o DDC155 o UDC39 o o UDC40 o o UDC41 o o UDC42 o
[ EQ22 ]
C1 ENERGY= 42.1 kJ/mol ( -210.3733562 Hartree) Energy+ZPE= 43.1 kJ/mol ZPE= 0.0982491 CONNECTIONS: o TS106 ( 56.0) o EQ7 o TS259 ( 56.4) o EQ17 o TS313 ( 52.9) o EQ21 o TS327 (427.4) o EQ22 o TS328 ( 48.0) o EQ24 o TS329 ( 50.9) o EQ24 o TS330 (559.7) o EQ24 o TS331 ( 46.9) o EQ25 o TS332 (391.8) o DDC156 o TS333 (396.5) o DDC157 o TS334 (431.3) o DDC158 o TS335 (453.2) o DDC159 o TS336 (478.5) o DDC160 o TS337 (501.5) o DDC161 o UDC43 o
[ EQ23 ]
Cs ENERGY= 42.3 kJ/mol ( -210.3732822 Hartree) Energy+ZPE= 43.0 kJ/mol ZPE= 0.0981412 CONNECTIONS: o TS243 ( 57.1) o EQ16 o TS314 ( 46.1) o EQ21 o TS338 ( 56.2) o EQ25 o TS339 ( 63.2) o EQ25 o TS340 (400.1) o EQ64 o TS341 (422.6) o EQ77 o TS342 (416.0) o DDC162 o TS343 (479.8) o DDC163 o TS344 (507.5) o DDC164 o UDC44 o o UDC45 o o UDC46 o
[ EQ24 ]
C1 ENERGY= 42.8 kJ/mol ( -210.3730910 Hartree) Energy+ZPE= 43.8 kJ/mol ZPE= 0.0982369 CONNECTIONS: o TS107 ( 57.8) o EQ7 o TS108 ( 61.5) o EQ7 o TS315 ( 54.2) o EQ21 o TS316 ( 61.8) o EQ21 o TS328 ( 48.0) o EQ22 o TS329 ( 50.9) o EQ22 o TS330 (559.7) o EQ22 o TS345 ( 48.2) o EQ25 o TS346 (416.0) o EQ65 o TS347 (342.4) o DDC165 o TS348 (386.1) o DDC166 o TS349 (429.8) o DDC167 o TS350 (450.1) o DDC168 o TS351 (452.3) o DDC169 o TS352 (454.1) o DDC170 o TS353 (466.0) o DDC171 o TS354 (478.8) o DDC172 o TS355 (511.1) o DDC173 o UDC47 o
[ EQ25 ]
C1 ENERGY= 43.6 kJ/mol ( -210.3727758 Hartree) Energy+ZPE= 44.3 kJ/mol ZPE= 0.0981437 CONNECTIONS: o TS269 ( 56.1) o EQ18 o TS331 ( 46.9) o EQ22 o TS338 ( 56.2) o EQ23 o TS339 ( 63.2) o EQ23 o TS345 ( 48.2) o EQ24 o TS356 ( 48.4) o EQ25 o TS357 (602.1) o EQ25 o TS358 (694.2) o EQ25 o TS359 ( 60.3) o EQ30 o TS360 (412.4) o EQ64 o TS361 (408.2) o DDC174 o TS362 (423.1) o DDC175 o TS363 (424.6) o DDC176 o TS364 (459.2) o DDC177 o TS365 (489.1) o DDC178 o TS366 (563.8) o DDC179 o UDC48 o o UDC49 o o UDC50 o o UDC51 o
[ EQ26 ]
C1 ENERGY= 49.5 kJ/mol ( -210.3705358 Hartree) Energy+ZPE= 49.1 kJ/mol ZPE= 0.0977147 CONNECTIONS: o TS182 ( 66.5) o EQ11 o TS203 ( 49.9) o EQ13 o TS367 ( 51.1) o EQ28 o TS368 (494.6) o EQ59 o TS369 (408.6) o EQ63 o TS370 (345.3) o DDC180 o TS371 (380.6) o DDC181 o TS372 (408.0) o DDC182 o UDC52 o
[ EQ27 ]
C1 ENERGY= 50.1 kJ/mol ( -210.3703054 Hartree) Energy+ZPE= 49.9 kJ/mol ZPE= 0.0977814 CONNECTIONS: o TS136 ( 55.0) o EQ8 o TS137 ( 56.1) o EQ8 o TS297 ( 57.6) o EQ20 o TS298 ( 58.4) o EQ20 o TS373 ( 52.2) o EQ27 o TS374 ( 61.0) o EQ27 o TS375 (430.6) o EQ100 o TS376 (362.7) o DDC183 o TS377 (428.4) o DDC184 o TS378 (431.6) o DDC185 o UDC53 o
[ EQ28 ]
C1 ENERGY= 50.8 kJ/mol ( -210.3700452 Hartree) Energy+ZPE= 50.2 kJ/mol ZPE= 0.0976329 CONNECTIONS: o TS83 (606.5) o EQ5 o TS194 ( 56.9) o EQ12 o TS231 ( 59.0) o EQ15 o TS367 ( 51.1) o EQ26 o TS379 ( 60.8) o EQ28 o TS380 ( 59.7) o EQ31 o TS381 (338.0) o DDC186 o TS382 (422.2) o DDC187
[ EQ29 ]
C1 ENERGY= 52.1 kJ/mol ( -210.3695490 Hartree) Energy+ZPE= 51.7 kJ/mol ZPE= 0.0977110 CONNECTIONS: o TS168 ( 57.4) o EQ10 o TS195 ( 52.8) o EQ12 o TS383 ( 53.9) o EQ31 o TS384 (526.5) o EQ39 o TS385 (413.0) o EQ70 o TS386 (413.4) o EQ72 o TS387 (345.3) o DDC188 o TS388 (373.6) o DDC189
[ EQ30 ]
C1 ENERGY= 52.5 kJ/mol ( -210.3693852 Hartree) Energy+ZPE= 52.2 kJ/mol ZPE= 0.0977506 CONNECTIONS: o TS109 ( 53.3) o EQ7 o TS110 ( 57.2) o EQ7 o TS244 ( 57.0) o EQ16 o TS270 ( 54.4) o EQ18 o TS359 ( 60.3) o EQ25 o TS389 (403.6) o EQ80 o TS390 (508.1) o EQ82 o TS391 (421.9) o DDC190 o TS392 (470.2) o DDC191
[ EQ31 ]
C1 ENERGY= 52.5 kJ/mol ( -210.3693744 Hartree) Energy+ZPE= 51.8 kJ/mol ZPE= 0.0976115 CONNECTIONS: o TS204 ( 55.6) o EQ13 o TS380 ( 59.7) o EQ28 o TS383 ( 53.9) o EQ29 o TS393 ( 65.7) o EQ31 o TS394 (416.2) o EQ73 o TS395 (415.6) o EQ74 o TS396 (339.9) o DDC192 o TS397 (345.3) o DDC193 o TS398 (356.9) o DDC194 o TS399 (400.4) o DDC195 o TS400 (402.6) o DDC196 o TS401 (495.5) o DDC197
[ EQ32 ]
C1 ENERGY= 140.7 kJ/mol ( -210.3358102 Hartree) Energy+ZPE= 140.2 kJ/mol ZPE= 0.0976589 CONNECTIONS: o TS402 (153.8) o EQ32 o TS403 (156.7) o EQ34 o TS404 (172.6) o EQ38 o TS405 (175.3) o EQ38 o TS406 (194.5) o EQ40 o TS407 (349.6) o EQ46 o TS408 (555.7) o EQ105 o TS409 (398.0) o DDC198 o TS410 (459.8) o DDC199 o TS411 (469.5) o DDC200 o TS412 (469.9) o DDC201 o TS413 (501.2) o DDC202 o TS414 (621.0) o DDC203 o TS415 (623.2) o DDC204 o TS416 (631.8) o DDC205 o TS417 (634.9) o DDC206 o UDC54 o o UDC55 o
[ EQ33 ]
C1 ENERGY= 142.1 kJ/mol ( -210.3352634 Hartree) Energy+ZPE= 141.2 kJ/mol ZPE= 0.0975173 CONNECTIONS: o TS418 (155.2) o EQ33 o TS419 (156.8) o EQ34 o TS420 (193.9) o EQ38 o TS421 (174.1) o EQ40 o TS422 (174.3) o EQ40 o TS423 (349.1) o EQ46 o TS424 (553.4) o EQ102 o TS425 (580.4) o EQ102 o TS426 (538.6) o EQ116 o TS427 (397.1) o DDC207 o TS428 (399.7) o DDC208 o TS429 (458.5) o DDC209 o TS430 (475.2) o DDC210 o TS431 (489.4) o DDC211 o TS432 (502.6) o DDC212 o TS433 (512.0) o DDC213 o TS434 (545.5) o DDC214 o TS435 (554.8) o DDC215 o TS436 (561.7) o DDC216 o TS437 (635.9) o DDC217 o UDC56 o o UDC57 o o UDC58 o
[ EQ34 ]
C1 ENERGY= 142.3 kJ/mol ( -210.3351936 Hartree) Energy+ZPE= 141.3 kJ/mol ZPE= 0.0974833 CONNECTIONS: o TS205 (511.2) o EQ13 o TS403 (156.7) o EQ32 o TS419 (156.8) o EQ33 o TS438 (154.5) o EQ34 o TS439 (171.5) o EQ39 o TS440 (175.7) o EQ39 o TS441 (196.1) o EQ39 o TS442 (352.3) o EQ47 o TS443 (406.9) o EQ91 o TS444 (453.2) o DDC218 o TS445 (506.0) o DDC219 o TS446 (529.2) o DDC220 o TS447 (544.8) o DDC221 o TS448 (596.3) o DDC222 o TS449 (603.2) o DDC223 o TS450 (619.0) o DDC224 o TS451 (629.3) o DDC225 o UDC59 o o UDC60 o o UDC61 o o UDC62 o
[ EQ35 ]
C1 ENERGY= 145.9 kJ/mol ( -210.3338144 Hartree) Energy+ZPE= 145.0 kJ/mol ZPE= 0.0975158 CONNECTIONS: o TS84 (562.4) o EQ5 o TS452 (160.2) o EQ35 o TS453 (167.7) o EQ35 o TS454 (618.2) o EQ35 o TS455 (154.2) o EQ36 o TS456 (172.9) o EQ41 o TS457 (174.0) o EQ41 o TS458 (199.5) o EQ41 o TS459 (499.6) o EQ46 o TS460 (430.4) o EQ102 o TS461 (434.6) o EQ105 o TS462 (544.8) o EQ118 o TS463 (356.4) o DDC226 o TS464 (444.3) o DDC227 o TS465 (446.7) o DDC228 o TS466 (465.0) o DDC229 o TS467 (500.3) o DDC230 o TS468 (505.0) o DDC231 o TS469 (506.0) o DDC232 o TS470 (523.5) o DDC233 o TS471 (531.5) o DDC234 o TS472 (539.4) o DDC235 o TS473 (551.8) o DDC236 o TS474 (621.4) o DDC237 o TS475 (625.2) o DDC238 o TS476 (647.3) o DDC239 o TS477 (893.4) o DDC240 o UDC63 o
[ EQ36 ]
Cs ENERGY= 146.1 kJ/mol ( -210.3337422 Hartree) Energy+ZPE= 144.5 kJ/mol ZPE= 0.0972605 CONNECTIONS: o TS455 (154.2) o EQ35 o TS478 (159.1) o EQ36 o TS479 (169.9) o EQ37 o TS480 (198.8) o EQ37 o TS481 (464.5) o EQ47 o TS482 (433.1) o EQ107 o TS483 (541.6) o EQ117 o TS484 (527.6) o DDC241 o TS485 (614.7) o DDC242 o TS486 (620.0) o DDC243 o TS487 (629.5) o DDC244 o UDC64 o o UDC65 o
[ EQ37 ]
Cs ENERGY= 156.1 kJ/mol ( -210.3299329 Hartree) Energy+ZPE= 154.6 kJ/mol ZPE= 0.0972813 CONNECTIONS: o TS479 (169.9) o EQ36 o TS480 (198.8) o EQ36 o TS488 (168.5) o EQ37 o TS489 (169.6) o EQ41 o TS490 (470.7) o EQ47 o TS491 (455.1) o EQ107 o TS492 (537.8) o EQ114 o TS493 (526.2) o DDC245 o TS494 (556.2) o DDC246 o TS495 (648.0) o DDC247 o UDC66 o o UDC67 o
[ EQ38 ]
C1 ENERGY= 157.4 kJ/mol ( -210.3294150 Hartree) Energy+ZPE= 155.8 kJ/mol ZPE= 0.0972573 CONNECTIONS: o TS404 (172.6) o EQ32 o TS405 (175.3) o EQ32 o TS420 (193.9) o EQ33 o TS496 (169.5) o EQ38 o TS497 (174.7) o EQ39 o TS498 (185.6) o EQ40 o TS499 (376.8) o DDC248 o TS500 (497.8) o DDC249 o UDC68 o o UDC69 o o UDC70 o
[ EQ39 ]
C1 ENERGY= 158.1 kJ/mol ( -210.3291756 Hartree) Energy+ZPE= 156.4 kJ/mol ZPE= 0.0972005 CONNECTIONS: o TS384 (526.5) o EQ29 o TS439 (171.5) o EQ34 o TS440 (175.7) o EQ34 o TS441 (196.1) o EQ34 o TS497 (174.7) o EQ38 o TS501 (170.2) o EQ39 o TS502 (176.9) o EQ40 o TS503 (423.6) o EQ91 o TS504 (554.1) o EQ112 o TS505 (371.7) o DDC250 o TS506 (644.4) o DDC251 o TS507 (651.5) o DDC252 o UDC71 o o UDC72 o o UDC73 o o UDC74 o
[ EQ40 ]
C1 ENERGY= 160.7 kJ/mol ( -210.3281851 Hartree) Energy+ZPE= 159.1 kJ/mol ZPE= 0.0972686 CONNECTIONS: o TS406 (194.5) o EQ32 o TS421 (174.1) o EQ33 o TS422 (174.3) o EQ33 o TS498 (185.6) o EQ38 o TS502 (176.9) o EQ39 o TS508 (172.9) o EQ40 o TS509 (606.3) o EQ110 o TS510 (580.3) o EQ111 o TS511 (409.0) o DDC253 o TS512 (420.1) o DDC254 o TS513 (484.9) o DDC255 o TS514 (488.5) o DDC256 o TS515 (635.2) o DDC257 o TS516 (635.5) o DDC258 o TS517 (649.3) o DDC259 o UDC75 o o UDC76 o
[ EQ41 ]
C1 ENERGY= 160.7 kJ/mol ( -210.3281687 Hartree) Energy+ZPE= 159.3 kJ/mol ZPE= 0.0973322 CONNECTIONS: o TS456 (172.9) o EQ35 o TS457 (174.0) o EQ35 o TS458 (199.5) o EQ35 o TS489 (169.6) o EQ37 o TS518 (173.3) o EQ41 o TS519 (184.8) o EQ41 o TS520 (496.2) o EQ46 o TS521 (460.0) o EQ105 o TS522 (455.0) o EQ110 o TS523 (473.9) o DDC260 o TS524 (489.8) o DDC261 o TS525 (495.1) o DDC262 o TS526 (510.9) o DDC263 o TS527 (518.7) o DDC264 o TS528 (542.7) o DDC265 o TS529 (628.9) o DDC266 o TS530 (646.5) o DDC267 o TS531 (675.0) o DDC268 o UDC77 o o UDC78 o
[ EQ42 ]
C1 ENERGY= 167.3 kJ/mol ( -210.3256545 Hartree) Energy+ZPE= 156.7 kJ/mol ZPE= 0.0938110 CONNECTIONS: o TS42 (251.9) o EQ2 o TS55 (251.4) o EQ3 o TS532 (173.9) o EQ42 o TS533 (176.5) o EQ42 o TS534 (372.6) o EQ42 o TS535 (397.0) o EQ42 o TS536 (228.1) o DDC269 o TS537 (403.5) o DDC270 o UDC79 o o UDC80 o
[ EQ43 ]
C1 ENERGY= 203.7 kJ/mol ( -210.3118047 Hartree) Energy+ZPE= 194.3 kJ/mol ZPE= 0.0942752 CONNECTIONS: o TS183 (286.6) o EQ11 o TS232 (283.4) o EQ15 o TS538 (208.7) o EQ43 o TS539 (210.6) o EQ43 o TS540 (399.5) o EQ60 o TS541 (657.3) o EQ65 o TS542 (260.2) o DDC271 o TS543 (425.7) o DDC272 o UDC81 o o UDC82 o o UDC83 o
[ EQ44 ]
C1 ENERGY= 207.6 kJ/mol ( -210.3103241 Hartree) Energy+ZPE= 197.3 kJ/mol ZPE= 0.0939258 CONNECTIONS: o TS169 (286.0) o EQ10 o TS184 (281.7) o EQ11 o TS544 (212.3) o EQ44 o TS545 (222.6) o EQ44 o TS546 (308.1) o DDC273 o TS547 (312.8) o DDC274 o TS548 (397.3) o DDC275 o TS549 (696.7) o DDC276 o TS550 (697.2) o DDC277 o UDC84 o o UDC85 o o UDC86 o o UDC87 o o UDC88 o
[ EQ45 ]
C1 ENERGY= 226.8 kJ/mol ( -210.3029894 Hartree) Energy+ZPE= 218.5 kJ/mol ZPE= 0.0947067 CONNECTIONS: o TS138 (288.0) o EQ8 o TS151 (286.4) o EQ9 o TS317 (439.5) o EQ21 o TS551 (230.6) o EQ45 o TS552 (232.7) o EQ45 o TS553 (462.7) o EQ45 o TS554 (673.0) o EQ45 o TS555 (658.2) o EQ123 o TS556 (751.7) o EQ126 o TS557 (281.8) o DDC278 o TS558 (669.8) o DDC279 o UDC89 o
[ EQ46 ]
C1 ENERGY= 229.9 kJ/mol ( -210.3018298 Hartree) Energy+ZPE= 230.9 kJ/mol ZPE= 0.0982476 CONNECTIONS: o TS407 (349.6) o EQ32 o TS423 (349.1) o EQ33 o TS459 (499.6) o EQ35 o TS520 (496.2) o EQ41 o TS559 (242.4) o EQ46 o TS560 (251.6) o EQ46 o TS561 (251.8) o EQ47 o TS562 (328.9) o DDC280 o TS563 (454.9) o DDC281 o TS564 (459.7) o DDC282 o TS565 (690.7) o DDC283 o TS566 (762.9) o DDC284 o UDC90 o o UDC91 o o UDC92 o o UDC93 o
[ EQ47 ]
C1 ENERGY= 235.8 kJ/mol ( -210.2995887 Hartree) Energy+ZPE= 236.1 kJ/mol ZPE= 0.0979810 CONNECTIONS: o TS442 (352.3) o EQ34 o TS481 (464.5) o EQ36 o TS490 (470.7) o EQ37 o TS561 (251.8) o EQ46 o TS567 (245.1) o EQ47 o TS568 (422.1) o DDC285 o TS569 (461.9) o DDC286 o TS570 (519.2) o DDC287 o TS571 (709.8) o DDC288 o UDC94 o o UDC95 o
[ EQ48 ]
C1 ENERGY= 262.9 kJ/mol ( -210.2892546 Hartree) Energy+ZPE= 253.8 kJ/mol ZPE= 0.0943775 CONNECTIONS: o TS572 (265.3) o EQ48 o TS573 (268.0) o EQ48 o TS574 (268.0) o EQ48 o TS575 (271.9) o EQ48 o TS576 (379.0) o EQ52 o TS577 (287.3) o DDC289 o TS578 (350.0) o DDC290 o TS579 (356.2) o DDC291 o TS580 (375.4) o DDC292 o TS581 (468.2) o DDC293
[ EQ49 ]
C1 ENERGY= 265.3 kJ/mol ( -210.2883167 Hartree) Energy+ZPE= 255.7 kJ/mol ZPE= 0.0942123 CONNECTIONS:
[ EQ50 ]
C1 ENERGY= 279.9 kJ/mol ( -210.2827688 Hartree) Energy+ZPE= 273.3 kJ/mol ZPE= 0.0953620 CONNECTIONS: o TS582 (298.4) o EQ50 o TS583 (302.2) o EQ51 o TS584 (337.2) o EQ51 o TS585 (389.4) o EQ51 o TS586 (280.8) o DDC294 o TS587 (366.7) o DDC295 o TS588 (383.5) o DDC296 o TS589 (388.6) o DDC297 o TS590 (503.7) o DDC298
[ EQ51 ]
C1 ENERGY= 283.1 kJ/mol ( -210.2815612 Hartree) Energy+ZPE= 274.6 kJ/mol ZPE= 0.0946398 CONNECTIONS: o TS583 (302.2) o EQ50 o TS584 (337.2) o EQ50 o TS585 (389.4) o EQ50 o TS591 (305.6) o EQ51 o TS592 (284.0) o DDC299 o TS593 (351.9) o DDC300
[ EQ52 ]
C1 ENERGY= 289.0 kJ/mol ( -210.2793191 Hartree) Energy+ZPE= 276.9 kJ/mol ZPE= 0.0932397 CONNECTIONS: o TS576 (379.0) o EQ48 o TS594 (290.8) o EQ52 o TS595 (297.7) o EQ52 o TS596 (494.1) o DDC301 o TS597 (686.4) o DDC302 o TS598 (686.6) o DDC303 o TS1143 (289.2) o xx
[ EQ53 ]
C1 ENERGY= 289.0 kJ/mol ( -210.2793076 Hartree) Energy+ZPE= 276.9 kJ/mol ZPE= 0.0932424 CONNECTIONS: o TS599 (332.8) o DDC304
[ EQ54 ]
Cs ENERGY= 289.2 kJ/mol ( -210.2792472 Hartree) Energy+ZPE= 277.0 kJ/mol ZPE= 0.0932015 CONNECTIONS:
[ EQ55 ]
C1 ENERGY= 290.3 kJ/mol ( -210.2787983 Hartree) Energy+ZPE= 289.4 kJ/mol ZPE= 0.0975009 CONNECTIONS: o TS111 (373.2) o EQ7 o TS220 (378.3) o EQ14 o TS600 (309.9) o EQ55 o TS601 (330.0) o EQ56 o TS602 (336.7) o EQ57 o TS603 (318.9) o EQ62 o TS604 (336.5) o EQ62 o TS605 (321.2) o EQ67 o TS606 (395.0) o DDC305 o TS607 (405.3) o DDC306 o TS608 (412.4) o DDC307 o TS609 (413.7) o DDC308
[ EQ56 ]
C1 ENERGY= 295.4 kJ/mol ( -210.2768727 Hartree) Energy+ZPE= 294.5 kJ/mol ZPE= 0.0975046 CONNECTIONS: o TS260 (383.9) o EQ17 o TS285 (399.0) o EQ19 o TS601 (330.0) o EQ55 o TS610 (311.6) o EQ56 o TS611 (306.7) o EQ57 o TS612 (326.7) o EQ57 o TS613 (344.9) o EQ62 o TS614 (344.5) o EQ67 o TS615 (345.1) o EQ67 o TS616 (414.3) o EQ101 o TS617 (328.2) o DDC309 o TS618 (396.9) o DDC310 o TS619 (475.3) o DDC311 o TS620 (559.0) o DDC312 o TS621 (631.6) o DDC313
[ EQ57 ]
C1 ENERGY= 300.2 kJ/mol ( -210.2750582 Hartree) Energy+ZPE= 298.3 kJ/mol ZPE= 0.0971359 CONNECTIONS: o TS271 (388.8) o EQ18 o TS602 (336.7) o EQ55 o TS611 (306.7) o EQ56 o TS612 (326.7) o EQ56 o TS622 (314.2) o EQ57 o TS623 (340.2) o EQ62 o TS624 (347.9) o EQ77 o TS625 (332.8) o DDC314 o TS626 (408.8) o DDC315 o TS627 (408.8) o DDC316 o TS628 (431.6) o DDC317 o TS629 (476.1) o DDC318 o TS630 (553.6) o DDC319
[ EQ58 ]
C1 ENERGY= 303.4 kJ/mol ( -210.2738280 Hartree) Energy+ZPE= 296.4 kJ/mol ZPE= 0.0952016 CONNECTIONS: o TS112 (313.8) o EQ7 o TS631 (304.0) o EQ58 o TS632 (310.8) o EQ58 o TS633 (307.4) o DDC320 o TS634 (310.0) o DDC321
[ EQ59 ]
C1 ENERGY= 303.6 kJ/mol ( -210.2737548 Hartree) Energy+ZPE= 301.5 kJ/mol ZPE= 0.0970697 CONNECTIONS: o TS69 (519.9) o EQ4 o TS368 (494.6) o EQ26 o TS635 (316.4) o EQ59 o TS636 (693.9) o EQ59 o TS637 (313.8) o EQ60 o TS638 (312.5) o EQ61 o TS639 (331.1) o EQ66 o TS640 (367.4) o EQ66 o TS641 (396.4) o EQ68 o TS642 (398.8) o DDC322 o TS643 (426.5) o DDC323 o TS644 (433.2) o DDC324 o TS645 (666.3) o DDC325 o TS646 (716.1) o DDC326
[ EQ60 ]
C1 ENERGY= 305.3 kJ/mol ( -210.2730888 Hartree) Energy+ZPE= 303.0 kJ/mol ZPE= 0.0969967 CONNECTIONS: o TS540 (399.5) o EQ43 o TS637 (313.8) o EQ59 o TS647 (318.4) o EQ60 o TS648 (675.0) o EQ60 o TS649 (314.1) o EQ61 o TS650 (393.9) o EQ66 o TS651 (333.1) o EQ68 o TS652 (660.0) o EQ122 o TS653 (401.0) o DDC327 o TS654 (402.7) o DDC328 o TS655 (630.0) o DDC329 o TS656 (692.1) o DDC330 o TS657 (709.9) o DDC331 o TS658 (762.0) o DDC332
[ EQ61 ]
C1 ENERGY= 306.7 kJ/mol ( -210.2725594 Hartree) Energy+ZPE= 303.7 kJ/mol ZPE= 0.0967273 CONNECTIONS: o TS6 (481.3) o EQ0 o TS43 (487.6) o EQ2 o TS170 (483.0) o EQ10 o TS638 (312.5) o EQ59 o TS649 (314.1) o EQ60 o TS659 (315.9) o EQ61 o TS660 (334.2) o EQ69 o TS661 (398.9) o EQ69 o TS662 (430.7) o EQ71 o TS663 (655.0) o EQ121
[ EQ62 ]
C1 ENERGY= 310.9 kJ/mol ( -210.2709655 Hartree) Energy+ZPE= 307.5 kJ/mol ZPE= 0.0965479 CONNECTIONS: o TS245 (393.8) o EQ16 o TS603 (318.9) o EQ55 o TS604 (336.5) o EQ55 o TS613 (344.9) o EQ56 o TS623 (340.2) o EQ57 o TS664 (331.4) o EQ62 o TS665 (349.4) o EQ78 o TS666 (404.4) o DDC333 o TS667 (410.2) o DDC334 o TS668 (414.8) o DDC335 o TS669 (416.7) o DDC336 o TS670 (418.3) o DDC337 o TS671 (658.7) o DDC338
[ EQ63 ]
C1 ENERGY= 313.8 kJ/mol ( -210.2698618 Hartree) Energy+ZPE= 312.3 kJ/mol ZPE= 0.0972855 CONNECTIONS: o TS171 (399.2) o EQ10 o TS369 (408.6) o EQ26 o TS672 (371.7) o EQ63 o TS673 (343.2) o EQ70 o TS674 (348.9) o EQ76 o TS675 (352.0) o EQ76 o TS676 (318.3) o DDC339 o TS677 (338.6) o DDC340 o TS678 (345.3) o DDC341
[ EQ64 ]
C1 ENERGY= 318.5 kJ/mol ( -210.2680659 Hartree) Energy+ZPE= 310.6 kJ/mol ZPE= 0.0948646 CONNECTIONS: o TS340 (400.1) o EQ23 o TS360 (412.4) o EQ25 o TS679 (323.9) o EQ65 o TS680 (341.9) o EQ65 o TS681 (350.1) o EQ65 o TS682 (437.5) o EQ65 o TS683 (409.3) o EQ88 o TS684 (657.6) o EQ122 o TS685 (334.4) o DDC342 o TS686 (397.2) o DDC343 o TS687 (413.6) o DDC344 o TS688 (414.5) o DDC345 o TS689 (426.9) o DDC346 o TS690 (428.9) o DDC347 o TS691 (436.5) o DDC348 o TS692 (577.3) o DDC349 o TS693 (606.7) o DDC350 o UDC96 o
[ EQ65 ]
C1 ENERGY= 318.6 kJ/mol ( -210.2680383 Hartree) Energy+ZPE= 310.7 kJ/mol ZPE= 0.0948539 CONNECTIONS: o TS318 (401.4) o EQ21 o TS346 (416.0) o EQ24 o TS541 (657.3) o EQ43 o TS679 (323.9) o EQ64 o TS680 (341.9) o EQ64 o TS681 (350.1) o EQ64 o TS682 (437.5) o EQ64 o TS694 (438.3) o EQ80 o TS695 (416.2) o EQ86 o TS696 (412.3) o EQ93 o TS697 (417.7) o EQ93 o TS698 (432.1) o EQ94 o TS699 (661.3) o EQ125 o TS700 (334.5) o DDC351 o TS701 (399.1) o DDC352 o TS702 (415.2) o DDC353 o TS703 (423.0) o DDC354 o TS704 (425.8) o DDC355 o TS705 (484.2) o DDC356 o TS706 (493.5) o DDC357 o UDC97 o
[ EQ66 ]
C1 ENERGY= 320.0 kJ/mol ( -210.2675056 Hartree) Energy+ZPE= 315.1 kJ/mol ZPE= 0.0960088 CONNECTIONS: o TS639 (331.1) o EQ59 o TS640 (367.4) o EQ59 o TS650 (393.9) o EQ60 o TS707 (332.2) o EQ66 o TS708 (330.5) o EQ69 o TS709 (686.6) o EQ122 o TS710 (328.3) o DDC358 o TS711 (394.5) o DDC359 o TS712 (419.0) o DDC360 o TS713 (423.2) o DDC361 o TS714 (619.0) o DDC362
[ EQ67 ]
C1 ENERGY= 320.6 kJ/mol ( -210.2672651 Hartree) Energy+ZPE= 317.9 kJ/mol ZPE= 0.0968314 CONNECTIONS: o TS319 (402.1) o EQ21 o TS605 (321.2) o EQ55 o TS614 (344.5) o EQ56 o TS615 (345.1) o EQ56 o TS715 (350.6) o EQ78 o TS716 (423.5) o DDC363
[ EQ68 ]
C1 ENERGY= 322.1 kJ/mol ( -210.2666968 Hartree) Energy+ZPE= 317.1 kJ/mol ZPE= 0.0959553 CONNECTIONS: o TS641 (396.4) o EQ59 o TS651 (333.1) o EQ60 o TS717 (334.5) o EQ68 o TS718 (388.3) o DDC364 o TS719 (399.0) o DDC365 o TS720 (420.8) o DDC366 o TS721 (494.3) o DDC367
[ EQ69 ]
C1 ENERGY= 322.2 kJ/mol ( -210.2666759 Hartree) Energy+ZPE= 316.5 kJ/mol ZPE= 0.0957014 CONNECTIONS: o TS660 (334.2) o EQ61 o TS661 (398.9) o EQ61 o TS708 (330.5) o EQ66 o TS722 (331.2) o EQ69 o TS723 (441.8) o EQ72 o TS724 (329.9) o DDC368 o TS725 (392.2) o DDC369
[ EQ70 ]
C1 ENERGY= 330.2 kJ/mol ( -210.2635974 Hartree) Energy+ZPE= 327.8 kJ/mol ZPE= 0.0969609 CONNECTIONS: o TS206 (405.3) o EQ13 o TS385 (413.0) o EQ29 o TS673 (343.2) o EQ63 o TS726 (353.9) o EQ70 o TS727 (348.5) o EQ71 o TS728 (349.5) o EQ72 o TS729 (366.3) o EQ72 o TS730 (334.7) o EQ73 o TS731 (352.7) o EQ76 o TS732 (406.8) o DDC370 o TS733 (407.7) o DDC371 o TS734 (412.4) o DDC372 o TS735 (413.4) o DDC373 o TS736 (414.6) o DDC374 o TS737 (488.6) o DDC375 o UDC98 o o UDC99 o
[ EQ71 ]
C1 ENERGY= 331.0 kJ/mol ( -210.2633213 Hartree) Energy+ZPE= 328.2 kJ/mol ZPE= 0.0967916 CONNECTIONS: o TS7 (479.5) o EQ0 o TS44 (483.9) o EQ2 o TS207 (405.2) o EQ13 o TS662 (430.7) o EQ61 o TS727 (348.5) o EQ70 o TS738 (337.8) o EQ72 o TS739 (357.5) o EQ72 o TS740 (335.2) o EQ74 o TS741 (353.4) o EQ79 o TS742 (337.4) o DDC376 o UDC100 o
[ EQ72 ]
C1 ENERGY= 332.4 kJ/mol ( -210.2627894 Hartree) Energy+ZPE= 329.0 kJ/mol ZPE= 0.0965622 CONNECTIONS: o TS272 (525.0) o EQ18 o TS386 (413.4) o EQ29 o TS723 (441.8) o EQ69 o TS728 (349.5) o EQ70 o TS729 (366.3) o EQ70 o TS738 (337.8) o EQ71 o TS739 (357.5) o EQ71 o TS743 (342.6) o DDC377 o TS744 (396.7) o DDC378 o TS745 (557.1) o DDC379 o TS746 (607.4) o DDC380
[ EQ73 ]
Cs ENERGY= 334.4 kJ/mol ( -210.2620055 Hartree) Energy+ZPE= 330.7 kJ/mol ZPE= 0.0964520 CONNECTIONS: o TS394 (416.2) o EQ31 o TS730 (334.7) o EQ70
[ EQ74 ]
C1 ENERGY= 335.0 kJ/mol ( -210.2617866 Hartree) Energy+ZPE= 331.0 kJ/mol ZPE= 0.0963336 CONNECTIONS: o TS395 (415.6) o EQ31 o TS740 (335.2) o EQ71 o TS747 (340.2) o EQ74 o TS748 (475.9) o DDC381
[ EQ75 ]
C1 ENERGY= 336.4 kJ/mol ( -210.2612572 Hartree) Energy+ZPE= 321.9 kJ/mol ZPE= 0.0923224 CONNECTIONS: o TS185 (377.8) o EQ11
[ EQ76 ]
C1 ENERGY= 347.0 kJ/mol ( -210.2571993 Hartree) Energy+ZPE= 343.7 kJ/mol ZPE= 0.0965955 CONNECTIONS: o TS186 (488.9) o EQ11 o TS196 (414.7) o EQ12 o TS674 (348.9) o EQ63 o TS675 (352.0) o EQ63 o TS731 (352.7) o EQ70 o TS749 (381.8) o EQ79 o UDC101 o
[ EQ77 ]
C1 ENERGY= 347.6 kJ/mol ( -210.2570019 Hartree) Energy+ZPE= 341.7 kJ/mol ZPE= 0.0956250 CONNECTIONS: o TS341 (422.6) o EQ23 o TS624 (347.9) o EQ57 o TS750 (347.7) o EQ78 o TS751 (412.4) o DDC382
[ EQ78 ]
C1 ENERGY= 347.6 kJ/mol ( -210.2569787 Hartree) Energy+ZPE= 342.0 kJ/mol ZPE= 0.0957185 CONNECTIONS: o TS665 (349.4) o EQ62 o TS715 (350.6) o EQ67 o TS750 (347.7) o EQ77 o TS752 (429.0) o DDC383 o TS753 (550.2) o DDC384
[ EQ79 ]
C1 ENERGY= 348.2 kJ/mol ( -210.2567737 Hartree) Energy+ZPE= 344.4 kJ/mol ZPE= 0.0964314 CONNECTIONS: o TS187 (414.0) o EQ11 o TS197 (466.6) o EQ12 o TS741 (353.4) o EQ71 o TS749 (381.8) o EQ76 o TS754 (353.5) o DDC385 o TS755 (359.3) o DDC386 o TS756 (400.9) o DDC387 o UDC102 o
[ EQ80 ]
C1 ENERGY= 361.5 kJ/mol ( -210.2517117 Hartree) Energy+ZPE= 355.3 kJ/mol ZPE= 0.0955177 CONNECTIONS: o TS113 (378.9) o EQ7 o TS273 (411.8) o EQ18 o TS389 (403.6) o EQ30 o TS694 (438.3) o EQ65 o TS757 (392.1) o EQ81 o TS758 (388.0) o EQ83 o TS759 (416.0) o EQ83 o TS760 (404.8) o EQ89 o TS761 (408.0) o EQ90 o TS762 (372.1) o DDC388 o TS763 (394.1) o DDC389 o TS764 (401.4) o DDC390 o TS765 (506.3) o DDC391 o UDC103 o
[ EQ81 ]
C1 ENERGY= 364.0 kJ/mol ( -210.2507485 Hartree) Energy+ZPE= 358.0 kJ/mol ZPE= 0.0955665 CONNECTIONS: o TS114 (395.8) o EQ7 o TS757 (392.1) o EQ80 o TS766 (399.1) o EQ82 o TS767 (405.5) o EQ82 o TS768 (406.8) o EQ82 o TS769 (408.2) o EQ93 o TS770 (416.8) o EQ94 o TS771 (369.5) o DDC392 o TS772 (402.6) o DDC393 o TS773 (403.6) o DDC394
[ EQ82 ]
C1 ENERGY= 375.9 kJ/mol ( -210.2462181 Hartree) Energy+ZPE= 368.9 kJ/mol ZPE= 0.0952003 CONNECTIONS: o TS274 (409.6) o EQ18 o TS275 (514.2) o EQ18 o TS390 (508.1) o EQ30 o TS766 (399.1) o EQ81 o TS767 (405.5) o EQ81 o TS768 (406.8) o EQ81 o TS774 (416.6) o EQ83 o TS775 (382.2) o DDC395 o TS776 (409.9) o DDC396
[ EQ83 ]
C1 ENERGY= 376.9 kJ/mol ( -210.2458119 Hartree) Energy+ZPE= 369.6 kJ/mol ZPE= 0.0950913 CONNECTIONS: o TS758 (388.0) o EQ80 o TS759 (416.0) o EQ80 o TS774 (416.6) o EQ82 o TS777 (384.2) o DDC397 o TS778 (409.1) o DDC398 o TS779 (458.2) o DDC399
[ EQ84 ]
C1 ENERGY= 391.3 kJ/mol ( -210.2403554 Hartree) Energy+ZPE= 384.2 kJ/mol ZPE= 0.0951604 CONNECTIONS: o TS152 (418.8) o EQ9 o TS153 (496.6) o EQ9 o TS188 (459.2) o EQ11 o TS780 (410.4) o EQ85 o TS781 (410.3) o EQ92 o TS782 (408.4) o EQ97 o TS783 (412.4) o EQ98 o TS784 (393.3) o DDC400 o TS785 (411.9) o DDC401 o TS786 (469.4) o DDC402 o TS787 (515.5) o DDC403 o UDC104 o
[ EQ85 ]
C1 ENERGY= 393.7 kJ/mol ( -210.2394234 Hartree) Energy+ZPE= 385.5 kJ/mol ZPE= 0.0947262 CONNECTIONS: o TS154 (415.5) o EQ9 o TS155 (484.2) o EQ9 o TS233 (460.3) o EQ15 o TS246 (496.1) o EQ16 o TS780 (410.4) o EQ84 o TS788 (407.1) o EQ95 o TS789 (431.7) o EQ95 o TS790 (416.1) o EQ98 o TS791 (394.0) o DDC404 o TS792 (431.2) o DDC405 o TS793 (458.3) o DDC406 o TS794 (467.9) o DDC407
[ EQ86 ]
C1 ENERGY= 395.5 kJ/mol ( -210.2387467 Hartree) Energy+ZPE= 376.2 kJ/mol ZPE= 0.0904922 CONNECTIONS: o TS247 (395.6) o EQ16 o TS695 (416.2) o EQ65 o TS795 (404.7) o EQ96 o TS796 (399.8) o DDC408 o TS797 (403.8) o DDC409 o TS798 (407.5) o DDC410 o TS799 (490.7) o DDC411
[ EQ87 ]
C1 ENERGY= 397.0 kJ/mol ( -210.2381656 Hartree) Energy+ZPE= 378.7 kJ/mol ZPE= 0.0908848 CONNECTIONS: o TS276 (397.1) o EQ18 o TS800 (403.2) o EQ94 o TS801 (403.2) o DDC412 o TS802 (408.8) o DDC413
[ EQ88 ]
C1 ENERGY= 399.2 kJ/mol ( -210.2373377 Hartree) Energy+ZPE= 380.8 kJ/mol ZPE= 0.0908667 CONNECTIONS: o TS248 (399.3) o EQ16 o TS683 (409.3) o EQ64 o TS803 (401.7) o EQ93 o TS804 (404.4) o DDC414 o TS805 (412.1) o DDC415 o TS806 (488.3) o DDC416
[ EQ89 ]
C1 ENERGY= 400.0 kJ/mol ( -210.2370287 Hartree) Energy+ZPE= 384.9 kJ/mol ZPE= 0.0921045 CONNECTIONS: o TS249 (400.1) o EQ16 o TS760 (404.8) o EQ80 o TS807 (400.3) o EQ90
[ EQ90 ]
C1 ENERGY= 400.1 kJ/mol ( -210.2369792 Hartree) Energy+ZPE= 380.9 kJ/mol ZPE= 0.0905578 CONNECTIONS: o TS286 (401.0) o EQ19 o TS287 (519.6) o EQ19 o TS761 (408.0) o EQ80 o TS807 (400.3) o EQ89 o TS808 (403.5) o DDC417 o TS809 (409.7) o DDC418 o TS810 (410.9) o DDC419
[ EQ91 ]
Cs ENERGY= 400.8 kJ/mol ( -210.2367404 Hartree) Energy+ZPE= 386.0 kJ/mol ZPE= 0.0922359 CONNECTIONS: o TS443 (406.9) o EQ34 o TS503 (423.6) o EQ39 o TS811 (419.8) o EQ106 o TS812 (404.7) o DDC420 o TS813 (418.3) o DDC421 o TS814 (493.7) o DDC422
[ EQ92 ]
C1 ENERGY= 401.1 kJ/mol ( -210.2366287 Hartree) Energy+ZPE= 394.1 kJ/mol ZPE= 0.0952068 CONNECTIONS: o TS299 (432.3) o EQ20 o TS300 (494.8) o EQ20 o TS301 (503.6) o EQ20 o TS781 (410.3) o EQ84 o TS815 (412.2) o EQ100 o TS816 (416.8) o EQ104 o TS817 (437.7) o EQ104 o TS818 (477.4) o EQ104 o TS819 (420.5) o DDC423 o TS820 (436.2) o DDC424 o TS821 (472.9) o DDC425 o TS822 (546.0) o DDC426
[ EQ93 ]
C1 ENERGY= 401.6 kJ/mol ( -210.2364390 Hartree) Energy+ZPE= 383.8 kJ/mol ZPE= 0.0910743 CONNECTIONS: o TS221 (401.9) o EQ14 o TS222 (519.6) o EQ14 o TS696 (412.3) o EQ65 o TS697 (417.7) o EQ65 o TS769 (408.2) o EQ81 o TS803 (401.7) o EQ88 o TS823 (406.6) o DDC427 o TS824 (414.9) o DDC428 o TS825 (483.4) o DDC429
[ EQ94 ]
C1 ENERGY= 402.2 kJ/mol ( -210.2362052 Hartree) Energy+ZPE= 384.0 kJ/mol ZPE= 0.0909151 CONNECTIONS: o TS261 (402.8) o EQ17 o TS698 (432.1) o EQ65 o TS770 (416.8) o EQ81 o TS800 (403.2) o EQ87 o TS826 (406.2) o DDC430 o TS827 (412.9) o DDC431 o TS828 (503.2) o DDC432
[ EQ95 ]
C1 ENERGY= 402.4 kJ/mol ( -210.2361135 Hartree) Energy+ZPE= 394.8 kJ/mol ZPE= 0.0949520 CONNECTIONS: o TS788 (407.1) o EQ85 o TS789 (431.7) o EQ85 o TS829 (440.0) o EQ95 o TS830 (417.6) o EQ97 o TS831 (415.2) o EQ99 o TS832 (767.4) o EQ123 o TS833 (774.0) o EQ123 o TS834 (407.6) o DDC433
[ EQ96 ]
C1 ENERGY= 403.5 kJ/mol ( -210.2357018 Hartree) Energy+ZPE= 382.9 kJ/mol ZPE= 0.0900009 CONNECTIONS: o TS277 (403.7) o EQ18 o TS795 (404.7) o EQ86 o TS835 (404.7) o DDC434
[ EQ97 ]
C1 ENERGY= 405.0 kJ/mol ( -210.2351106 Hartree) Energy+ZPE= 397.2 kJ/mol ZPE= 0.0948739 CONNECTIONS: o TS782 (408.4) o EQ84 o TS830 (417.6) o EQ95 o TS836 (417.9) o EQ99 o TS837 (419.1) o EQ104 o TS838 (409.8) o DDC435
[ EQ98 ]
C1 ENERGY= 407.6 kJ/mol ( -210.2341366 Hartree) Energy+ZPE= 399.0 kJ/mol ZPE= 0.0945802 CONNECTIONS: o TS139 (414.5) o EQ8 o TS140 (495.2) o EQ8 o TS783 (412.4) o EQ84 o TS790 (416.1) o EQ85 o TS839 (409.9) o EQ99 o TS840 (415.2) o EQ100 o TS841 (446.3) o EQ100 o TS842 (460.4) o DDC436 o TS843 (509.9) o DDC437 o UDC105 o
[ EQ99 ]
C1 ENERGY= 409.1 kJ/mol ( -210.2335534 Hartree) Energy+ZPE= 400.2 kJ/mol ZPE= 0.0944897 CONNECTIONS: o TS831 (415.2) o EQ95 o TS836 (417.9) o EQ97 o TS839 (409.9) o EQ98 o TS844 (418.9) o EQ103 o TS845 (443.2) o EQ103 o TS846 (447.7) o DDC438
[ EQ100 ]
C1 ENERGY= 410.5 kJ/mol ( -210.2330267 Hartree) Energy+ZPE= 402.0 kJ/mol ZPE= 0.0946161 CONNECTIONS: o TS27 (483.7) o EQ1 o TS70 (491.5) o EQ4 o TS375 (430.6) o EQ27 o TS815 (412.2) o EQ92 o TS840 (415.2) o EQ98 o TS841 (446.3) o EQ98 o TS847 (427.2) o EQ100 o TS848 (416.1) o EQ103 o TS849 (439.5) o EQ103 o TS850 (465.6) o EQ103 o UDC106 o
[ EQ101 ]
C1 ENERGY= 413.9 kJ/mol ( -210.2317416 Hartree) Energy+ZPE= 393.5 kJ/mol ZPE= 0.0901000 CONNECTIONS: o TS616 (414.3) o EQ56 o TS851 (415.7) o DDC439 o TS852 (423.8) o DDC440
[ EQ102 ]
C1 ENERGY= 415.0 kJ/mol ( -210.2313096 Hartree) Energy+ZPE= 407.6 kJ/mol ZPE= 0.0950539 CONNECTIONS: o TS424 (553.4) o EQ33 o TS425 (580.4) o EQ33 o TS460 (430.4) o EQ35 o TS853 (429.7) o EQ102 o TS854 (434.3) o EQ105 o TS855 (435.9) o EQ105 o TS856 (427.8) o EQ107 o TS857 (445.1) o EQ110 o TS858 (446.2) o EQ110 o TS859 (449.3) o EQ111 o TS860 (548.8) o EQ115 o TS861 (544.7) o DDC441 o TS862 (665.9) o DDC442 o UDC107 o
[ EQ103 ]
C1 ENERGY= 415.2 kJ/mol ( -210.2312358 Hartree) Energy+ZPE= 406.1 kJ/mol ZPE= 0.0943813 CONNECTIONS: o TS844 (418.9) o EQ99 o TS845 (443.2) o EQ99 o TS848 (416.1) o EQ100 o TS849 (439.5) o EQ100 o TS850 (465.6) o EQ100 o TS863 (428.2) o EQ103 o TS864 (419.0) o EQ104 o TS865 (445.0) o DDC443 o TS866 (802.4) o DDC444 o TS867 (803.3) o DDC445
[ EQ104 ]
C1 ENERGY= 415.5 kJ/mol ( -210.2311092 Hartree) Energy+ZPE= 406.4 kJ/mol ZPE= 0.0943786 CONNECTIONS: o TS816 (416.8) o EQ92 o TS817 (437.7) o EQ92 o TS818 (477.4) o EQ92 o TS837 (419.1) o EQ97 o TS864 (419.0) o EQ103 o TS868 (547.3) o DDC446 o TS869 (797.4) o DDC447
[ EQ105 ]
C1 ENERGY= 417.2 kJ/mol ( -210.2304818 Hartree) Energy+ZPE= 409.3 kJ/mol ZPE= 0.0948462 CONNECTIONS: o TS8 (552.0) o EQ0 o TS115 (523.8) o EQ7 o TS408 (555.7) o EQ32 o TS461 (434.6) o EQ35 o TS521 (460.0) o EQ41 o TS854 (434.3) o EQ102 o TS855 (435.9) o EQ102 o TS870 (432.3) o EQ105 o TS871 (426.9) o EQ107 o TS872 (449.7) o EQ110 o TS873 (442.6) o EQ111 o TS874 (446.9) o EQ111 o TS875 (437.0) o DDC448 o TS876 (550.7) o DDC449 o TS877 (791.3) o DDC450
[ EQ106 ]
Cs ENERGY= 418.4 kJ/mol ( -210.2300233 Hartree) Energy+ZPE= 405.2 kJ/mol ZPE= 0.0928272 CONNECTIONS: o TS811 (419.8) o EQ91 o TS878 (426.4) o EQ106 o TS879 (507.1) o DDC451
[ EQ107 ]
C1 ENERGY= 419.5 kJ/mol ( -210.2296216 Hartree) Energy+ZPE= 411.2 kJ/mol ZPE= 0.0947069 CONNECTIONS: o TS482 (433.1) o EQ36 o TS491 (455.1) o EQ37 o TS856 (427.8) o EQ102 o TS871 (426.9) o EQ105 o TS880 (432.4) o EQ107 o TS881 (445.1) o EQ112 o TS882 (447.4) o EQ112 o TS883 (451.7) o EQ112 o TS884 (528.3) o DDC452 o TS885 (607.9) o DDC453
[ EQ108 ]
C1 ENERGY= 425.3 kJ/mol ( -210.2273854 Hartree) Energy+ZPE= 408.2 kJ/mol ZPE= 0.0913391 CONNECTIONS: o TS223 (436.5) o EQ14 o TS288 (439.1) o EQ19 o TS886 (446.4) o EQ108 o TS887 (449.1) o EQ109 o TS888 (450.0) o EQ109 o TS889 (449.4) o EQ113 o TS890 (473.4) o EQ113
[ EQ109 ]
C1 ENERGY= 426.2 kJ/mol ( -210.2270502 Hartree) Energy+ZPE= 408.0 kJ/mol ZPE= 0.0909215 CONNECTIONS: o TS887 (449.1) o EQ108 o TS888 (450.0) o EQ108 o TS891 (432.6) o DDC454 o TS892 (461.1) o DDC455
[ EQ110 ]
C1 ENERGY= 434.9 kJ/mol ( -210.2237372 Hartree) Energy+ZPE= 426.0 kJ/mol ZPE= 0.0944892 CONNECTIONS: o TS509 (606.3) o EQ40 o TS522 (455.0) o EQ41 o TS857 (445.1) o EQ102 o TS858 (446.2) o EQ102 o TS872 (449.7) o EQ105 o TS893 (447.6) o EQ110 o TS894 (451.2) o EQ111 o TS895 (445.2) o EQ112 o TS896 (459.4) o DDC456 o TS897 (684.8) o DDC457 o TS898 (767.0) o DDC458 o TS899 (828.2) o DDC459 o UDC108 o o UDC109 o
[ EQ111 ]
C1 ENERGY= 436.6 kJ/mol ( -210.2230892 Hartree) Energy+ZPE= 428.0 kJ/mol ZPE= 0.0945868 CONNECTIONS: o TS510 (580.3) o EQ40 o TS859 (449.3) o EQ102 o TS873 (442.6) o EQ105 o TS874 (446.9) o EQ105 o TS894 (451.2) o EQ110 o TS900 (451.6) o EQ111 o TS901 (447.5) o EQ112 o TS902 (574.8) o EQ114 o TS903 (671.8) o DDC460
[ EQ112 ]
C1 ENERGY= 437.4 kJ/mol ( -210.2227721 Hartree) Energy+ZPE= 428.3 kJ/mol ZPE= 0.0943795 CONNECTIONS: o TS504 (554.1) o EQ39 o TS881 (445.1) o EQ107 o TS882 (447.4) o EQ107 o TS883 (451.7) o EQ107 o TS895 (445.2) o EQ110 o TS901 (447.5) o EQ111 o TS904 (450.1) o EQ112 o TS905 (575.7) o EQ115 o TS906 (910.9) o DDC461 o UDC110 o o UDC111 o
[ EQ113 ]
C1 ENERGY= 448.7 kJ/mol ( -210.2184843 Hartree) Energy+ZPE= 429.9 kJ/mol ZPE= 0.0906915 CONNECTIONS: o TS889 (449.4) o EQ108 o TS890 (473.4) o EQ108 o TS907 (465.4) o EQ113 o TS908 (454.7) o DDC462
[ EQ114 ]
C1 ENERGY= 512.1 kJ/mol ( -210.1943419 Hartree) Energy+ZPE= 501.5 kJ/mol ZPE= 0.0938144 CONNECTIONS: o TS492 (537.8) o EQ37 o TS902 (574.8) o EQ111 o TS909 (528.7) o EQ114 o TS910 (539.6) o EQ115 o TS911 (544.3) o EQ117 o TS912 (578.7) o EQ117 o TS913 (521.3) o DDC463 o TS914 (530.4) o DDC464 o TS915 (551.1) o DDC465 o TS916 (605.9) o DDC466
[ EQ115 ]
C1 ENERGY= 514.6 kJ/mol ( -210.1933868 Hartree) Energy+ZPE= 503.8 kJ/mol ZPE= 0.0937431 CONNECTIONS: o TS860 (548.8) o EQ102 o TS905 (575.7) o EQ112 o TS910 (539.6) o EQ114 o TS917 (529.0) o EQ115 o TS918 (581.3) o EQ115 o TS919 (546.3) o EQ118 o TS920 (579.0) o EQ118 o TS921 (605.1) o EQ120 o TS922 (527.9) o DDC467 o TS923 (531.8) o DDC468 o TS924 (546.7) o DDC469 o TS925 (612.4) o DDC470 o TS926 (616.1) o DDC471 o TS927 (802.9) o DDC472
[ EQ116 ]
C1 ENERGY= 538.2 kJ/mol ( -210.1843864 Hartree) Energy+ZPE= 517.5 kJ/mol ZPE= 0.0899574 CONNECTIONS: o TS426 (538.6) o EQ33 o TS928 (548.4) o DDC473 o TS929 (552.6) o DDC474
[ EQ117 ]
C1 ENERGY= 539.6 kJ/mol ( -210.1838470 Hartree) Energy+ZPE= 527.1 kJ/mol ZPE= 0.0930952 CONNECTIONS: o TS483 (541.6) o EQ36 o TS911 (544.3) o EQ114 o TS912 (578.7) o EQ114
[ EQ118 ]
C1 ENERGY= 540.3 kJ/mol ( -210.1836085 Hartree) Energy+ZPE= 527.9 kJ/mol ZPE= 0.0931242 CONNECTIONS: o TS56 (675.0) o EQ3 o TS462 (544.8) o EQ35 o TS919 (546.3) o EQ115 o TS920 (579.0) o EQ115 o TS930 (552.9) o EQ118
[ EQ119 ]
C1 ENERGY= 551.1 kJ/mol ( -210.1794771 Hartree) Energy+ZPE= 526.5 kJ/mol ZPE= 0.0884728 CONNECTIONS: o TS931 (551.2) o DDC475 o TS932 (555.8) o DDC476 o TS933 (556.3) o DDC477 o TS934 (558.7) o DDC478 o TS935 (564.2) o DDC479
[ EQ120 ]
C1 ENERGY= 604.9 kJ/mol ( -210.1589950 Hartree) Energy+ZPE= 579.8 kJ/mol ZPE= 0.0883050 CONNECTIONS: o TS921 (605.1) o EQ115 o TS936 (612.2) o EQ120 o TS937 (605.1) o DDC480 o TS938 (615.6) o DDC481
[ EQ121 ]
C1 ENERGY= 651.5 kJ/mol ( -210.1412427 Hartree) Energy+ZPE= 635.2 kJ/mol ZPE= 0.0916354 CONNECTIONS: o TS663 (655.0) o EQ61 o TS939 (659.1) o EQ121 o TS940 (659.2) o EQ121 o TS941 (658.0) o EQ124 o TS942 (691.1) o EQ124 o TS943 (661.7) o EQ125 o TS944 (690.6) o DDC482 o TS945 (697.3) o DDC483 o TS946 (712.4) o DDC484
[ EQ122 ]
C1 ENERGY= 652.3 kJ/mol ( -210.1409333 Hartree) Energy+ZPE= 636.9 kJ/mol ZPE= 0.0919766 CONNECTIONS: o TS652 (660.0) o EQ60 o TS684 (657.6) o EQ64 o TS709 (686.6) o EQ66 o TS947 (657.6) o EQ122 o TS948 (661.0) o EQ124 o TS949 (656.9) o EQ125 o TS950 (691.2) o EQ125 o TS951 (660.6) o DDC485 o TS952 (667.5) o DDC486 o TS953 (701.3) o DDC487 o TS954 (706.6) o DDC488
[ EQ123 ]
C1 ENERGY= 652.5 kJ/mol ( -210.1408422 Hartree) Energy+ZPE= 642.4 kJ/mol ZPE= 0.0940149 CONNECTIONS: o TS302 (783.2) o EQ20 o TS555 (658.2) o EQ45 o TS832 (767.4) o EQ95 o TS833 (774.0) o EQ95 o TS955 (678.9) o EQ123 o TS956 (654.8) o DDC489 o TS957 (676.5) o DDC490 o TS958 (690.9) o DDC491 o TS959 (704.9) o DDC492
[ EQ124 ]
C1 ENERGY= 654.6 kJ/mol ( -210.1400615 Hartree) Energy+ZPE= 638.5 kJ/mol ZPE= 0.0917339 CONNECTIONS: o TS941 (658.0) o EQ121 o TS942 (691.1) o EQ121 o TS948 (661.0) o EQ122 o TS960 (662.8) o EQ124 o TS961 (661.8) o DDC493 o TS962 (681.2) o DDC494 o TS963 (693.1) o DDC495 o TS964 (699.9) o DDC496
[ EQ125 ]
C1 ENERGY= 655.8 kJ/mol ( -210.1395837 Hartree) Energy+ZPE= 640.0 kJ/mol ZPE= 0.0918365 CONNECTIONS: o TS699 (661.3) o EQ65 o TS943 (661.7) o EQ121 o TS949 (656.9) o EQ122 o TS950 (691.2) o EQ122 o TS965 (660.3) o EQ125 o TS966 (664.7) o DDC497 o TS967 (671.0) o DDC498 o TS968 (695.3) o DDC499 o TS969 (705.4) o DDC500 o TS970 (709.5) o DDC501
[ EQ126 ]
C1 ENERGY= 681.5 kJ/mol ( -210.1297948 Hartree) Energy+ZPE= 668.4 kJ/mol ZPE= 0.0928682 CONNECTIONS: o TS556 (751.7) o EQ45 o TS971 (681.7) o DDC502 o TS972 (690.2) o DDC503 o TS973 (724.6) o DDC504 o TS974 (840.5) o DDC505
[ TS0 ] Animation
C1 ENERGY= 14.7 kJ/mol Energy+ZPE= 14.0 kJ/mol ZPE= 0.0975904 CONNECTIONS: o EQ0 o EQ0
[ TS1 ] Animation
C1 ENERGY= 5.6 kJ/mol Energy+ZPE= 4.0 kJ/mol ZPE= 0.0972658 CONNECTIONS: o EQ0 o EQ2
[ TS2 ] Animation
C1 ENERGY= 9.4 kJ/mol Energy+ZPE= 7.5 kJ/mol ZPE= 0.0971494 CONNECTIONS: o EQ0 o EQ3
[ TS3 ] Animation
C1 ENERGY= 18.2 kJ/mol Energy+ZPE= 14.2 kJ/mol ZPE= 0.0963361 CONNECTIONS: o EQ0 o EQ4
[ TS4 ] Animation
C1 ENERGY= 19.5 kJ/mol Energy+ZPE= 17.8 kJ/mol ZPE= 0.0972204 CONNECTIONS: o EQ0 o EQ4
[ TS5 ] Animation
C1 ENERGY= 24.8 kJ/mol Energy+ZPE= 22.6 kJ/mol ZPE= 0.0970225 CONNECTIONS: o EQ0 o EQ4
[ TS6 ] Animation
C1 ENERGY= 481.3 kJ/mol Energy+ZPE= 468.9 kJ/mol ZPE= 0.0931229 CONNECTIONS: o EQ0 o EQ61
[ TS7 ] Animation
C1 ENERGY= 479.5 kJ/mol Energy+ZPE= 458.2 kJ/mol ZPE= 0.0897448 CONNECTIONS: o EQ0 o EQ71
[ TS8 ] Animation
C1 ENERGY= 552.0 kJ/mol Energy+ZPE= 530.7 kJ/mol ZPE= 0.0897499 CONNECTIONS: o EQ0 o EQ105
[ TS9 ] Animation
C1 ENERGY= 236.3 kJ/mol Energy+ZPE= 216.8 kJ/mol ZPE= 0.0904385 CONNECTIONS: o EQ0 o DDC0
[ TS10 ] Animation
C1 ENERGY= 260.2 kJ/mol Energy+ZPE= 238.6 kJ/mol ZPE= 0.0896420 CONNECTIONS: o EQ0 o DDC1
[ TS11 ] Animation
C1 ENERGY= 333.5 kJ/mol Energy+ZPE= 311.1 kJ/mol ZPE= 0.0893343 CONNECTIONS: o EQ0 o DDC2
[ TS12 ] Animation
C1 ENERGY= 461.0 kJ/mol Energy+ZPE= 444.6 kJ/mol ZPE= 0.0916201 CONNECTIONS: o EQ0 o DDC3
[ TS13 ] Animation
C1 ENERGY= 468.2 kJ/mol Energy+ZPE= 439.3 kJ/mol ZPE= 0.0868476 CONNECTIONS: o EQ0 o DDC4
[ TS14 ] Animation
C1 ENERGY= 470.0 kJ/mol Energy+ZPE= 433.3 kJ/mol ZPE= 0.0838912 CONNECTIONS: o EQ0 o DDC5
[ TS15 ] Animation
C1 ENERGY= 492.3 kJ/mol Energy+ZPE= 460.3 kJ/mol ZPE= 0.0856620 CONNECTIONS: o EQ0 o DDC6
[ TS16 ] Animation
C1 ENERGY= 498.3 kJ/mol Energy+ZPE= 460.7 kJ/mol ZPE= 0.0835426 CONNECTIONS: o EQ0 o DDC7
[ TS17 ] Animation
C1 ENERGY= 503.4 kJ/mol Energy+ZPE= 487.4 kJ/mol ZPE= 0.0917520 CONNECTIONS: o EQ0 o DDC8
[ TS18 ] Animation
C1 ENERGY= 16.2 kJ/mol Energy+ZPE= 15.4 kJ/mol ZPE= 0.0975672 CONNECTIONS: o EQ1 o EQ1
[ TS19 ] Animation
C1 ENERGY= 32.5 kJ/mol Energy+ZPE= 29.5 kJ/mol ZPE= 0.0967077 CONNECTIONS: o EQ1 o EQ1
[ TS20 ] Animation
C1 ENERGY= 18.7 kJ/mol Energy+ZPE= 14.8 kJ/mol ZPE= 0.0963792 CONNECTIONS: o EQ1 o EQ3
[ TS21 ] Animation
C1 ENERGY= 20.1 kJ/mol Energy+ZPE= 18.5 kJ/mol ZPE= 0.0972398 CONNECTIONS: o EQ1 o EQ3
[ TS22 ] Animation
C1 ENERGY= 24.3 kJ/mol Energy+ZPE= 21.9 kJ/mol ZPE= 0.0969619 CONNECTIONS: o EQ1 o EQ3
[ TS23 ] Animation
C1 ENERGY= 9.3 kJ/mol Energy+ZPE= 7.5 kJ/mol ZPE= 0.0971649 CONNECTIONS: o EQ1 o EQ4
[ TS24 ] Animation
C1 ENERGY= 538.2 kJ/mol Energy+ZPE= 503.9 kJ/mol ZPE= 0.0848090 CONNECTIONS: o EQ1 o EQ4
[ TS25 ] Animation
C1 ENERGY= 22.5 kJ/mol Energy+ZPE= 19.9 kJ/mol ZPE= 0.0968564 CONNECTIONS: o EQ1 o EQ5
[ TS26 ] Animation
C1 ENERGY= 24.0 kJ/mol Energy+ZPE= 21.0 kJ/mol ZPE= 0.0967024 CONNECTIONS: o EQ1 o EQ6
[ TS27 ] Animation
C1 ENERGY= 483.7 kJ/mol Energy+ZPE= 460.5 kJ/mol ZPE= 0.0890296 CONNECTIONS: o EQ1 o EQ100
[ TS28 ] Animation
C1 ENERGY= 170.0 kJ/mol Energy+ZPE= 154.3 kJ/mol ZPE= 0.0918804 CONNECTIONS: o EQ1 o DDC9
[ TS29 ] Animation
C1 ENERGY= 324.5 kJ/mol Energy+ZPE= 303.0 kJ/mol ZPE= 0.0896849 CONNECTIONS: o EQ1 o DDC10
[ TS30 ] Animation
C1 ENERGY= 340.7 kJ/mol Energy+ZPE= 318.5 kJ/mol ZPE= 0.0893869 CONNECTIONS: o EQ1 o DDC11
[ TS31 ] Animation
C1 ENERGY= 394.2 kJ/mol Energy+ZPE= 364.3 kJ/mol ZPE= 0.0864666 CONNECTIONS: o EQ1 o DDC12
[ TS32 ] Animation
C1 ENERGY= 448.5 kJ/mol Energy+ZPE= 412.5 kJ/mol ZPE= 0.0841492 CONNECTIONS: o EQ1 o DDC13
[ TS33 ] Animation
C1 ENERGY= 467.2 kJ/mol Energy+ZPE= 436.4 kJ/mol ZPE= 0.0861302 CONNECTIONS: o EQ1 o DDC14
[ TS34 ] Animation
C1 ENERGY= 481.7 kJ/mol Energy+ZPE= 447.1 kJ/mol ZPE= 0.0846902 CONNECTIONS: o EQ1 o DDC15
[ TS35 ] Animation
C1 ENERGY= 483.5 kJ/mol Energy+ZPE= 460.4 kJ/mol ZPE= 0.0890506 CONNECTIONS: o EQ1 o DDC16
[ TS36 ] Animation
C1 ENERGY= 495.3 kJ/mol Energy+ZPE= 460.1 kJ/mol ZPE= 0.0844549 CONNECTIONS: o EQ1 o DDC17
[ TS37 ] Animation
C1 ENERGY= 15.9 kJ/mol Energy+ZPE= 14.7 kJ/mol ZPE= 0.0973990 CONNECTIONS: o EQ2 o EQ2
[ TS38 ] Animation
C1 ENERGY= 6.1 kJ/mol Energy+ZPE= 4.4 kJ/mol ZPE= 0.0971985 CONNECTIONS: o EQ2 o EQ3
[ TS39 ] Animation
C1 ENERGY= 22.8 kJ/mol Energy+ZPE= 20.1 kJ/mol ZPE= 0.0968509 CONNECTIONS: o EQ2 o EQ5
[ TS40 ] Animation
C1 ENERGY= 30.3 kJ/mol Energy+ZPE= 25.1 kJ/mol ZPE= 0.0958889 CONNECTIONS: o EQ2 o EQ5
[ TS41 ] Animation
C1 ENERGY= 24.2 kJ/mol Energy+ZPE= 21.4 kJ/mol ZPE= 0.0967877 CONNECTIONS: o EQ2 o EQ6
[ TS42 ] Animation
C1 ENERGY= 251.9 kJ/mol Energy+ZPE= 232.1 kJ/mol ZPE= 0.0903086 CONNECTIONS: o EQ2 o EQ42
[ TS43 ] Animation
C1 ENERGY= 487.6 kJ/mol Energy+ZPE= 473.4 kJ/mol ZPE= 0.0924464 CONNECTIONS: o EQ2 o EQ61
[ TS44 ] Animation
C1 ENERGY= 483.9 kJ/mol Energy+ZPE= 461.1 kJ/mol ZPE= 0.0891849 CONNECTIONS: o EQ2 o EQ71
[ TS45 ] Animation
C1 ENERGY= 232.2 kJ/mol Energy+ZPE= 212.2 kJ/mol ZPE= 0.0902333 CONNECTIONS: o EQ2 o DDC18
[ TS46 ] Animation
C1 ENERGY= 234.8 kJ/mol Energy+ZPE= 215.1 kJ/mol ZPE= 0.0903485 CONNECTIONS: o EQ2 o DDC19
[ TS47 ] Animation
C1 ENERGY= 258.5 kJ/mol Energy+ZPE= 237.4 kJ/mol ZPE= 0.0898391 CONNECTIONS: o EQ2 o DDC20
[ TS48 ] Animation
C1 ENERGY= 440.7 kJ/mol Energy+ZPE= 413.5 kJ/mol ZPE= 0.0875167 CONNECTIONS: o EQ2 o DDC21
[ TS49 ] Animation
C1 ENERGY= 479.0 kJ/mol Energy+ZPE= 443.8 kJ/mol ZPE= 0.0844661 CONNECTIONS: o EQ2 o DDC22
[ TS50 ] Animation
C1 ENERGY= 484.3 kJ/mol Energy+ZPE= 453.6 kJ/mol ZPE= 0.0861518 CONNECTIONS: o EQ2 o DDC23
[ TS51 ] Animation
C1 ENERGY= 487.9 kJ/mol Energy+ZPE= 464.4 kJ/mol ZPE= 0.0889089 CONNECTIONS: o EQ2 o DDC24
[ TS52 ] Animation
C1 ENERGY= 490.7 kJ/mol Energy+ZPE= 465.9 kJ/mol ZPE= 0.0884112 CONNECTIONS: o EQ2 o DDC25
[ TS53 ] Animation
C1 ENERGY= 503.0 kJ/mol Energy+ZPE= 487.3 kJ/mol ZPE= 0.0918917 CONNECTIONS: o EQ2 o DDC26
[ TS54 ] Animation
C1 ENERGY= 14.1 kJ/mol Energy+ZPE= 13.4 kJ/mol ZPE= 0.0976013 CONNECTIONS: o EQ3 o EQ3
[ TS55 ] Animation
C1 ENERGY= 251.4 kJ/mol Energy+ZPE= 231.5 kJ/mol ZPE= 0.0902913 CONNECTIONS: o EQ3 o EQ42
[ TS56 ] Animation
C1 ENERGY= 675.0 kJ/mol Energy+ZPE= 655.4 kJ/mol ZPE= 0.0903865 CONNECTIONS: o EQ3 o EQ118
[ TS57 ] Animation
C1 ENERGY= 238.2 kJ/mol Energy+ZPE= 218.7 kJ/mol ZPE= 0.0904380 CONNECTIONS: o EQ3 o DDC27
[ TS58 ] Animation
C1 ENERGY= 330.0 kJ/mol Energy+ZPE= 305.0 kJ/mol ZPE= 0.0883572 CONNECTIONS: o EQ3 o DDC28
[ TS59 ] Animation
C1 ENERGY= 405.4 kJ/mol Energy+ZPE= 385.1 kJ/mol ZPE= 0.0901134 CONNECTIONS: o EQ3 o DDC29
[ TS60 ] Animation
C1 ENERGY= 470.2 kJ/mol Energy+ZPE= 443.6 kJ/mol ZPE= 0.0877115 CONNECTIONS: o EQ3 o DDC30
[ TS61 ] Animation
C1 ENERGY= 481.0 kJ/mol Energy+ZPE= 449.8 kJ/mol ZPE= 0.0859698 CONNECTIONS: o EQ3 o DDC31
[ TS62 ] Animation
C1 ENERGY= 485.8 kJ/mol Energy+ZPE= 461.9 kJ/mol ZPE= 0.0887529 CONNECTIONS: o EQ3 o DDC32
[ TS63 ] Animation
C1 ENERGY= 487.6 kJ/mol Energy+ZPE= 463.7 kJ/mol ZPE= 0.0887579 CONNECTIONS: o EQ3 o DDC33
[ TS64 ] Animation
C1 ENERGY= 502.8 kJ/mol Energy+ZPE= 464.6 kJ/mol ZPE= 0.0833021 CONNECTIONS: o EQ3 o DDC34
[ TS65 ] Animation
C1 ENERGY= 520.9 kJ/mol Energy+ZPE= 484.6 kJ/mol ZPE= 0.0840351 CONNECTIONS: o EQ3 o DDC35
[ TS66 ] Animation
C1 ENERGY= 15.6 kJ/mol Energy+ZPE= 15.0 kJ/mol ZPE= 0.0976481 CONNECTIONS: o EQ4 o EQ4
[ TS67 ] Animation
C1 ENERGY= 21.7 kJ/mol Energy+ZPE= 19.0 kJ/mol ZPE= 0.0968378 CONNECTIONS: o EQ4 o EQ5
[ TS68 ] Animation
C1 ENERGY= 23.6 kJ/mol Energy+ZPE= 21.0 kJ/mol ZPE= 0.0968871 CONNECTIONS: o EQ4 o EQ6
[ TS69 ] Animation
C1 ENERGY= 519.9 kJ/mol Energy+ZPE= 504.8 kJ/mol ZPE= 0.0921165 CONNECTIONS: o EQ4 o EQ59
[ TS70 ] Animation
C1 ENERGY= 491.5 kJ/mol Energy+ZPE= 466.7 kJ/mol ZPE= 0.0884143 CONNECTIONS: o EQ4 o EQ100
[ TS71 ] Animation
C1 ENERGY= 311.7 kJ/mol Energy+ZPE= 295.6 kJ/mol ZPE= 0.0917381 CONNECTIONS: o EQ4 o DDC36
[ TS72 ] Animation
C1 ENERGY= 343.7 kJ/mol Energy+ZPE= 321.0 kJ/mol ZPE= 0.0892224 CONNECTIONS: o EQ4 o DDC37
[ TS73 ] Animation
C1 ENERGY= 389.0 kJ/mol Energy+ZPE= 372.6 kJ/mol ZPE= 0.0916136 CONNECTIONS: o EQ4 o DDC38
[ TS74 ] Animation
C1 ENERGY= 404.8 kJ/mol Energy+ZPE= 379.0 kJ/mol ZPE= 0.0880494 CONNECTIONS: o EQ4 o DDC39
[ TS75 ] Animation
C1 ENERGY= 459.4 kJ/mol Energy+ZPE= 425.9 kJ/mol ZPE= 0.0850884 CONNECTIONS: o EQ4 o DDC40
[ TS76 ] Animation
C1 ENERGY= 461.6 kJ/mol Energy+ZPE= 444.5 kJ/mol ZPE= 0.0913338 CONNECTIONS: o EQ4 o DDC41
[ TS77 ] Animation
C1 ENERGY= 476.5 kJ/mol Energy+ZPE= 446.5 kJ/mol ZPE= 0.0864440 CONNECTIONS: o EQ4 o DDC42
[ TS78 ] Animation
C1 ENERGY= 476.9 kJ/mol Energy+ZPE= 446.6 kJ/mol ZPE= 0.0863359 CONNECTIONS: o EQ4 o DDC43
[ TS79 ] Animation
C1 ENERGY= 490.7 kJ/mol Energy+ZPE= 459.8 kJ/mol ZPE= 0.0861002 CONNECTIONS: o EQ4 o DDC44
[ TS80 ] Animation
C1 ENERGY= 491.0 kJ/mol Energy+ZPE= 454.7 kJ/mol ZPE= 0.0840194 CONNECTIONS: o EQ4 o DDC45
[ TS81 ] Animation
C1 ENERGY= 33.4 kJ/mol Energy+ZPE= 31.2 kJ/mol ZPE= 0.0970084 CONNECTIONS: o EQ5 o EQ5
[ TS82 ] Animation
C1 ENERGY= 26.5 kJ/mol Energy+ZPE= 23.9 kJ/mol ZPE= 0.0968842 CONNECTIONS: o EQ5 o EQ6
[ TS83 ] Animation
C1 ENERGY= 606.5 kJ/mol Energy+ZPE= 574.0 kJ/mol ZPE= 0.0854921 CONNECTIONS: o EQ5 o EQ28
[ TS84 ] Animation
C1 ENERGY= 562.4 kJ/mol Energy+ZPE= 532.7 kJ/mol ZPE= 0.0865660 CONNECTIONS: o EQ5 o EQ35
[ TS85 ] Animation
C1 ENERGY= 309.5 kJ/mol Energy+ZPE= 280.1 kJ/mol ZPE= 0.0866799 CONNECTIONS: o EQ5 o DDC46
[ TS86 ] Animation
C1 ENERGY= 387.1 kJ/mol Energy+ZPE= 359.0 kJ/mol ZPE= 0.0871534 CONNECTIONS: o EQ5 o DDC47
[ TS87 ] Animation
C1 ENERGY= 481.1 kJ/mol Energy+ZPE= 446.8 kJ/mol ZPE= 0.0847860 CONNECTIONS: o EQ5 o DDC48
[ TS88 ] Animation
C1 ENERGY= 487.5 kJ/mol Energy+ZPE= 452.4 kJ/mol ZPE= 0.0845077 CONNECTIONS: o EQ5 o DDC49
[ TS89 ] Animation
C1 ENERGY= 505.1 kJ/mol Energy+ZPE= 481.0 kJ/mol ZPE= 0.0886752 CONNECTIONS: o EQ5 o DDC50
[ TS90 ] Animation
C1 ENERGY= 38.5 kJ/mol Energy+ZPE= 35.9 kJ/mol ZPE= 0.0968879 CONNECTIONS: o EQ6 o EQ6
[ TS91 ] Animation
C1 ENERGY= 313.2 kJ/mol Energy+ZPE= 288.4 kJ/mol ZPE= 0.0883958 CONNECTIONS: o EQ6 o DDC51
[ TS92 ] Animation
C1 ENERGY= 328.7 kJ/mol Energy+ZPE= 307.3 kJ/mol ZPE= 0.0896922 CONNECTIONS: o EQ6 o DDC52
[ TS93 ] Animation
C1 ENERGY= 477.4 kJ/mol Energy+ZPE= 445.8 kJ/mol ZPE= 0.0858387 CONNECTIONS: o EQ6 o DDC53
[ TS94 ] Animation
C1 ENERGY= 493.2 kJ/mol Energy+ZPE= 458.2 kJ/mol ZPE= 0.0845122 CONNECTIONS: o EQ6 o DDC54
[ TS95 ] Animation
C1 ENERGY= 501.8 kJ/mol Energy+ZPE= 469.7 kJ/mol ZPE= 0.0856503 CONNECTIONS: o EQ6 o DDC55
[ TS96 ] Animation
C1 ENERGY= 45.2 kJ/mol Energy+ZPE= 47.9 kJ/mol ZPE= 0.0988932 CONNECTIONS: o EQ7 o EQ7
[ TS97 ] Animation
Cs ENERGY= 219.2 kJ/mol Energy+ZPE= 217.4 kJ/mol ZPE= 0.0971708 CONNECTIONS: o EQ7 o EQ7
[ TS98 ] Animation
C1 ENERGY= 504.3 kJ/mol Energy+ZPE= 483.3 kJ/mol ZPE= 0.0898438 CONNECTIONS: o EQ7 o EQ7
[ TS99 ] Animation
C1 ENERGY= 48.9 kJ/mol Energy+ZPE= 48.6 kJ/mol ZPE= 0.0977422 CONNECTIONS: o EQ7 o EQ14
[ TS100 ] Animation
C1 ENERGY= 53.3 kJ/mol Energy+ZPE= 52.6 kJ/mol ZPE= 0.0975798 CONNECTIONS: o EQ7 o EQ17
[ TS101 ] Animation
C1 ENERGY= 55.5 kJ/mol Energy+ZPE= 54.6 kJ/mol ZPE= 0.0975195 CONNECTIONS: o EQ7 o EQ17
[ TS102 ] Animation
C1 ENERGY= 39.0 kJ/mol Energy+ZPE= 39.5 kJ/mol ZPE= 0.0980474 CONNECTIONS: o EQ7 o EQ18
[ TS103 ] Animation
C1 ENERGY= 50.5 kJ/mol Energy+ZPE= 48.9 kJ/mol ZPE= 0.0972655 CONNECTIONS: o EQ7 o EQ19
[ TS104 ] Animation
C1 ENERGY= 53.7 kJ/mol Energy+ZPE= 53.1 kJ/mol ZPE= 0.0976190 CONNECTIONS: o EQ7 o EQ19
[ TS105 ] Animation
C1 ENERGY= 56.5 kJ/mol Energy+ZPE= 55.9 kJ/mol ZPE= 0.0976155 CONNECTIONS: o EQ7 o EQ19
[ TS106 ] Animation
C1 ENERGY= 56.0 kJ/mol Energy+ZPE= 56.7 kJ/mol ZPE= 0.0981452 CONNECTIONS: o EQ7 o EQ22
[ TS107 ] Animation
C1 ENERGY= 57.8 kJ/mol Energy+ZPE= 57.8 kJ/mol ZPE= 0.0978786 CONNECTIONS: o EQ7 o EQ24
[ TS108 ] Animation
C1 ENERGY= 61.5 kJ/mol Energy+ZPE= 61.7 kJ/mol ZPE= 0.0979415 CONNECTIONS: o EQ7 o EQ24
[ TS109 ] Animation
C1 ENERGY= 53.3 kJ/mol Energy+ZPE= 52.0 kJ/mol ZPE= 0.0973743 CONNECTIONS: o EQ7 o EQ30
[ TS110 ] Animation
C1 ENERGY= 57.2 kJ/mol Energy+ZPE= 55.9 kJ/mol ZPE= 0.0973595 CONNECTIONS: o EQ7 o EQ30
[ TS111 ] Animation
C1 ENERGY= 373.2 kJ/mol Energy+ZPE= 362.5 kJ/mol ZPE= 0.0937777 CONNECTIONS: o EQ7 o EQ55
[ TS112 ] Animation
C1 ENERGY= 313.8 kJ/mol Energy+ZPE= 303.5 kJ/mol ZPE= 0.0939308 CONNECTIONS: o EQ7 o EQ58
[ TS113 ] Animation
C1 ENERGY= 378.9 kJ/mol Energy+ZPE= 362.9 kJ/mol ZPE= 0.0917718 CONNECTIONS: o EQ7 o EQ80
[ TS114 ] Animation
C1 ENERGY= 395.8 kJ/mol Energy+ZPE= 379.8 kJ/mol ZPE= 0.0917577 CONNECTIONS: o EQ7 o EQ81
[ TS115 ] Animation
C1 ENERGY= 523.8 kJ/mol Energy+ZPE= 502.8 kJ/mol ZPE= 0.0898800 CONNECTIONS: o EQ7 o EQ105
[ TS116 ] Animation
C1 ENERGY= 298.7 kJ/mol Energy+ZPE= 278.7 kJ/mol ZPE= 0.0902513 CONNECTIONS: o EQ7 o DDC56
[ TS117 ] Animation
C1 ENERGY= 305.8 kJ/mol Energy+ZPE= 289.2 kJ/mol ZPE= 0.0915489 CONNECTIONS: o EQ7 o DDC57
[ TS118 ] Animation
C1 ENERGY= 337.2 kJ/mol Energy+ZPE= 323.6 kJ/mol ZPE= 0.0926840 CONNECTIONS: o EQ7 o DDC58
[ TS119 ] Animation
C1 ENERGY= 340.9 kJ/mol Energy+ZPE= 319.8 kJ/mol ZPE= 0.0898101 CONNECTIONS: o EQ7 o DDC59
[ TS120 ] Animation
C1 ENERGY= 344.6 kJ/mol Energy+ZPE= 322.9 kJ/mol ZPE= 0.0895877 CONNECTIONS: o EQ7 o DDC60
[ TS121 ] Animation
C1 ENERGY= 353.7 kJ/mol Energy+ZPE= 336.3 kJ/mol ZPE= 0.0912470 CONNECTIONS: o EQ7 o DDC61
[ TS122 ] Animation
C1 ENERGY= 383.5 kJ/mol Energy+ZPE= 365.0 kJ/mol ZPE= 0.0908284 CONNECTIONS: o EQ7 o DDC62
[ TS123 ] Animation
C1 ENERGY= 386.9 kJ/mol Energy+ZPE= 362.6 kJ/mol ZPE= 0.0886182 CONNECTIONS: o EQ7 o DDC63
[ TS124 ] Animation
C1 ENERGY= 388.5 kJ/mol Energy+ZPE= 361.0 kJ/mol ZPE= 0.0873883 CONNECTIONS: o EQ7 o DDC64
[ TS125 ] Animation
C1 ENERGY= 397.3 kJ/mol Energy+ZPE= 369.6 kJ/mol ZPE= 0.0873248 CONNECTIONS: o EQ7 o DDC65
[ TS126 ] Animation
C1 ENERGY= 407.8 kJ/mol Energy+ZPE= 384.9 kJ/mol ZPE= 0.0891460 CONNECTIONS: o EQ7 o DDC66
[ TS127 ] Animation
C1 ENERGY= 440.4 kJ/mol Energy+ZPE= 412.6 kJ/mol ZPE= 0.0872750 CONNECTIONS: o EQ7 o DDC67
[ TS128 ] Animation
C1 ENERGY= 449.6 kJ/mol Energy+ZPE= 430.8 kJ/mol ZPE= 0.0907064 CONNECTIONS: o EQ7 o DDC68
[ TS129 ] Animation
C1 ENERGY= 483.6 kJ/mol Energy+ZPE= 467.7 kJ/mol ZPE= 0.0917880 CONNECTIONS: o EQ7 o DDC69
[ TS130 ] Animation
C1 ENERGY= 493.7 kJ/mol Energy+ZPE= 476.8 kJ/mol ZPE= 0.0914133 CONNECTIONS: o EQ7 o DDC70
[ TS131 ] Animation
C1 ENERGY= 517.8 kJ/mol Energy+ZPE= 480.4 kJ/mol ZPE= 0.0836157 CONNECTIONS: o EQ7 o DDC71
[ TS132 ] Animation
C1 ENERGY= 518.0 kJ/mol Energy+ZPE= 484.8 kJ/mol ZPE= 0.0852179 CONNECTIONS: o EQ7 o DDC72
[ TS133 ] Animation
Cs ENERGY= 38.7 kJ/mol Energy+ZPE= 38.9 kJ/mol ZPE= 0.0979321 CONNECTIONS: o EQ8 o EQ8
[ TS134 ] Animation
Cs ENERGY= 473.9 kJ/mol Energy+ZPE= 449.6 kJ/mol ZPE= 0.0886083 CONNECTIONS: o EQ8 o EQ8
[ TS135 ] Animation
C1 ENERGY= 38.0 kJ/mol Energy+ZPE= 38.7 kJ/mol ZPE= 0.0981191 CONNECTIONS: o EQ8 o EQ9
[ TS136 ] Animation
Cs ENERGY= 55.0 kJ/mol Energy+ZPE= 51.4 kJ/mol ZPE= 0.0964774 CONNECTIONS: o EQ8 o EQ27
[ TS137 ] Animation
C1 ENERGY= 56.1 kJ/mol Energy+ZPE= 55.0 kJ/mol ZPE= 0.0974251 CONNECTIONS: o EQ8 o EQ27
[ TS138 ] Animation
C1 ENERGY= 288.0 kJ/mol Energy+ZPE= 269.0 kJ/mol ZPE= 0.0906375 CONNECTIONS: o EQ8 o EQ45
[ TS139 ] Animation
C1 ENERGY= 414.5 kJ/mol Energy+ZPE= 398.5 kJ/mol ZPE= 0.0917619 CONNECTIONS: o EQ8 o EQ98
[ TS140 ] Animation
C1 ENERGY= 495.2 kJ/mol Energy+ZPE= 476.7 kJ/mol ZPE= 0.0908024 CONNECTIONS: o EQ8 o EQ98
[ TS141 ] Animation
C1 ENERGY= 273.8 kJ/mol Energy+ZPE= 254.2 kJ/mol ZPE= 0.0903817 CONNECTIONS: o EQ8 o DDC73
[ TS142 ] Animation
C1 ENERGY= 383.7 kJ/mol Energy+ZPE= 354.7 kJ/mol ZPE= 0.0868170 CONNECTIONS: o EQ8 o DDC74
[ TS143 ] Animation
C1 ENERGY= 409.6 kJ/mol Energy+ZPE= 382.0 kJ/mol ZPE= 0.0873454 CONNECTIONS: o EQ8 o DDC75
[ TS144 ] Animation
C1 ENERGY= 412.1 kJ/mol Energy+ZPE= 384.6 kJ/mol ZPE= 0.0873782 CONNECTIONS: o EQ8 o DDC76
[ TS145 ] Animation
C1 ENERGY= 501.6 kJ/mol Energy+ZPE= 464.2 kJ/mol ZPE= 0.0836095 CONNECTIONS: o EQ8 o DDC77
[ TS146 ] Animation
C1 ENERGY= 38.5 kJ/mol Energy+ZPE= 39.1 kJ/mol ZPE= 0.0980754 CONNECTIONS: o EQ9 o EQ9
[ TS147 ] Animation
Cs ENERGY= 52.9 kJ/mol Energy+ZPE= 53.6 kJ/mol ZPE= 0.0981409 CONNECTIONS: o EQ9 o EQ9
[ TS148 ] Animation
C1 ENERGY= 48.3 kJ/mol Energy+ZPE= 46.1 kJ/mol ZPE= 0.0970041 CONNECTIONS: o EQ9 o EQ20
[ TS149 ] Animation
C1 ENERGY= 56.5 kJ/mol Energy+ZPE= 56.0 kJ/mol ZPE= 0.0976821 CONNECTIONS: o EQ9 o EQ20
[ TS150 ] Animation
C1 ENERGY= 60.9 kJ/mol Energy+ZPE= 59.9 kJ/mol ZPE= 0.0974826 CONNECTIONS: o EQ9 o EQ20
[ TS151 ] Animation
C1 ENERGY= 286.4 kJ/mol Energy+ZPE= 266.8 kJ/mol ZPE= 0.0904009 CONNECTIONS: o EQ9 o EQ45
[ TS152 ] Animation
C1 ENERGY= 418.8 kJ/mol Energy+ZPE= 402.1 kJ/mol ZPE= 0.0915083 CONNECTIONS: o EQ9 o EQ84
[ TS153 ] Animation
C1 ENERGY= 496.6 kJ/mol Energy+ZPE= 478.3 kJ/mol ZPE= 0.0908809 CONNECTIONS: o EQ9 o EQ84
[ TS154 ] Animation
C1 ENERGY= 415.5 kJ/mol Energy+ZPE= 399.2 kJ/mol ZPE= 0.0916488 CONNECTIONS: o EQ9 o EQ85
[ TS155 ] Animation
C1 ENERGY= 484.2 kJ/mol Energy+ZPE= 465.8 kJ/mol ZPE= 0.0908387 CONNECTIONS: o EQ9 o EQ85
[ TS156 ] Animation
C1 ENERGY= 322.4 kJ/mol Energy+ZPE= 292.7 kJ/mol ZPE= 0.0865568 CONNECTIONS: o EQ9 o DDC78
[ TS157 ] Animation
C1 ENERGY= 374.3 kJ/mol Energy+ZPE= 352.2 kJ/mol ZPE= 0.0894574 CONNECTIONS: o EQ9 o DDC79
[ TS158 ] Animation
C1 ENERGY= 406.9 kJ/mol Energy+ZPE= 380.1 kJ/mol ZPE= 0.0876505 CONNECTIONS: o EQ9 o DDC80
[ TS159 ] Animation
C1 ENERGY= 407.4 kJ/mol Energy+ZPE= 380.9 kJ/mol ZPE= 0.0877701 CONNECTIONS: o EQ9 o DDC81
[ TS160 ] Animation
C1 ENERGY= 409.5 kJ/mol Energy+ZPE= 382.4 kJ/mol ZPE= 0.0875495 CONNECTIONS: o EQ9 o DDC82
[ TS161 ] Animation
C1 ENERGY= 414.9 kJ/mol Energy+ZPE= 387.3 kJ/mol ZPE= 0.0873520 CONNECTIONS: o EQ9 o DDC83
[ TS162 ] Animation
C1 ENERGY= 504.0 kJ/mol Energy+ZPE= 484.0 kJ/mol ZPE= 0.0902603 CONNECTIONS: o EQ9 o DDC84
[ TS163 ] Animation
C1 ENERGY= 43.6 kJ/mol Energy+ZPE= 43.1 kJ/mol ZPE= 0.0976525 CONNECTIONS: o EQ10 o EQ10
[ TS164 ] Animation
C1 ENERGY= 43.9 kJ/mol Energy+ZPE= 42.8 kJ/mol ZPE= 0.0974494 CONNECTIONS: o EQ10 o EQ11
[ TS165 ] Animation
C1 ENERGY= 65.5 kJ/mol Energy+ZPE= 65.8 kJ/mol ZPE= 0.0979785 CONNECTIONS: o EQ10 o EQ12
[ TS166 ] Animation
C1 ENERGY= 51.9 kJ/mol Energy+ZPE= 49.0 kJ/mol ZPE= 0.0967710 CONNECTIONS: o EQ10 o EQ13
[ TS167 ] Animation
C1 ENERGY= 37.1 kJ/mol Energy+ZPE= 36.5 kJ/mol ZPE= 0.0976139 CONNECTIONS: o EQ10 o EQ15
[ TS168 ] Animation
C1 ENERGY= 57.4 kJ/mol Energy+ZPE= 56.4 kJ/mol ZPE= 0.0974822 CONNECTIONS: o EQ10 o EQ29
[ TS169 ] Animation
C1 ENERGY= 286.0 kJ/mol Energy+ZPE= 267.3 kJ/mol ZPE= 0.0907510 CONNECTIONS: o EQ10 o EQ44
[ TS170 ] Animation
C1 ENERGY= 483.0 kJ/mol Energy+ZPE= 465.1 kJ/mol ZPE= 0.0910460 CONNECTIONS: o EQ10 o EQ61
[ TS171 ] Animation
C1 ENERGY= 399.2 kJ/mol Energy+ZPE= 384.6 kJ/mol ZPE= 0.0922872 CONNECTIONS: o EQ10 o EQ63
[ TS172 ] Animation
C1 ENERGY= 281.1 kJ/mol Energy+ZPE= 259.8 kJ/mol ZPE= 0.0897357 CONNECTIONS: o EQ10 o DDC85
[ TS173 ] Animation
C1 ENERGY= 319.1 kJ/mol Energy+ZPE= 294.2 kJ/mol ZPE= 0.0883586 CONNECTIONS: o EQ10 o DDC86
[ TS174 ] Animation
C1 ENERGY= 364.1 kJ/mol Energy+ZPE= 345.1 kJ/mol ZPE= 0.0906084 CONNECTIONS: o EQ10 o DDC87
[ TS175 ] Animation
C1 ENERGY= 379.6 kJ/mol Energy+ZPE= 354.0 kJ/mol ZPE= 0.0881120 CONNECTIONS: o EQ10 o DDC88
[ TS176 ] Animation
C1 ENERGY= 381.6 kJ/mol Energy+ZPE= 360.2 kJ/mol ZPE= 0.0896960 CONNECTIONS: o EQ10 o DDC89
[ TS177 ] Animation
C1 ENERGY= 387.1 kJ/mol Energy+ZPE= 360.1 kJ/mol ZPE= 0.0875616 CONNECTIONS: o EQ10 o DDC90
[ TS178 ] Animation
C1 ENERGY= 42.1 kJ/mol Energy+ZPE= 42.0 kJ/mol ZPE= 0.0978183 CONNECTIONS: o EQ11 o EQ11
[ TS179 ] Animation
C1 ENERGY= 47.5 kJ/mol Energy+ZPE= 44.7 kJ/mol ZPE= 0.0967970 CONNECTIONS: o EQ11 o EQ12
[ TS180 ] Animation
C1 ENERGY= 55.9 kJ/mol Energy+ZPE= 55.4 kJ/mol ZPE= 0.0976558 CONNECTIONS: o EQ11 o EQ13
[ TS181 ] Animation
C1 ENERGY= 39.1 kJ/mol Energy+ZPE= 38.5 kJ/mol ZPE= 0.0976428 CONNECTIONS: o EQ11 o EQ15
[ TS182 ] Animation
C1 ENERGY= 66.5 kJ/mol Energy+ZPE= 66.6 kJ/mol ZPE= 0.0979102 CONNECTIONS: o EQ11 o EQ26
[ TS183 ] Animation
C1 ENERGY= 286.6 kJ/mol Energy+ZPE= 268.1 kJ/mol ZPE= 0.0908052 CONNECTIONS: o EQ11 o EQ43
[ TS184 ] Animation
C1 ENERGY= 281.7 kJ/mol Energy+ZPE= 263.1 kJ/mol ZPE= 0.0907574 CONNECTIONS: o EQ11 o EQ44
[ TS185 ] Animation
C1 ENERGY= 377.8 kJ/mol Energy+ZPE= 356.4 kJ/mol ZPE= 0.0897008 CONNECTIONS: o EQ11 o EQ75
[ TS186 ] Animation
C1 ENERGY= 488.9 kJ/mol Energy+ZPE= 463.8 kJ/mol ZPE= 0.0883176 CONNECTIONS: o EQ11 o EQ76
[ TS187 ] Animation
C1 ENERGY= 414.0 kJ/mol Energy+ZPE= 398.1 kJ/mol ZPE= 0.0917883 CONNECTIONS: o EQ11 o EQ79
[ TS188 ] Animation
C1 ENERGY= 459.2 kJ/mol Energy+ZPE= 439.0 kJ/mol ZPE= 0.0901834 CONNECTIONS: o EQ11 o EQ84
[ TS189 ] Animation
C1 ENERGY= 394.6 kJ/mol Energy+ZPE= 367.8 kJ/mol ZPE= 0.0876528 CONNECTIONS: o EQ11 o DDC91
[ TS190 ] Animation
C1 ENERGY= 395.9 kJ/mol Energy+ZPE= 369.1 kJ/mol ZPE= 0.0876503 CONNECTIONS: o EQ11 o DDC92
[ TS191 ] Animation
C1 ENERGY= 405.7 kJ/mol Energy+ZPE= 380.1 kJ/mol ZPE= 0.0881151 CONNECTIONS: o EQ11 o DDC93
[ TS192 ] Animation
C1 ENERGY= 42.9 kJ/mol Energy+ZPE= 42.8 kJ/mol ZPE= 0.0978166 CONNECTIONS: o EQ12 o EQ12
[ TS193 ] Animation
C1 ENERGY= 45.3 kJ/mol Energy+ZPE= 44.1 kJ/mol ZPE= 0.0974071 CONNECTIONS: o EQ12 o EQ13
[ TS194 ] Animation
C1 ENERGY= 56.9 kJ/mol Energy+ZPE= 55.1 kJ/mol ZPE= 0.0971846 CONNECTIONS: o EQ12 o EQ28
[ TS195 ] Animation
C1 ENERGY= 52.8 kJ/mol Energy+ZPE= 51.7 kJ/mol ZPE= 0.0974403 CONNECTIONS: o EQ12 o EQ29
[ TS196 ] Animation
C1 ENERGY= 414.7 kJ/mol Energy+ZPE= 399.9 kJ/mol ZPE= 0.0922073 CONNECTIONS: o EQ12 o EQ76
[ TS197 ] Animation
C1 ENERGY= 466.6 kJ/mol Energy+ZPE= 449.9 kJ/mol ZPE= 0.0915043 CONNECTIONS: o EQ12 o EQ79
[ TS198 ] Animation
C1 ENERGY= 200.6 kJ/mol Energy+ZPE= 187.4 kJ/mol ZPE= 0.0928180 CONNECTIONS: o EQ12 o DDC94
[ TS199 ] Animation
C1 ENERGY= 355.6 kJ/mol Energy+ZPE= 330.7 kJ/mol ZPE= 0.0883709 CONNECTIONS: o EQ12 o DDC95
[ TS200 ] Animation
C1 ENERGY= 392.4 kJ/mol Energy+ZPE= 365.8 kJ/mol ZPE= 0.0877388 CONNECTIONS: o EQ12 o DDC96
[ TS201 ] Animation
C1 ENERGY= 401.1 kJ/mol Energy+ZPE= 372.5 kJ/mol ZPE= 0.0869667 CONNECTIONS: o EQ12 o DDC97
[ TS202 ] Animation
C1 ENERGY= 46.6 kJ/mol Energy+ZPE= 46.6 kJ/mol ZPE= 0.0978678 CONNECTIONS: o EQ13 o EQ13
[ TS203 ] Animation
C1 ENERGY= 49.9 kJ/mol Energy+ZPE= 48.5 kJ/mol ZPE= 0.0973107 CONNECTIONS: o EQ13 o EQ26
[ TS204 ] Animation
C1 ENERGY= 55.6 kJ/mol Energy+ZPE= 53.5 kJ/mol ZPE= 0.0970675 CONNECTIONS: o EQ13 o EQ31
[ TS205 ] Animation
C1 ENERGY= 511.2 kJ/mol Energy+ZPE= 493.6 kJ/mol ZPE= 0.0911403 CONNECTIONS: o EQ13 o EQ34
[ TS206 ] Animation
C1 ENERGY= 405.3 kJ/mol Energy+ZPE= 389.5 kJ/mol ZPE= 0.0918458 CONNECTIONS: o EQ13 o EQ70
[ TS207 ] Animation
C1 ENERGY= 405.2 kJ/mol Energy+ZPE= 389.0 kJ/mol ZPE= 0.0917006 CONNECTIONS: o EQ13 o EQ71
[ TS208 ] Animation
C1 ENERGY= 346.2 kJ/mol Energy+ZPE= 320.3 kJ/mol ZPE= 0.0879796 CONNECTIONS: o EQ13 o DDC98
[ TS209 ] Animation
C1 ENERGY= 368.3 kJ/mol Energy+ZPE= 348.6 kJ/mol ZPE= 0.0903734 CONNECTIONS: o EQ13 o DDC99
[ TS210 ] Animation
C1 ENERGY= 387.8 kJ/mol Energy+ZPE= 361.4 kJ/mol ZPE= 0.0878144 CONNECTIONS: o EQ13 o DDC100
[ TS211 ] Animation
C1 ENERGY= 389.1 kJ/mol Energy+ZPE= 362.6 kJ/mol ZPE= 0.0877744 CONNECTIONS: o EQ13 o DDC101
[ TS212 ] Animation
Cs ENERGY= 502.9 kJ/mol Energy+ZPE= 481.4 kJ/mol ZPE= 0.0896745 CONNECTIONS: o EQ14 o EQ14
[ TS213 ] Animation
C1 ENERGY= 40.5 kJ/mol Energy+ZPE= 40.7 kJ/mol ZPE= 0.0979431 CONNECTIONS: o EQ14 o EQ16
[ TS214 ] Animation
C1 ENERGY= 48.7 kJ/mol Energy+ZPE= 48.8 kJ/mol ZPE= 0.0979174 CONNECTIONS: o EQ14 o EQ17
[ TS215 ] Animation
C1 ENERGY= 59.6 kJ/mol Energy+ZPE= 57.0 kJ/mol ZPE= 0.0968623 CONNECTIONS: o EQ14 o EQ17
[ TS216 ] Animation
C1 ENERGY= 48.3 kJ/mol Energy+ZPE= 47.8 kJ/mol ZPE= 0.0976628 CONNECTIONS: o EQ14 o EQ19
[ TS217 ] Animation
C1 ENERGY= 58.0 kJ/mol Energy+ZPE= 58.9 kJ/mol ZPE= 0.0982185 CONNECTIONS: o EQ14 o EQ19
[ TS218 ] Animation
C1 ENERGY= 527.6 kJ/mol Energy+ZPE= 508.4 kJ/mol ZPE= 0.0905430 CONNECTIONS: o EQ14 o EQ19
[ TS219 ] Animation
C1 ENERGY= 56.6 kJ/mol Energy+ZPE= 57.1 kJ/mol ZPE= 0.0980439 CONNECTIONS: o EQ14 o EQ21
[ TS220 ] Animation
C1 ENERGY= 378.3 kJ/mol Energy+ZPE= 362.3 kJ/mol ZPE= 0.0917689 CONNECTIONS: o EQ14 o EQ55
[ TS221 ] Animation
C1 ENERGY= 401.9 kJ/mol Energy+ZPE= 381.5 kJ/mol ZPE= 0.0900937 CONNECTIONS: o EQ14 o EQ93
[ TS222 ] Animation
C1 ENERGY= 519.6 kJ/mol Energy+ZPE= 498.1 kJ/mol ZPE= 0.0896730 CONNECTIONS: o EQ14 o EQ93
[ TS223 ] Animation
C1 ENERGY= 436.5 kJ/mol Energy+ZPE= 416.9 kJ/mol ZPE= 0.0904050 CONNECTIONS: o EQ14 o EQ108
[ TS224 ] Animation
C1 ENERGY= 350.4 kJ/mol Energy+ZPE= 327.6 kJ/mol ZPE= 0.0891744 CONNECTIONS: o EQ14 o DDC102
[ TS225 ] Animation
C1 ENERGY= 383.0 kJ/mol Energy+ZPE= 364.3 kJ/mol ZPE= 0.0907427 CONNECTIONS: o EQ14 o DDC103
[ TS226 ] Animation
C1 ENERGY= 454.1 kJ/mol Energy+ZPE= 438.3 kJ/mol ZPE= 0.0918609 CONNECTIONS: o EQ14 o DDC104
[ TS227 ] Animation
C1 ENERGY= 460.2 kJ/mol Energy+ZPE= 438.2 kJ/mol ZPE= 0.0894788 CONNECTIONS: o EQ14 o DDC105
[ TS228 ] Animation
C1 ENERGY= 463.0 kJ/mol Energy+ZPE= 437.0 kJ/mol ZPE= 0.0879686 CONNECTIONS: o EQ14 o DDC106
[ TS229 ] Animation
C1 ENERGY= 502.4 kJ/mol Energy+ZPE= 481.2 kJ/mol ZPE= 0.0897943 CONNECTIONS: o EQ14 o DDC107
[ TS230 ] Animation
C1 ENERGY= 45.8 kJ/mol Energy+ZPE= 44.9 kJ/mol ZPE= 0.0975158 CONNECTIONS: o EQ15 o EQ15
[ TS231 ] Animation
C1 ENERGY= 59.0 kJ/mol Energy+ZPE= 55.0 kJ/mol ZPE= 0.0963301 CONNECTIONS: o EQ15 o EQ28
[ TS232 ] Animation
C1 ENERGY= 283.4 kJ/mol Energy+ZPE= 265.0 kJ/mol ZPE= 0.0908663 CONNECTIONS: o EQ15 o EQ43
[ TS233 ] Animation
C1 ENERGY= 460.3 kJ/mol Energy+ZPE= 439.4 kJ/mol ZPE= 0.0899114 CONNECTIONS: o EQ15 o EQ85
[ TS234 ] Animation
C1 ENERGY= 278.0 kJ/mol Energy+ZPE= 256.4 kJ/mol ZPE= 0.0896458 CONNECTIONS: o EQ15 o DDC108
[ TS235 ] Animation
C1 ENERGY= 400.6 kJ/mol Energy+ZPE= 373.0 kJ/mol ZPE= 0.0873665 CONNECTIONS: o EQ15 o DDC109
[ TS236 ] Animation
C1 ENERGY= 401.6 kJ/mol Energy+ZPE= 374.0 kJ/mol ZPE= 0.0873380 CONNECTIONS: o EQ15 o DDC110
[ TS237 ] Animation
C1 ENERGY= 420.8 kJ/mol Energy+ZPE= 394.1 kJ/mol ZPE= 0.0876922 CONNECTIONS: o EQ15 o DDC111
[ TS238 ] Animation
C1 ENERGY= 422.8 kJ/mol Energy+ZPE= 408.6 kJ/mol ZPE= 0.0924391 CONNECTIONS: o EQ15 o DDC112
[ TS239 ] Animation
Cs ENERGY= 57.1 kJ/mol Energy+ZPE= 58.3 kJ/mol ZPE= 0.0983076 CONNECTIONS: o EQ16 o EQ16
[ TS240 ] Animation
C1 ENERGY= 49.8 kJ/mol Energy+ZPE= 49.9 kJ/mol ZPE= 0.0979023 CONNECTIONS: o EQ16 o EQ18
[ TS241 ] Animation
C1 ENERGY= 61.9 kJ/mol Energy+ZPE= 58.9 kJ/mol ZPE= 0.0967160 CONNECTIONS: o EQ16 o EQ18
[ TS242 ] Animation
C1 ENERGY= 41.2 kJ/mol Energy+ZPE= 41.3 kJ/mol ZPE= 0.0978893 CONNECTIONS: o EQ16 o EQ19
[ TS243 ] Animation
C1 ENERGY= 57.1 kJ/mol Energy+ZPE= 57.3 kJ/mol ZPE= 0.0979373 CONNECTIONS: o EQ16 o EQ23
[ TS244 ] Animation
C1 ENERGY= 57.0 kJ/mol Energy+ZPE= 56.2 kJ/mol ZPE= 0.0975622 CONNECTIONS: o EQ16 o EQ30
[ TS245 ] Animation
C1 ENERGY= 393.8 kJ/mol Energy+ZPE= 376.4 kJ/mol ZPE= 0.0912269 CONNECTIONS: o EQ16 o EQ62
[ TS246 ] Animation
C1 ENERGY= 496.1 kJ/mol Energy+ZPE= 480.2 kJ/mol ZPE= 0.0918021 CONNECTIONS: o EQ16 o EQ85
[ TS247 ] Animation
C1 ENERGY= 395.6 kJ/mol Energy+ZPE= 374.1 kJ/mol ZPE= 0.0896812 CONNECTIONS: o EQ16 o EQ86
[ TS248 ] Animation
C1 ENERGY= 399.3 kJ/mol Energy+ZPE= 379.1 kJ/mol ZPE= 0.0901701 CONNECTIONS: o EQ16 o EQ88
[ TS249 ] Animation
C1 ENERGY= 400.1 kJ/mol Energy+ZPE= 384.8 kJ/mol ZPE= 0.0920409 CONNECTIONS: o EQ16 o EQ89
[ TS250 ] Animation
C1 ENERGY= 382.9 kJ/mol Energy+ZPE= 361.6 kJ/mol ZPE= 0.0897568 CONNECTIONS: o EQ16 o DDC113
[ TS251 ] Animation
C1 ENERGY= 414.0 kJ/mol Energy+ZPE= 388.0 kJ/mol ZPE= 0.0879388 CONNECTIONS: o EQ16 o DDC114
[ TS252 ] Animation
C1 ENERGY= 415.0 kJ/mol Energy+ZPE= 390.8 kJ/mol ZPE= 0.0886621 CONNECTIONS: o EQ16 o DDC115
[ TS253 ] Animation
C1 ENERGY= 431.4 kJ/mol Energy+ZPE= 408.7 kJ/mol ZPE= 0.0892164 CONNECTIONS: o EQ16 o DDC116
[ TS254 ] Animation
C1 ENERGY= 444.0 kJ/mol Energy+ZPE= 424.1 kJ/mol ZPE= 0.0902753 CONNECTIONS: o EQ16 o DDC117
[ TS255 ] Animation
C1 ENERGY= 455.8 kJ/mol Energy+ZPE= 431.6 kJ/mol ZPE= 0.0886328 CONNECTIONS: o EQ16 o DDC118
[ TS256 ] Animation
C1 ENERGY= 458.5 kJ/mol Energy+ZPE= 437.9 kJ/mol ZPE= 0.0900136 CONNECTIONS: o EQ16 o DDC119
[ TS257 ] Animation
C1 ENERGY= 472.1 kJ/mol Energy+ZPE= 455.1 kJ/mol ZPE= 0.0913792 CONNECTIONS: o EQ16 o DDC120
[ TS258 ] Animation
C1 ENERGY= 43.2 kJ/mol Energy+ZPE= 43.3 kJ/mol ZPE= 0.0979062 CONNECTIONS: o EQ17 o EQ18
[ TS259 ] Animation
C1 ENERGY= 56.4 kJ/mol Energy+ZPE= 56.9 kJ/mol ZPE= 0.0980333 CONNECTIONS: o EQ17 o EQ22
[ TS260 ] Animation
C1 ENERGY= 383.9 kJ/mol Energy+ZPE= 368.7 kJ/mol ZPE= 0.0920809 CONNECTIONS: o EQ17 o EQ56
[ TS261 ] Animation
C1 ENERGY= 402.8 kJ/mol Energy+ZPE= 381.8 kJ/mol ZPE= 0.0898799 CONNECTIONS: o EQ17 o EQ94
[ TS262 ] Animation
C1 ENERGY= 334.7 kJ/mol Energy+ZPE= 310.6 kJ/mol ZPE= 0.0886782 CONNECTIONS: o EQ17 o DDC121
[ TS263 ] Animation
C1 ENERGY= 353.9 kJ/mol Energy+ZPE= 329.9 kJ/mol ZPE= 0.0887188 CONNECTIONS: o EQ17 o DDC122
[ TS264 ] Animation
C1 ENERGY= 360.5 kJ/mol Energy+ZPE= 343.8 kJ/mol ZPE= 0.0915015 CONNECTIONS: o EQ17 o DDC123
[ TS265 ] Animation
C1 ENERGY= 368.5 kJ/mol Energy+ZPE= 343.1 kJ/mol ZPE= 0.0881740 CONNECTIONS: o EQ17 o DDC124
[ TS266 ] Animation
C1 ENERGY= 395.9 kJ/mol Energy+ZPE= 372.3 kJ/mol ZPE= 0.0888729 CONNECTIONS: o EQ17 o DDC125
[ TS267 ] Animation
C1 ENERGY= 475.8 kJ/mol Energy+ZPE= 467.3 kJ/mol ZPE= 0.0946091 CONNECTIONS: o EQ17 o DDC126
[ TS268 ] Animation
C1 ENERGY= 590.6 kJ/mol Energy+ZPE= 574.7 kJ/mol ZPE= 0.0917974 CONNECTIONS: o EQ17 o DDC127
[ TS269 ] Animation
C1 ENERGY= 56.1 kJ/mol Energy+ZPE= 56.5 kJ/mol ZPE= 0.0980302 CONNECTIONS: o EQ18 o EQ25
[ TS270 ] Animation
C1 ENERGY= 54.4 kJ/mol Energy+ZPE= 53.1 kJ/mol ZPE= 0.0973537 CONNECTIONS: o EQ18 o EQ30
[ TS271 ] Animation
C1 ENERGY= 388.8 kJ/mol Energy+ZPE= 373.0 kJ/mol ZPE= 0.0918434 CONNECTIONS: o EQ18 o EQ57
[ TS272 ] Animation
C1 ENERGY= 525.0 kJ/mol Energy+ZPE= 513.0 kJ/mol ZPE= 0.0932881 CONNECTIONS: o EQ18 o EQ72
[ TS273 ] Animation
C1 ENERGY= 411.8 kJ/mol Energy+ZPE= 396.0 kJ/mol ZPE= 0.0918598 CONNECTIONS: o EQ18 o EQ80
[ TS274 ] Animation
C1 ENERGY= 409.6 kJ/mol Energy+ZPE= 396.7 kJ/mol ZPE= 0.0929514 CONNECTIONS: o EQ18 o EQ82
[ TS275 ] Animation
C1 ENERGY= 514.2 kJ/mol Energy+ZPE= 493.8 kJ/mol ZPE= 0.0900993 CONNECTIONS: o EQ18 o EQ82
[ TS276 ] Animation
C1 ENERGY= 397.1 kJ/mol Energy+ZPE= 377.0 kJ/mol ZPE= 0.0902122 CONNECTIONS: o EQ18 o EQ87
[ TS277 ] Animation
C1 ENERGY= 403.7 kJ/mol Energy+ZPE= 381.1 kJ/mol ZPE= 0.0892425 CONNECTIONS: o EQ18 o EQ96
[ TS278 ] Animation
C1 ENERGY= 357.4 kJ/mol Energy+ZPE= 341.6 kJ/mol ZPE= 0.0918440 CONNECTIONS: o EQ18 o DDC128
[ TS279 ] Animation
C1 ENERGY= 380.9 kJ/mol Energy+ZPE= 354.3 kJ/mol ZPE= 0.0877466 CONNECTIONS: o EQ18 o DDC129
[ TS280 ] Animation
C1 ENERGY= 396.2 kJ/mol Energy+ZPE= 372.9 kJ/mol ZPE= 0.0889689 CONNECTIONS: o EQ18 o DDC130
[ TS281 ] Animation
C1 ENERGY= 427.7 kJ/mol Energy+ZPE= 400.7 kJ/mol ZPE= 0.0875601 CONNECTIONS: o EQ18 o DDC131
[ TS282 ] Animation
C1 ENERGY= 447.1 kJ/mol Energy+ZPE= 416.5 kJ/mol ZPE= 0.0862129 CONNECTIONS: o EQ18 o DDC132
[ TS283 ] Animation
C1 ENERGY= 525.8 kJ/mol Energy+ZPE= 486.3 kJ/mol ZPE= 0.0827983 CONNECTIONS: o EQ18 o DDC133
[ TS284 ] Animation
C1 ENERGY= 57.6 kJ/mol Energy+ZPE= 57.6 kJ/mol ZPE= 0.0978691 CONNECTIONS: o EQ19 o EQ21
[ TS285 ] Animation
C1 ENERGY= 399.0 kJ/mol Energy+ZPE= 379.8 kJ/mol ZPE= 0.0905344 CONNECTIONS: o EQ19 o EQ56
[ TS286 ] Animation
C1 ENERGY= 401.0 kJ/mol Energy+ZPE= 379.1 kJ/mol ZPE= 0.0895358 CONNECTIONS: o EQ19 o EQ90
[ TS287 ] Animation
C1 ENERGY= 519.6 kJ/mol Energy+ZPE= 498.8 kJ/mol ZPE= 0.0899239 CONNECTIONS: o EQ19 o EQ90
[ TS288 ] Animation
C1 ENERGY= 439.1 kJ/mol Energy+ZPE= 417.6 kJ/mol ZPE= 0.0896858 CONNECTIONS: o EQ19 o EQ108
[ TS289 ] Animation
C1 ENERGY= 353.0 kJ/mol Energy+ZPE= 329.9 kJ/mol ZPE= 0.0890728 CONNECTIONS: o EQ19 o DDC134
[ TS290 ] Animation
C1 ENERGY= 367.8 kJ/mol Energy+ZPE= 351.5 kJ/mol ZPE= 0.0916454 CONNECTIONS: o EQ19 o DDC135
[ TS291 ] Animation
C1 ENERGY= 416.3 kJ/mol Energy+ZPE= 389.3 kJ/mol ZPE= 0.0875699 CONNECTIONS: o EQ19 o DDC136
[ TS292 ] Animation
C1 ENERGY= 455.5 kJ/mol Energy+ZPE= 439.0 kJ/mol ZPE= 0.0915704 CONNECTIONS: o EQ19 o DDC137
[ TS293 ] Animation
C1 ENERGY= 460.7 kJ/mol Energy+ZPE= 435.7 kJ/mol ZPE= 0.0883525 CONNECTIONS: o EQ19 o DDC138
[ TS294 ] Animation
C1 ENERGY= 463.3 kJ/mol Energy+ZPE= 448.7 kJ/mol ZPE= 0.0922969 CONNECTIONS: o EQ19 o DDC139
[ TS295 ] Animation
C1 ENERGY= 47.0 kJ/mol Energy+ZPE= 47.0 kJ/mol ZPE= 0.0978715 CONNECTIONS: o EQ20 o EQ20
[ TS296 ] Animation
Cs ENERGY= 62.4 kJ/mol Energy+ZPE= 61.2 kJ/mol ZPE= 0.0974021 CONNECTIONS: o EQ20 o EQ20
[ TS297 ] Animation
C1 ENERGY= 57.6 kJ/mol Energy+ZPE= 57.0 kJ/mol ZPE= 0.0976295 CONNECTIONS: o EQ20 o EQ27
[ TS298 ] Animation
C1 ENERGY= 58.4 kJ/mol Energy+ZPE= 57.6 kJ/mol ZPE= 0.0975601 CONNECTIONS: o EQ20 o EQ27
[ TS299 ] Animation
C1 ENERGY= 432.3 kJ/mol Energy+ZPE= 413.3 kJ/mol ZPE= 0.0906169 CONNECTIONS: o EQ20 o EQ92
[ TS300 ] Animation
C1 ENERGY= 494.8 kJ/mol Energy+ZPE= 475.9 kJ/mol ZPE= 0.0906775 CONNECTIONS: o EQ20 o EQ92
[ TS301 ] Animation
C1 ENERGY= 503.6 kJ/mol Energy+ZPE= 484.8 kJ/mol ZPE= 0.0906896 CONNECTIONS: o EQ20 o EQ92
[ TS302 ] Animation
C1 ENERGY= 783.2 kJ/mol Energy+ZPE= 756.8 kJ/mol ZPE= 0.0878087 CONNECTIONS: o EQ20 o EQ123
[ TS303 ] Animation
C1 ENERGY= 342.3 kJ/mol Energy+ZPE= 333.4 kJ/mol ZPE= 0.0944652 CONNECTIONS: o EQ20 o DDC140
[ TS304 ] Animation
C1 ENERGY= 378.0 kJ/mol Energy+ZPE= 353.6 kJ/mol ZPE= 0.0885539 CONNECTIONS: o EQ20 o DDC141
[ TS305 ] Animation
C1 ENERGY= 386.6 kJ/mol Energy+ZPE= 365.2 kJ/mol ZPE= 0.0897132 CONNECTIONS: o EQ20 o DDC142
[ TS306 ] Animation
C1 ENERGY= 387.0 kJ/mol Energy+ZPE= 360.7 kJ/mol ZPE= 0.0878310 CONNECTIONS: o EQ20 o DDC143
[ TS307 ] Animation
C1 ENERGY= 425.5 kJ/mol Energy+ZPE= 397.7 kJ/mol ZPE= 0.0872712 CONNECTIONS: o EQ20 o DDC144
[ TS308 ] Animation
C1 ENERGY= 426.3 kJ/mol Energy+ZPE= 397.4 kJ/mol ZPE= 0.0868719 CONNECTIONS: o EQ20 o DDC145
[ TS309 ] Animation
C1 ENERGY= 429.2 kJ/mol Energy+ZPE= 399.2 kJ/mol ZPE= 0.0864296 CONNECTIONS: o EQ20 o DDC146
[ TS310 ] Animation
C1 ENERGY= 430.0 kJ/mol Energy+ZPE= 401.2 kJ/mol ZPE= 0.0868754 CONNECTIONS: o EQ20 o DDC147
[ TS311 ] Animation
C1 ENERGY= 493.9 kJ/mol Energy+ZPE= 478.0 kJ/mol ZPE= 0.0918167 CONNECTIONS: o EQ20 o DDC148
[ TS312 ] Animation
Cs ENERGY= 47.3 kJ/mol Energy+ZPE= 46.9 kJ/mol ZPE= 0.0977097 CONNECTIONS: o EQ21 o EQ21
[ TS313 ] Animation
C1 ENERGY= 52.9 kJ/mol Energy+ZPE= 52.7 kJ/mol ZPE= 0.0977765 CONNECTIONS: o EQ21 o EQ22
[ TS314 ] Animation
C1 ENERGY= 46.1 kJ/mol Energy+ZPE= 45.5 kJ/mol ZPE= 0.0976483 CONNECTIONS: o EQ21 o EQ23
[ TS315 ] Animation
C1 ENERGY= 54.2 kJ/mol Energy+ZPE= 54.0 kJ/mol ZPE= 0.0977843 CONNECTIONS: o EQ21 o EQ24
[ TS316 ] Animation
C1 ENERGY= 61.8 kJ/mol Energy+ZPE= 58.0 kJ/mol ZPE= 0.0964106 CONNECTIONS: o EQ21 o EQ24
[ TS317 ] Animation
C1 ENERGY= 439.5 kJ/mol Energy+ZPE= 424.1 kJ/mol ZPE= 0.0920015 CONNECTIONS: o EQ21 o EQ45
[ TS318 ] Animation
C1 ENERGY= 401.4 kJ/mol Energy+ZPE= 380.9 kJ/mol ZPE= 0.0900362 CONNECTIONS: o EQ21 o EQ65
[ TS319 ] Animation
C1 ENERGY= 402.1 kJ/mol Energy+ZPE= 385.2 kJ/mol ZPE= 0.0914055 CONNECTIONS: o EQ21 o EQ67
[ TS320 ] Animation
C1 ENERGY= 375.8 kJ/mol Energy+ZPE= 356.2 kJ/mol ZPE= 0.0903967 CONNECTIONS: o EQ21 o DDC149
[ TS321 ] Animation
C1 ENERGY= 377.1 kJ/mol Energy+ZPE= 357.3 kJ/mol ZPE= 0.0903058 CONNECTIONS: o EQ21 o DDC150
[ TS322 ] Animation
C1 ENERGY= 378.5 kJ/mol Energy+ZPE= 361.2 kJ/mol ZPE= 0.0912712 CONNECTIONS: o EQ21 o DDC151
[ TS323 ] Animation
C1 ENERGY= 395.2 kJ/mol Energy+ZPE= 380.0 kJ/mol ZPE= 0.0920842 CONNECTIONS: o EQ21 o DDC152
[ TS324 ] Animation
C1 ENERGY= 421.1 kJ/mol Energy+ZPE= 393.2 kJ/mol ZPE= 0.0872472 CONNECTIONS: o EQ21 o DDC153
[ TS325 ] Animation
C1 ENERGY= 430.8 kJ/mol Energy+ZPE= 414.7 kJ/mol ZPE= 0.0917200 CONNECTIONS: o EQ21 o DDC154
[ TS326 ] Animation
C1 ENERGY= 459.2 kJ/mol Energy+ZPE= 444.4 kJ/mol ZPE= 0.0922345 CONNECTIONS: o EQ21 o DDC155
[ TS327 ] Animation
Cs ENERGY= 427.4 kJ/mol Energy+ZPE= 412.3 kJ/mol ZPE= 0.0921146 CONNECTIONS: o EQ22 o EQ22
[ TS328 ] Animation
C1 ENERGY= 48.0 kJ/mol Energy+ZPE= 47.6 kJ/mol ZPE= 0.0977106 CONNECTIONS: o EQ22 o EQ24
[ TS329 ] Animation
C1 ENERGY= 50.9 kJ/mol Energy+ZPE= 50.3 kJ/mol ZPE= 0.0976430 CONNECTIONS: o EQ22 o EQ24
[ TS330 ] Animation
C1 ENERGY= 559.7 kJ/mol Energy+ZPE= 525.9 kJ/mol ZPE= 0.0849842 CONNECTIONS: o EQ22 o EQ24
[ TS331 ] Animation
C1 ENERGY= 46.9 kJ/mol Energy+ZPE= 46.4 kJ/mol ZPE= 0.0976528 CONNECTIONS: o EQ22 o EQ25
[ TS332 ] Animation
C1 ENERGY= 391.8 kJ/mol Energy+ZPE= 372.7 kJ/mol ZPE= 0.0905729 CONNECTIONS: o EQ22 o DDC156
[ TS333 ] Animation
C1 ENERGY= 396.5 kJ/mol Energy+ZPE= 368.9 kJ/mol ZPE= 0.0873553 CONNECTIONS: o EQ22 o DDC157
[ TS334 ] Animation
C1 ENERGY= 431.3 kJ/mol Energy+ZPE= 403.5 kJ/mol ZPE= 0.0872694 CONNECTIONS: o EQ22 o DDC158
[ TS335 ] Animation
C1 ENERGY= 453.2 kJ/mol Energy+ZPE= 433.8 kJ/mol ZPE= 0.0904899 CONNECTIONS: o EQ22 o DDC159
[ TS336 ] Animation
C1 ENERGY= 478.5 kJ/mol Energy+ZPE= 462.7 kJ/mol ZPE= 0.0918259 CONNECTIONS: o EQ22 o DDC160
[ TS337 ] Animation
C1 ENERGY= 501.5 kJ/mol Energy+ZPE= 478.1 kJ/mol ZPE= 0.0889566 CONNECTIONS: o EQ22 o DDC161
[ TS338 ] Animation
C1 ENERGY= 56.2 kJ/mol Energy+ZPE= 55.5 kJ/mol ZPE= 0.0975947 CONNECTIONS: o EQ23 o EQ25
[ TS339 ] Animation
Cs ENERGY= 63.2 kJ/mol Energy+ZPE= 59.3 kJ/mol ZPE= 0.0963868 CONNECTIONS: o EQ23 o EQ25
[ TS340 ] Animation
C1 ENERGY= 400.1 kJ/mol Energy+ZPE= 379.2 kJ/mol ZPE= 0.0899061 CONNECTIONS: o EQ23 o EQ64
[ TS341 ] Animation
C1 ENERGY= 422.6 kJ/mol Energy+ZPE= 403.2 kJ/mol ZPE= 0.0904843 CONNECTIONS: o EQ23 o EQ77
[ TS342 ] Animation
C1 ENERGY= 416.0 kJ/mol Energy+ZPE= 388.6 kJ/mol ZPE= 0.0874257 CONNECTIONS: o EQ23 o DDC162
[ TS343 ] Animation
C1 ENERGY= 479.8 kJ/mol Energy+ZPE= 461.3 kJ/mol ZPE= 0.0908010 CONNECTIONS: o EQ23 o DDC163
[ TS344 ] Animation
C1 ENERGY= 507.5 kJ/mol Energy+ZPE= 480.4 kJ/mol ZPE= 0.0875285 CONNECTIONS: o EQ23 o DDC164
[ TS345 ] Animation
C1 ENERGY= 48.2 kJ/mol Energy+ZPE= 47.5 kJ/mol ZPE= 0.0975967 CONNECTIONS: o EQ24 o EQ25
[ TS346 ] Animation
C1 ENERGY= 416.0 kJ/mol Energy+ZPE= 393.4 kJ/mol ZPE= 0.0892357 CONNECTIONS: o EQ24 o EQ65
[ TS347 ] Animation
C1 ENERGY= 342.4 kJ/mol Energy+ZPE= 313.9 kJ/mol ZPE= 0.0870047 CONNECTIONS: o EQ24 o DDC165
[ TS348 ] Animation
C1 ENERGY= 386.1 kJ/mol Energy+ZPE= 357.6 kJ/mol ZPE= 0.0870135 CONNECTIONS: o EQ24 o DDC166
[ TS349 ] Animation
C1 ENERGY= 429.8 kJ/mol Energy+ZPE= 401.1 kJ/mol ZPE= 0.0869182 CONNECTIONS: o EQ24 o DDC167
[ TS350 ] Animation
C1 ENERGY= 450.1 kJ/mol Energy+ZPE= 431.7 kJ/mol ZPE= 0.0908451 CONNECTIONS: o EQ24 o DDC168
[ TS351 ] Animation
C1 ENERGY= 452.3 kJ/mol Energy+ZPE= 440.3 kJ/mol ZPE= 0.0932757 CONNECTIONS: o EQ24 o DDC169
[ TS352 ] Animation
C1 ENERGY= 454.1 kJ/mol Energy+ZPE= 419.9 kJ/mol ZPE= 0.0848367 CONNECTIONS: o EQ24 o DDC170
[ TS353 ] Animation
C1 ENERGY= 466.0 kJ/mol Energy+ZPE= 451.3 kJ/mol ZPE= 0.0922521 CONNECTIONS: o EQ24 o DDC171
[ TS354 ] Animation
C1 ENERGY= 478.8 kJ/mol Energy+ZPE= 469.7 kJ/mol ZPE= 0.0943904 CONNECTIONS: o EQ24 o DDC172
[ TS355 ] Animation
C1 ENERGY= 511.1 kJ/mol Energy+ZPE= 478.0 kJ/mol ZPE= 0.0852548 CONNECTIONS: o EQ24 o DDC173
[ TS356 ] Animation
Cs ENERGY= 48.4 kJ/mol Energy+ZPE= 47.8 kJ/mol ZPE= 0.0976466 CONNECTIONS: o EQ25 o EQ25
[ TS357 ] Animation
Cs ENERGY= 602.1 kJ/mol Energy+ZPE= 568.6 kJ/mol ZPE= 0.0851073 CONNECTIONS: o EQ25 o EQ25
[ TS358 ] Animation
C1 ENERGY= 694.2 kJ/mol Energy+ZPE= 654.4 kJ/mol ZPE= 0.0827049 CONNECTIONS: o EQ25 o EQ25
[ TS359 ] Animation
C1 ENERGY= 60.3 kJ/mol Energy+ZPE= 60.3 kJ/mol ZPE= 0.0978646 CONNECTIONS: o EQ25 o EQ30
[ TS360 ] Animation
C1 ENERGY= 412.4 kJ/mol Energy+ZPE= 389.9 kJ/mol ZPE= 0.0892827 CONNECTIONS: o EQ25 o EQ64
[ TS361 ] Animation
C1 ENERGY= 408.2 kJ/mol Energy+ZPE= 378.6 kJ/mol ZPE= 0.0865924 CONNECTIONS: o EQ25 o DDC174
[ TS362 ] Animation
C1 ENERGY= 423.1 kJ/mol Energy+ZPE= 395.5 kJ/mol ZPE= 0.0873372 CONNECTIONS: o EQ25 o DDC175
[ TS363 ] Animation
C1 ENERGY= 424.6 kJ/mol Energy+ZPE= 397.6 kJ/mol ZPE= 0.0875609 CONNECTIONS: o EQ25 o DDC176
[ TS364 ] Animation
C1 ENERGY= 459.2 kJ/mol Energy+ZPE= 425.3 kJ/mol ZPE= 0.0849401 CONNECTIONS: o EQ25 o DDC177
[ TS365 ] Animation
C1 ENERGY= 489.1 kJ/mol Energy+ZPE= 465.2 kJ/mol ZPE= 0.0887742 CONNECTIONS: o EQ25 o DDC178
[ TS366 ] Animation
C1 ENERGY= 563.8 kJ/mol Energy+ZPE= 540.4 kJ/mol ZPE= 0.0889561 CONNECTIONS: o EQ25 o DDC179
[ TS367 ] Animation
C1 ENERGY= 51.1 kJ/mol Energy+ZPE= 49.5 kJ/mol ZPE= 0.0972392 CONNECTIONS: o EQ26 o EQ28
[ TS368 ] Animation
C1 ENERGY= 494.6 kJ/mol Energy+ZPE= 477.9 kJ/mol ZPE= 0.0915113 CONNECTIONS: o EQ26 o EQ59
[ TS369 ] Animation
C1 ENERGY= 408.6 kJ/mol Energy+ZPE= 393.9 kJ/mol ZPE= 0.0922790 CONNECTIONS: o EQ26 o EQ63
[ TS370 ] Animation
C1 ENERGY= 345.3 kJ/mol Energy+ZPE= 320.7 kJ/mol ZPE= 0.0884957 CONNECTIONS: o EQ26 o DDC180
[ TS371 ] Animation
C1 ENERGY= 380.6 kJ/mol Energy+ZPE= 354.0 kJ/mol ZPE= 0.0877438 CONNECTIONS: o EQ26 o DDC181
[ TS372 ] Animation
C1 ENERGY= 408.0 kJ/mol Energy+ZPE= 393.1 kJ/mol ZPE= 0.0921939 CONNECTIONS: o EQ26 o DDC182
[ TS373 ] Animation
Cs ENERGY= 52.2 kJ/mol Energy+ZPE= 50.5 kJ/mol ZPE= 0.0972012 CONNECTIONS: o EQ27 o EQ27
[ TS374 ] Animation
C1 ENERGY= 61.0 kJ/mol Energy+ZPE= 59.5 kJ/mol ZPE= 0.0973037 CONNECTIONS: o EQ27 o EQ27
[ TS375 ] Animation
C1 ENERGY= 430.6 kJ/mol Energy+ZPE= 412.1 kJ/mol ZPE= 0.0908106 CONNECTIONS: o EQ27 o EQ100
[ TS376 ] Animation
C1 ENERGY= 362.7 kJ/mol Energy+ZPE= 337.2 kJ/mol ZPE= 0.0881588 CONNECTIONS: o EQ27 o DDC183
[ TS377 ] Animation
C1 ENERGY= 428.4 kJ/mol Energy+ZPE= 398.3 kJ/mol ZPE= 0.0864060 CONNECTIONS: o EQ27 o DDC184
[ TS378 ] Animation
C1 ENERGY= 431.6 kJ/mol Energy+ZPE= 400.9 kJ/mol ZPE= 0.0861530 CONNECTIONS: o EQ27 o DDC185
[ TS379 ] Animation
C1 ENERGY= 60.8 kJ/mol Energy+ZPE= 58.6 kJ/mol ZPE= 0.0970396 CONNECTIONS: o EQ28 o EQ28
[ TS380 ] Animation
C1 ENERGY= 59.7 kJ/mol Energy+ZPE= 58.0 kJ/mol ZPE= 0.0972201 CONNECTIONS: o EQ28 o EQ31
[ TS381 ] Animation
C1 ENERGY= 338.0 kJ/mol Energy+ZPE= 310.7 kJ/mol ZPE= 0.0874445 CONNECTIONS: o EQ28 o DDC186
[ TS382 ] Animation
C1 ENERGY= 422.2 kJ/mol Energy+ZPE= 396.8 kJ/mol ZPE= 0.0882027 CONNECTIONS: o EQ28 o DDC187
[ TS383 ] Animation
C1 ENERGY= 53.9 kJ/mol Energy+ZPE= 52.2 kJ/mol ZPE= 0.0971978 CONNECTIONS: o EQ29 o EQ31
[ TS384 ] Animation
C1 ENERGY= 526.5 kJ/mol Energy+ZPE= 507.9 kJ/mol ZPE= 0.0907899 CONNECTIONS: o EQ29 o EQ39
[ TS385 ] Animation
C1 ENERGY= 413.0 kJ/mol Energy+ZPE= 396.7 kJ/mol ZPE= 0.0916347 CONNECTIONS: o EQ29 o EQ70
[ TS386 ] Animation
C1 ENERGY= 413.4 kJ/mol Energy+ZPE= 396.1 kJ/mol ZPE= 0.0912634 CONNECTIONS: o EQ29 o EQ72
[ TS387 ] Animation
C1 ENERGY= 345.3 kJ/mol Energy+ZPE= 318.9 kJ/mol ZPE= 0.0878207 CONNECTIONS: o EQ29 o DDC188
[ TS388 ] Animation
C1 ENERGY= 373.6 kJ/mol Energy+ZPE= 346.3 kJ/mol ZPE= 0.0874560 CONNECTIONS: o EQ29 o DDC189
[ TS389 ] Animation
C1 ENERGY= 403.6 kJ/mol Energy+ZPE= 381.4 kJ/mol ZPE= 0.0893965 CONNECTIONS: o EQ30 o EQ80
[ TS390 ] Animation
C1 ENERGY= 508.1 kJ/mol Energy+ZPE= 487.7 kJ/mol ZPE= 0.0900924 CONNECTIONS: o EQ30 o EQ82
[ TS391 ] Animation
C1 ENERGY= 421.9 kJ/mol Energy+ZPE= 394.9 kJ/mol ZPE= 0.0875769 CONNECTIONS: o EQ30 o DDC190
[ TS392 ] Animation
C1 ENERGY= 470.2 kJ/mol Energy+ZPE= 437.9 kJ/mol ZPE= 0.0855660 CONNECTIONS: o EQ30 o DDC191
[ TS393 ] Animation
C1 ENERGY= 65.7 kJ/mol Energy+ZPE= 63.6 kJ/mol ZPE= 0.0970784 CONNECTIONS: o EQ31 o EQ31
[ TS394 ] Animation
C1 ENERGY= 416.2 kJ/mol Energy+ZPE= 398.5 kJ/mol ZPE= 0.0911270 CONNECTIONS: o EQ31 o EQ73
[ TS395 ] Animation
C1 ENERGY= 415.6 kJ/mol Energy+ZPE= 398.0 kJ/mol ZPE= 0.0911665 CONNECTIONS: o EQ31 o EQ74
[ TS396 ] Animation
C1 ENERGY= 339.9 kJ/mol Energy+ZPE= 312.0 kJ/mol ZPE= 0.0872317 CONNECTIONS: o EQ31 o DDC192
[ TS397 ] Animation
C1 ENERGY= 345.3 kJ/mol Energy+ZPE= 318.9 kJ/mol ZPE= 0.0877970 CONNECTIONS: o EQ31 o DDC193
[ TS398 ] Animation
C1 ENERGY= 356.9 kJ/mol Energy+ZPE= 331.0 kJ/mol ZPE= 0.0879908 CONNECTIONS: o EQ31 o DDC194
[ TS399 ] Animation
C1 ENERGY= 400.4 kJ/mol Energy+ZPE= 372.0 kJ/mol ZPE= 0.0870615 CONNECTIONS: o EQ31 o DDC195
[ TS400 ] Animation
C1 ENERGY= 402.6 kJ/mol Energy+ZPE= 373.9 kJ/mol ZPE= 0.0869234 CONNECTIONS: o EQ31 o DDC196
[ TS401 ] Animation
C1 ENERGY= 495.5 kJ/mol Energy+ZPE= 472.3 kJ/mol ZPE= 0.0890385 CONNECTIONS: o EQ31 o DDC197
[ TS402 ] Animation
C1 ENERGY= 153.8 kJ/mol Energy+ZPE= 152.2 kJ/mol ZPE= 0.0972564 CONNECTIONS: o EQ32 o EQ32
[ TS403 ] Animation
C1 ENERGY= 156.7 kJ/mol Energy+ZPE= 154.6 kJ/mol ZPE= 0.0970674 CONNECTIONS: o EQ32 o EQ34
[ TS404 ] Animation
C1 ENERGY= 172.6 kJ/mol Energy+ZPE= 169.3 kJ/mol ZPE= 0.0966189 CONNECTIONS: o EQ32 o EQ38
[ TS405 ] Animation
C1 ENERGY= 175.3 kJ/mol Energy+ZPE= 171.9 kJ/mol ZPE= 0.0965549 CONNECTIONS: o EQ32 o EQ38
[ TS406 ] Animation
C1 ENERGY= 194.5 kJ/mol Energy+ZPE= 189.6 kJ/mol ZPE= 0.0959967 CONNECTIONS: o EQ32 o EQ40
[ TS407 ] Animation
C1 ENERGY= 349.6 kJ/mol Energy+ZPE= 337.4 kJ/mol ZPE= 0.0932096 CONNECTIONS: o EQ32 o EQ46
[ TS408 ] Animation
C1 ENERGY= 555.7 kJ/mol Energy+ZPE= 541.9 kJ/mol ZPE= 0.0926190 CONNECTIONS: o EQ32 o EQ105
[ TS409 ] Animation
C1 ENERGY= 398.0 kJ/mol Energy+ZPE= 374.3 kJ/mol ZPE= 0.0888263 CONNECTIONS: o EQ32 o DDC198
[ TS410 ] Animation
C1 ENERGY= 459.8 kJ/mol Energy+ZPE= 437.3 kJ/mol ZPE= 0.0892780 CONNECTIONS: o EQ32 o DDC199
[ TS411 ] Animation
C1 ENERGY= 469.5 kJ/mol Energy+ZPE= 450.0 kJ/mol ZPE= 0.0904388 CONNECTIONS: o EQ32 o DDC200
[ TS412 ] Animation
C1 ENERGY= 469.9 kJ/mol Energy+ZPE= 453.3 kJ/mol ZPE= 0.0915321 CONNECTIONS: o EQ32 o DDC201
[ TS413 ] Animation
C1 ENERGY= 501.2 kJ/mol Energy+ZPE= 475.6 kJ/mol ZPE= 0.0881177 CONNECTIONS: o EQ32 o DDC202
[ TS414 ] Animation
C1 ENERGY= 621.0 kJ/mol Energy+ZPE= 582.3 kJ/mol ZPE= 0.0831150 CONNECTIONS: o EQ32 o DDC203
[ TS415 ] Animation
C1 ENERGY= 623.2 kJ/mol Energy+ZPE= 585.3 kJ/mol ZPE= 0.0834135 CONNECTIONS: o EQ32 o DDC204
[ TS416 ] Animation
C1 ENERGY= 631.8 kJ/mol Energy+ZPE= 590.9 kJ/mol ZPE= 0.0822906 CONNECTIONS: o EQ32 o DDC205
[ TS417 ] Animation
C1 ENERGY= 634.9 kJ/mol Energy+ZPE= 604.0 kJ/mol ZPE= 0.0860767 CONNECTIONS: o EQ32 o DDC206
[ TS418 ] Animation
C1 ENERGY= 155.2 kJ/mol Energy+ZPE= 153.2 kJ/mol ZPE= 0.0971081 CONNECTIONS: o EQ33 o EQ33
[ TS419 ] Animation
C1 ENERGY= 156.8 kJ/mol Energy+ZPE= 155.1 kJ/mol ZPE= 0.0972041 CONNECTIONS: o EQ33 o EQ34
[ TS420 ] Animation
C1 ENERGY= 193.9 kJ/mol Energy+ZPE= 189.1 kJ/mol ZPE= 0.0960221 CONNECTIONS: o EQ33 o EQ38
[ TS421 ] Animation
C1 ENERGY= 174.1 kJ/mol Energy+ZPE= 170.9 kJ/mol ZPE= 0.0966363 CONNECTIONS: o EQ33 o EQ40
[ TS422 ] Animation
C1 ENERGY= 174.3 kJ/mol Energy+ZPE= 170.7 kJ/mol ZPE= 0.0964918 CONNECTIONS: o EQ33 o EQ40
[ TS423 ] Animation
C1 ENERGY= 349.1 kJ/mol Energy+ZPE= 336.7 kJ/mol ZPE= 0.0931560 CONNECTIONS: o EQ33 o EQ46
[ TS424 ] Animation
C1 ENERGY= 553.4 kJ/mol Energy+ZPE= 540.4 kJ/mol ZPE= 0.0929105 CONNECTIONS: o EQ33 o EQ102
[ TS425 ] Animation
C1 ENERGY= 580.4 kJ/mol Energy+ZPE= 560.2 kJ/mol ZPE= 0.0901702 CONNECTIONS: o EQ33 o EQ102
[ TS426 ] Animation
C1 ENERGY= 538.6 kJ/mol Energy+ZPE= 516.3 kJ/mol ZPE= 0.0893707 CONNECTIONS: o EQ33 o EQ116
[ TS427 ] Animation
C1 ENERGY= 397.1 kJ/mol Energy+ZPE= 373.6 kJ/mol ZPE= 0.0889104 CONNECTIONS: o EQ33 o DDC207
[ TS428 ] Animation
C1 ENERGY= 399.7 kJ/mol Energy+ZPE= 376.2 kJ/mol ZPE= 0.0889016 CONNECTIONS: o EQ33 o DDC208
[ TS429 ] Animation
C1 ENERGY= 458.5 kJ/mol Energy+ZPE= 438.9 kJ/mol ZPE= 0.0903805 CONNECTIONS: o EQ33 o DDC209
[ TS430 ] Animation
C1 ENERGY= 475.2 kJ/mol Energy+ZPE= 452.9 kJ/mol ZPE= 0.0893549 CONNECTIONS: o EQ33 o DDC210
[ TS431 ] Animation
C1 ENERGY= 489.4 kJ/mol Energy+ZPE= 464.8 kJ/mol ZPE= 0.0884892 CONNECTIONS: o EQ33 o DDC211
[ TS432 ] Animation
C1 ENERGY= 502.6 kJ/mol Energy+ZPE= 482.4 kJ/mol ZPE= 0.0901563 CONNECTIONS: o EQ33 o DDC212
[ TS433 ] Animation
C1 ENERGY= 512.0 kJ/mol Energy+ZPE= 482.1 kJ/mol ZPE= 0.0864743 CONNECTIONS: o EQ33 o DDC213
[ TS434 ] Animation
C1 ENERGY= 545.5 kJ/mol Energy+ZPE= 524.7 kJ/mol ZPE= 0.0899330 CONNECTIONS: o EQ33 o DDC214
[ TS435 ] Animation
C1 ENERGY= 554.8 kJ/mol Energy+ZPE= 536.3 kJ/mol ZPE= 0.0908114 CONNECTIONS: o EQ33 o DDC215
[ TS436 ] Animation
C1 ENERGY= 561.7 kJ/mol Energy+ZPE= 539.9 kJ/mol ZPE= 0.0895750 CONNECTIONS: o EQ33 o DDC216
[ TS437 ] Animation
C1 ENERGY= 635.9 kJ/mol Energy+ZPE= 597.6 kJ/mol ZPE= 0.0832887 CONNECTIONS: o EQ33 o DDC217
[ TS438 ] Animation
C1 ENERGY= 154.5 kJ/mol Energy+ZPE= 152.6 kJ/mol ZPE= 0.0971380 CONNECTIONS: o EQ34 o EQ34
[ TS439 ] Animation
C1 ENERGY= 171.5 kJ/mol Energy+ZPE= 168.2 kJ/mol ZPE= 0.0966163 CONNECTIONS: o EQ34 o EQ39
[ TS440 ] Animation
C1 ENERGY= 175.7 kJ/mol Energy+ZPE= 172.0 kJ/mol ZPE= 0.0964443 CONNECTIONS: o EQ34 o EQ39
[ TS441 ] Animation
C1 ENERGY= 196.1 kJ/mol Energy+ZPE= 191.0 kJ/mol ZPE= 0.0959081 CONNECTIONS: o EQ34 o EQ39
[ TS442 ] Animation
C1 ENERGY= 352.3 kJ/mol Energy+ZPE= 339.7 kJ/mol ZPE= 0.0930615 CONNECTIONS: o EQ34 o EQ47
[ TS443 ] Animation
C1 ENERGY= 406.9 kJ/mol Energy+ZPE= 385.6 kJ/mol ZPE= 0.0897612 CONNECTIONS: o EQ34 o EQ91
[ TS444 ] Animation
C1 ENERGY= 453.2 kJ/mol Energy+ZPE= 430.6 kJ/mol ZPE= 0.0892566 CONNECTIONS: o EQ34 o DDC218
[ TS445 ] Animation
C1 ENERGY= 506.0 kJ/mol Energy+ZPE= 474.4 kJ/mol ZPE= 0.0858222 CONNECTIONS: o EQ34 o DDC219
[ TS446 ] Animation
C1 ENERGY= 529.2 kJ/mol Energy+ZPE= 507.6 kJ/mol ZPE= 0.0896415 CONNECTIONS: o EQ34 o DDC220
[ TS447 ] Animation
C1 ENERGY= 544.8 kJ/mol Energy+ZPE= 529.2 kJ/mol ZPE= 0.0919071 CONNECTIONS: o EQ34 o DDC221
[ TS448 ] Animation
C1 ENERGY= 596.3 kJ/mol Energy+ZPE= 566.0 kJ/mol ZPE= 0.0863105 CONNECTIONS: o EQ34 o DDC222
[ TS449 ] Animation
C1 ENERGY= 603.2 kJ/mol Energy+ZPE= 567.6 kJ/mol ZPE= 0.0842942 CONNECTIONS: o EQ34 o DDC223
[ TS450 ] Animation
C1 ENERGY= 619.0 kJ/mol Energy+ZPE= 581.3 kJ/mol ZPE= 0.0834868 CONNECTIONS: o EQ34 o DDC224
[ TS451 ] Animation
C1 ENERGY= 629.3 kJ/mol Energy+ZPE= 589.5 kJ/mol ZPE= 0.0826990 CONNECTIONS: o EQ34 o DDC225
[ TS452 ] Animation
C1 ENERGY= 160.2 kJ/mol Energy+ZPE= 158.0 kJ/mol ZPE= 0.0970369 CONNECTIONS: o EQ35 o EQ35
[ TS453 ] Animation
Cs ENERGY= 167.7 kJ/mol Energy+ZPE= 166.1 kJ/mol ZPE= 0.0972507 CONNECTIONS: o EQ35 o EQ35
[ TS454 ] Animation
C1 ENERGY= 618.2 kJ/mol Energy+ZPE= 595.1 kJ/mol ZPE= 0.0890629 CONNECTIONS: o EQ35 o EQ35
[ TS455 ] Animation
C1 ENERGY= 154.2 kJ/mol Energy+ZPE= 152.3 kJ/mol ZPE= 0.0971468 CONNECTIONS: o EQ35 o EQ36
[ TS456 ] Animation
C1 ENERGY= 172.9 kJ/mol Energy+ZPE= 170.1 kJ/mol ZPE= 0.0967752 CONNECTIONS: o EQ35 o EQ41
[ TS457 ] Animation
C1 ENERGY= 174.0 kJ/mol Energy+ZPE= 171.4 kJ/mol ZPE= 0.0968559 CONNECTIONS: o EQ35 o EQ41
[ TS458 ] Animation
C1 ENERGY= 199.5 kJ/mol Energy+ZPE= 194.5 kJ/mol ZPE= 0.0959721 CONNECTIONS: o EQ35 o EQ41
[ TS459 ] Animation
Cs ENERGY= 499.6 kJ/mol Energy+ZPE= 483.0 kJ/mol ZPE= 0.0915465 CONNECTIONS: o EQ35 o EQ46
[ TS460 ] Animation
C1 ENERGY= 430.4 kJ/mol Energy+ZPE= 414.5 kJ/mol ZPE= 0.0917985 CONNECTIONS: o EQ35 o EQ102
[ TS461 ] Animation
C1 ENERGY= 434.6 kJ/mol Energy+ZPE= 418.3 kJ/mol ZPE= 0.0916632 CONNECTIONS: o EQ35 o EQ105
[ TS462 ] Animation
C1 ENERGY= 544.8 kJ/mol Energy+ZPE= 524.6 kJ/mol ZPE= 0.0901746 CONNECTIONS: o EQ35 o EQ118
[ TS463 ] Animation
Cs ENERGY= 356.4 kJ/mol Energy+ZPE= 341.1 kJ/mol ZPE= 0.0920454 CONNECTIONS: o EQ35 o DDC226
[ TS464 ] Animation
C1 ENERGY= 444.3 kJ/mol Energy+ZPE= 419.8 kJ/mol ZPE= 0.0885365 CONNECTIONS: o EQ35 o DDC227
[ TS465 ] Animation
C1 ENERGY= 446.7 kJ/mol Energy+ZPE= 421.7 kJ/mol ZPE= 0.0883309 CONNECTIONS: o EQ35 o DDC228
[ TS466 ] Animation
C1 ENERGY= 465.0 kJ/mol Energy+ZPE= 437.4 kJ/mol ZPE= 0.0873536 CONNECTIONS: o EQ35 o DDC229
[ TS467 ] Animation
C1 ENERGY= 500.3 kJ/mol Energy+ZPE= 477.2 kJ/mol ZPE= 0.0890460 CONNECTIONS: o EQ35 o DDC230
[ TS468 ] Animation
C1 ENERGY= 505.0 kJ/mol Energy+ZPE= 472.9 kJ/mol ZPE= 0.0856158 CONNECTIONS: o EQ35 o DDC231
[ TS469 ] Animation
C1 ENERGY= 506.0 kJ/mol Energy+ZPE= 473.4 kJ/mol ZPE= 0.0854476 CONNECTIONS: o EQ35 o DDC232
[ TS470 ] Animation
C1 ENERGY= 523.5 kJ/mol Energy+ZPE= 491.3 kJ/mol ZPE= 0.0856073 CONNECTIONS: o EQ35 o DDC233
[ TS471 ] Animation
C1 ENERGY= 531.5 kJ/mol Energy+ZPE= 504.4 kJ/mol ZPE= 0.0875511 CONNECTIONS: o EQ35 o DDC234
[ TS472 ] Animation
C1 ENERGY= 539.4 kJ/mol Energy+ZPE= 511.3 kJ/mol ZPE= 0.0871734 CONNECTIONS: o EQ35 o DDC235
[ TS473 ] Animation
C1 ENERGY= 551.8 kJ/mol Energy+ZPE= 536.1 kJ/mol ZPE= 0.0918645 CONNECTIONS: o EQ35 o DDC236
[ TS474 ] Animation
C1 ENERGY= 621.4 kJ/mol Energy+ZPE= 582.9 kJ/mol ZPE= 0.0831834 CONNECTIONS: o EQ35 o DDC237
[ TS475 ] Animation
C1 ENERGY= 625.2 kJ/mol Energy+ZPE= 587.1 kJ/mol ZPE= 0.0833615 CONNECTIONS: o EQ35 o DDC238
[ TS476 ] Animation
C1 ENERGY= 647.3 kJ/mol Energy+ZPE= 615.7 kJ/mol ZPE= 0.0858270 CONNECTIONS: o EQ35 o DDC239
[ TS477 ] Animation
C1 ENERGY= 893.4 kJ/mol Energy+ZPE= 851.8 kJ/mol ZPE= 0.0820052 CONNECTIONS: o EQ35 o DDC240
[ TS478 ] Animation
Cs ENERGY= 159.1 kJ/mol Energy+ZPE= 156.4 kJ/mol ZPE= 0.0968292 CONNECTIONS: o EQ36 o EQ36
[ TS479 ] Animation
C1 ENERGY= 169.9 kJ/mol Energy+ZPE= 167.0 kJ/mol ZPE= 0.0967625 CONNECTIONS: o EQ36 o EQ37
[ TS480 ] Animation
Cs ENERGY= 198.8 kJ/mol Energy+ZPE= 193.4 kJ/mol ZPE= 0.0957948 CONNECTIONS: o EQ36 o EQ37
[ TS481 ] Animation
C1 ENERGY= 464.5 kJ/mol Energy+ZPE= 449.0 kJ/mol ZPE= 0.0919702 CONNECTIONS: o EQ36 o EQ47
[ TS482 ] Animation
C1 ENERGY= 433.1 kJ/mol Energy+ZPE= 417.0 kJ/mol ZPE= 0.0917198 CONNECTIONS: o EQ36 o EQ107
[ TS483 ] Animation
C1 ENERGY= 541.6 kJ/mol Energy+ZPE= 523.6 kJ/mol ZPE= 0.0910014 CONNECTIONS: o EQ36 o EQ117
[ TS484 ] Animation
C1 ENERGY= 527.6 kJ/mol Energy+ZPE= 495.0 kJ/mol ZPE= 0.0854533 CONNECTIONS: o EQ36 o DDC241
[ TS485 ] Animation
C1 ENERGY= 614.7 kJ/mol Energy+ZPE= 584.4 kJ/mol ZPE= 0.0863282 CONNECTIONS: o EQ36 o DDC242
[ TS486 ] Animation
C1 ENERGY= 620.0 kJ/mol Energy+ZPE= 580.5 kJ/mol ZPE= 0.0828061 CONNECTIONS: o EQ36 o DDC243
[ TS487 ] Animation
C1 ENERGY= 629.5 kJ/mol Energy+ZPE= 590.5 kJ/mol ZPE= 0.0829992 CONNECTIONS: o EQ36 o DDC244
[ TS488 ] Animation
Cs ENERGY= 168.5 kJ/mol Energy+ZPE= 166.0 kJ/mol ZPE= 0.0969048 CONNECTIONS: o EQ37 o EQ37
[ TS489 ] Animation
C1 ENERGY= 169.6 kJ/mol Energy+ZPE= 167.3 kJ/mol ZPE= 0.0969723 CONNECTIONS: o EQ37 o EQ41
[ TS490 ] Animation
Cs ENERGY= 470.7 kJ/mol Energy+ZPE= 452.9 kJ/mol ZPE= 0.0910974 CONNECTIONS: o EQ37 o EQ47
[ TS491 ] Animation
C1 ENERGY= 455.1 kJ/mol Energy+ZPE= 437.7 kJ/mol ZPE= 0.0912252 CONNECTIONS: o EQ37 o EQ107
[ TS492 ] Animation
C1 ENERGY= 537.8 kJ/mol Energy+ZPE= 517.2 kJ/mol ZPE= 0.0900017 CONNECTIONS: o EQ37 o EQ114
[ TS493 ] Animation
C1 ENERGY= 526.2 kJ/mol Energy+ZPE= 495.1 kJ/mol ZPE= 0.0860271 CONNECTIONS: o EQ37 o DDC245
[ TS494 ] Animation
C1 ENERGY= 556.2 kJ/mol Energy+ZPE= 533.0 kJ/mol ZPE= 0.0890253 CONNECTIONS: o EQ37 o DDC246
[ TS495 ] Animation
C1 ENERGY= 648.0 kJ/mol Energy+ZPE= 605.3 kJ/mol ZPE= 0.0816149 CONNECTIONS: o EQ37 o DDC247
[ TS496 ] Animation
C1 ENERGY= 169.5 kJ/mol Energy+ZPE= 167.1 kJ/mol ZPE= 0.0969606 CONNECTIONS: o EQ38 o EQ38
[ TS497 ] Animation
C1 ENERGY= 174.7 kJ/mol Energy+ZPE= 171.9 kJ/mol ZPE= 0.0968113 CONNECTIONS: o EQ38 o EQ39
[ TS498 ] Animation
C1 ENERGY= 185.6 kJ/mol Energy+ZPE= 183.7 kJ/mol ZPE= 0.0971273 CONNECTIONS: o EQ38 o EQ40
[ TS499 ] Animation
C1 ENERGY= 376.8 kJ/mol Energy+ZPE= 353.4 kJ/mol ZPE= 0.0889405 CONNECTIONS: o EQ38 o DDC248
[ TS500 ] Animation
C1 ENERGY= 497.8 kJ/mol Energy+ZPE= 467.0 kJ/mol ZPE= 0.0861400 CONNECTIONS: o EQ38 o DDC249
[ TS501 ] Animation
C1 ENERGY= 170.2 kJ/mol Energy+ZPE= 167.7 kJ/mol ZPE= 0.0969028 CONNECTIONS: o EQ39 o EQ39
[ TS502 ] Animation
C1 ENERGY= 176.9 kJ/mol Energy+ZPE= 174.1 kJ/mol ZPE= 0.0968080 CONNECTIONS: o EQ39 o EQ40
[ TS503 ] Animation
C1 ENERGY= 423.6 kJ/mol Energy+ZPE= 401.3 kJ/mol ZPE= 0.0893564 CONNECTIONS: o EQ39 o EQ91
[ TS504 ] Animation
C1 ENERGY= 554.1 kJ/mol Energy+ZPE= 534.4 kJ/mol ZPE= 0.0903454 CONNECTIONS: o EQ39 o EQ112
[ TS505 ] Animation
C1 ENERGY= 371.7 kJ/mol Energy+ZPE= 347.6 kJ/mol ZPE= 0.0886857 CONNECTIONS: o EQ39 o DDC250
[ TS506 ] Animation
C1 ENERGY= 644.4 kJ/mol Energy+ZPE= 600.5 kJ/mol ZPE= 0.0811509 CONNECTIONS: o EQ39 o DDC251
[ TS507 ] Animation
C1 ENERGY= 651.5 kJ/mol Energy+ZPE= 619.7 kJ/mol ZPE= 0.0857587 CONNECTIONS: o EQ39 o DDC252
[ TS508 ] Animation
C1 ENERGY= 172.9 kJ/mol Energy+ZPE= 170.3 kJ/mol ZPE= 0.0968531 CONNECTIONS: o EQ40 o EQ40
[ TS509 ] Animation
C1 ENERGY= 606.3 kJ/mol Energy+ZPE= 583.4 kJ/mol ZPE= 0.0891437 CONNECTIONS: o EQ40 o EQ110
[ TS510 ] Animation
C1 ENERGY= 580.3 kJ/mol Energy+ZPE= 565.7 kJ/mol ZPE= 0.0923183 CONNECTIONS: o EQ40 o EQ111
[ TS511 ] Animation
C1 ENERGY= 409.0 kJ/mol Energy+ZPE= 389.0 kJ/mol ZPE= 0.0902246 CONNECTIONS: o EQ40 o DDC253
[ TS512 ] Animation
C1 ENERGY= 420.1 kJ/mol Energy+ZPE= 395.4 kJ/mol ZPE= 0.0884548 CONNECTIONS: o EQ40 o DDC254
[ TS513 ] Animation
C1 ENERGY= 484.9 kJ/mol Energy+ZPE= 460.9 kJ/mol ZPE= 0.0887311 CONNECTIONS: o EQ40 o DDC255
[ TS514 ] Animation
C1 ENERGY= 488.5 kJ/mol Energy+ZPE= 460.5 kJ/mol ZPE= 0.0872048 CONNECTIONS: o EQ40 o DDC256
[ TS515 ] Animation
C1 ENERGY= 635.2 kJ/mol Energy+ZPE= 598.6 kJ/mol ZPE= 0.0839117 CONNECTIONS: o EQ40 o DDC257
[ TS516 ] Animation
C1 ENERGY= 635.5 kJ/mol Energy+ZPE= 603.2 kJ/mol ZPE= 0.0855414 CONNECTIONS: o EQ40 o DDC258
[ TS517 ] Animation
C1 ENERGY= 649.3 kJ/mol Energy+ZPE= 614.7 kJ/mol ZPE= 0.0846766 CONNECTIONS: o EQ40 o DDC259
[ TS518 ] Animation
C1 ENERGY= 173.3 kJ/mol Energy+ZPE= 171.0 kJ/mol ZPE= 0.0969985 CONNECTIONS: o EQ41 o EQ41
[ TS519 ] Animation
Cs ENERGY= 184.8 kJ/mol Energy+ZPE= 183.1 kJ/mol ZPE= 0.0972049 CONNECTIONS: o EQ41 o EQ41
[ TS520 ] Animation
C1 ENERGY= 496.2 kJ/mol Energy+ZPE= 477.8 kJ/mol ZPE= 0.0908335 CONNECTIONS: o EQ41 o EQ46
[ TS521 ] Animation
C1 ENERGY= 460.0 kJ/mol Energy+ZPE= 442.2 kJ/mol ZPE= 0.0910927 CONNECTIONS: o EQ41 o EQ105
[ TS522 ] Animation
C1 ENERGY= 455.0 kJ/mol Energy+ZPE= 437.7 kJ/mol ZPE= 0.0912538 CONNECTIONS: o EQ41 o EQ110
[ TS523 ] Animation
C1 ENERGY= 473.9 kJ/mol Energy+ZPE= 448.4 kJ/mol ZPE= 0.0881438 CONNECTIONS: o EQ41 o DDC260
[ TS524 ] Animation
C1 ENERGY= 489.8 kJ/mol Energy+ZPE= 470.2 kJ/mol ZPE= 0.0903917 CONNECTIONS: o EQ41 o DDC261
[ TS525 ] Animation
C1 ENERGY= 495.1 kJ/mol Energy+ZPE= 461.7 kJ/mol ZPE= 0.0851297 CONNECTIONS: o EQ41 o DDC262
[ TS526 ] Animation
C1 ENERGY= 510.9 kJ/mol Energy+ZPE= 487.5 kJ/mol ZPE= 0.0889593 CONNECTIONS: o EQ41 o DDC263
[ TS527 ] Animation
C1 ENERGY= 518.7 kJ/mol Energy+ZPE= 494.2 kJ/mol ZPE= 0.0885394 CONNECTIONS: o EQ41 o DDC264
[ TS528 ] Animation
C1 ENERGY= 542.7 kJ/mol Energy+ZPE= 510.9 kJ/mol ZPE= 0.0857359 CONNECTIONS: o EQ41 o DDC265
[ TS529 ] Animation
C1 ENERGY= 628.9 kJ/mol Energy+ZPE= 591.5 kJ/mol ZPE= 0.0836155 CONNECTIONS: o EQ41 o DDC266
[ TS530 ] Animation
C1 ENERGY= 646.5 kJ/mol Energy+ZPE= 603.1 kJ/mol ZPE= 0.0813289 CONNECTIONS: o EQ41 o DDC267
[ TS531 ] Animation
C1 ENERGY= 675.0 kJ/mol Energy+ZPE= 639.9 kJ/mol ZPE= 0.0845026 CONNECTIONS: o EQ41 o DDC268
[ TS532 ] Animation
Cs ENERGY= 173.9 kJ/mol Energy+ZPE= 160.6 kJ/mol ZPE= 0.0927888 CONNECTIONS: o EQ42 o EQ42
[ TS533 ] Animation
C1 ENERGY= 176.5 kJ/mol Energy+ZPE= 164.7 kJ/mol ZPE= 0.0933788 CONNECTIONS: o EQ42 o EQ42
[ TS534 ] Animation
C1 ENERGY= 372.6 kJ/mol Energy+ZPE= 349.4 kJ/mol ZPE= 0.0890263 CONNECTIONS: o EQ42 o EQ42
[ TS535 ] Animation
C1 ENERGY= 397.0 kJ/mol Energy+ZPE= 373.4 kJ/mol ZPE= 0.0888740 CONNECTIONS: o EQ42 o EQ42
[ TS536 ] Animation
C1 ENERGY= 228.1 kJ/mol Energy+ZPE= 204.8 kJ/mol ZPE= 0.0889889 CONNECTIONS: o EQ42 o DDC269
[ TS537 ] Animation
C1 ENERGY= 403.5 kJ/mol Energy+ZPE= 363.7 kJ/mol ZPE= 0.0826915 CONNECTIONS: o EQ42 o DDC270
[ TS538 ] Animation
C1 ENERGY= 208.7 kJ/mol Energy+ZPE= 198.2 kJ/mol ZPE= 0.0938777 CONNECTIONS: o EQ43 o EQ43
[ TS539 ] Animation
Cs ENERGY= 210.6 kJ/mol Energy+ZPE= 198.6 kJ/mol ZPE= 0.0932862 CONNECTIONS: o EQ43 o EQ43
[ TS540 ] Animation
C1 ENERGY= 399.5 kJ/mol Energy+ZPE= 382.8 kJ/mol ZPE= 0.0914837 CONNECTIONS: o EQ43 o EQ60
[ TS541 ] Animation
C1 ENERGY= 657.3 kJ/mol Energy+ZPE= 625.7 kJ/mol ZPE= 0.0858294 CONNECTIONS: o EQ43 o EQ65
[ TS542 ] Animation
C1 ENERGY= 260.2 kJ/mol Energy+ZPE= 237.7 kJ/mol ZPE= 0.0892733 CONNECTIONS: o EQ43 o DDC271
[ TS543 ] Animation
C1 ENERGY= 425.7 kJ/mol Energy+ZPE= 394.1 kJ/mol ZPE= 0.0858198 CONNECTIONS: o EQ43 o DDC272
[ TS544 ] Animation
Cs ENERGY= 212.3 kJ/mol Energy+ZPE= 199.5 kJ/mol ZPE= 0.0930006 CONNECTIONS: o EQ44 o EQ44
[ TS545 ] Animation
C1 ENERGY= 222.6 kJ/mol Energy+ZPE= 208.1 kJ/mol ZPE= 0.0923289 CONNECTIONS: o EQ44 o EQ44
[ TS546 ] Animation
C1 ENERGY= 308.1 kJ/mol Energy+ZPE= 285.6 kJ/mol ZPE= 0.0892783 CONNECTIONS: o EQ44 o DDC273
[ TS547 ] Animation
C1 ENERGY= 312.8 kJ/mol Energy+ZPE= 290.9 kJ/mol ZPE= 0.0895046 CONNECTIONS: o EQ44 o DDC274
[ TS548 ] Animation
C1 ENERGY= 397.3 kJ/mol Energy+ZPE= 378.3 kJ/mol ZPE= 0.0906283 CONNECTIONS: o EQ44 o DDC275
[ TS549 ] Animation
C1 ENERGY= 696.7 kJ/mol Energy+ZPE= 667.5 kJ/mol ZPE= 0.0867243 CONNECTIONS: o EQ44 o DDC276
[ TS550 ] Animation
C1 ENERGY= 697.2 kJ/mol Energy+ZPE= 668.8 kJ/mol ZPE= 0.0870511 CONNECTIONS: o EQ44 o DDC277
[ TS551 ] Animation
C1 ENERGY= 230.6 kJ/mol Energy+ZPE= 221.4 kJ/mol ZPE= 0.0943740 CONNECTIONS: o EQ45 o EQ45
[ TS552 ] Animation
Cs ENERGY= 232.7 kJ/mol Energy+ZPE= 222.6 kJ/mol ZPE= 0.0940208 CONNECTIONS: o EQ45 o EQ45
[ TS553 ] Animation
C1 ENERGY= 462.7 kJ/mol Energy+ZPE= 439.3 kJ/mol ZPE= 0.0889461 CONNECTIONS: o EQ45 o EQ45
[ TS554 ] Animation
C1 ENERGY= 673.0 kJ/mol Energy+ZPE= 661.1 kJ/mol ZPE= 0.0933405 CONNECTIONS: o EQ45 o EQ45
[ TS555 ] Animation
C1 ENERGY= 658.2 kJ/mol Energy+ZPE= 645.7 kJ/mol ZPE= 0.0930821 CONNECTIONS: o EQ45 o EQ123
[ TS556 ] Animation
C1 ENERGY= 751.7 kJ/mol Energy+ZPE= 735.9 kJ/mol ZPE= 0.0918407 CONNECTIONS: o EQ45 o EQ126
[ TS557 ] Animation
C1 ENERGY= 281.8 kJ/mol Energy+ZPE= 259.4 kJ/mol ZPE= 0.0893253 CONNECTIONS: o EQ45 o DDC278
[ TS558 ] Animation
C1 ENERGY= 669.8 kJ/mol Energy+ZPE= 657.1 kJ/mol ZPE= 0.0930070 CONNECTIONS: o EQ45 o DDC279
[ TS559 ] Animation
C1 ENERGY= 242.4 kJ/mol Energy+ZPE= 242.5 kJ/mol ZPE= 0.0979090 CONNECTIONS: o EQ46 o EQ46
[ TS560 ] Animation
Cs ENERGY= 251.6 kJ/mol Energy+ZPE= 251.1 kJ/mol ZPE= 0.0976520 CONNECTIONS: o EQ46 o EQ46
[ TS561 ] Animation
C1 ENERGY= 251.8 kJ/mol Energy+ZPE= 251.2 kJ/mol ZPE= 0.0976259 CONNECTIONS: o EQ46 o EQ47
[ TS562 ] Animation
Cs ENERGY= 328.9 kJ/mol Energy+ZPE= 313.4 kJ/mol ZPE= 0.0919596 CONNECTIONS: o EQ46 o DDC280
[ TS563 ] Animation
C1 ENERGY= 454.9 kJ/mol Energy+ZPE= 430.1 kJ/mol ZPE= 0.0884120 CONNECTIONS: o EQ46 o DDC281
[ TS564 ] Animation
C1 ENERGY= 459.7 kJ/mol Energy+ZPE= 434.7 kJ/mol ZPE= 0.0883382 CONNECTIONS: o EQ46 o DDC282
[ TS565 ] Animation
C1 ENERGY= 690.7 kJ/mol Energy+ZPE= 665.4 kJ/mol ZPE= 0.0882293 CONNECTIONS: o EQ46 o DDC283
[ TS566 ] Animation
C1 ENERGY= 762.9 kJ/mol Energy+ZPE= 734.3 kJ/mol ZPE= 0.0869701 CONNECTIONS: o EQ46 o DDC284
[ TS567 ] Animation
Cs ENERGY= 245.1 kJ/mol Energy+ZPE= 244.9 kJ/mol ZPE= 0.0977698 CONNECTIONS: o EQ47 o EQ47
[ TS568 ] Animation
C1 ENERGY= 422.1 kJ/mol Energy+ZPE= 402.6 kJ/mol ZPE= 0.0904251 CONNECTIONS: o EQ47 o DDC285
[ TS569 ] Animation
C1 ENERGY= 461.9 kJ/mol Energy+ZPE= 436.2 kJ/mol ZPE= 0.0880656 CONNECTIONS: o EQ47 o DDC286
[ TS570 ] Animation
C1 ENERGY= 519.2 kJ/mol Energy+ZPE= 486.0 kJ/mol ZPE= 0.0852264 CONNECTIONS: o EQ47 o DDC287
[ TS571 ] Animation
C1 ENERGY= 709.8 kJ/mol Energy+ZPE= 673.7 kJ/mol ZPE= 0.0841109 CONNECTIONS: o EQ47 o DDC288
[ TS572 ] Animation
C1 ENERGY= 265.3 kJ/mol Energy+ZPE= 255.6 kJ/mol ZPE= 0.0941529 CONNECTIONS: o EQ48 o EQ48
[ TS573 ] Animation
Cs ENERGY= 268.0 kJ/mol Energy+ZPE= 257.9 kJ/mol ZPE= 0.0940013 CONNECTIONS: o EQ48 o EQ48
[ TS574 ] Animation
Cs ENERGY= 268.0 kJ/mol Energy+ZPE= 257.9 kJ/mol ZPE= 0.0939978 CONNECTIONS: o EQ48 o EQ48
[ TS575 ] Animation
C1 ENERGY= 271.9 kJ/mol Energy+ZPE= 261.5 kJ/mol ZPE= 0.0939074 CONNECTIONS: o EQ48 o EQ48
[ TS576 ] Animation
C1 ENERGY= 379.0 kJ/mol Energy+ZPE= 355.0 kJ/mol ZPE= 0.0887166 CONNECTIONS: o EQ48 o EQ52
[ TS577 ] Animation
C1 ENERGY= 287.3 kJ/mol Energy+ZPE= 267.5 kJ/mol ZPE= 0.0903231 CONNECTIONS: o EQ48 o DDC289
[ TS578 ] Animation
C1 ENERGY= 350.0 kJ/mol Energy+ZPE= 333.6 kJ/mol ZPE= 0.0916127 CONNECTIONS: o EQ48 o DDC290
[ TS579 ] Animation
C1 ENERGY= 356.2 kJ/mol Energy+ZPE= 338.3 kJ/mol ZPE= 0.0910475 CONNECTIONS: o EQ48 o DDC291
[ TS580 ] Animation
C1 ENERGY= 375.4 kJ/mol Energy+ZPE= 352.2 kJ/mol ZPE= 0.0890117 CONNECTIONS: o EQ48 o DDC292
[ TS581 ] Animation
C1 ENERGY= 468.2 kJ/mol Energy+ZPE= 445.4 kJ/mol ZPE= 0.0891950 CONNECTIONS: o EQ48 o DDC293
[ TS582 ] Animation
C1 ENERGY= 298.4 kJ/mol Energy+ZPE= 290.7 kJ/mol ZPE= 0.0949273 CONNECTIONS: o EQ50 o EQ50
[ TS583 ] Animation
C1 ENERGY= 302.2 kJ/mol Energy+ZPE= 294.0 kJ/mol ZPE= 0.0947563 CONNECTIONS: o EQ50 o EQ51
[ TS584 ] Animation
C1 ENERGY= 337.2 kJ/mol Energy+ZPE= 327.2 kJ/mol ZPE= 0.0940559 CONNECTIONS: o EQ50 o EQ51
[ TS585 ] Animation
C1 ENERGY= 389.4 kJ/mol Energy+ZPE= 373.6 kJ/mol ZPE= 0.0918556 CONNECTIONS: o EQ50 o EQ51
[ TS586 ] Animation
C1 ENERGY= 280.8 kJ/mol Energy+ZPE= 271.7 kJ/mol ZPE= 0.0943806 CONNECTIONS: o EQ50 o DDC294
[ TS587 ] Animation
C1 ENERGY= 366.7 kJ/mol Energy+ZPE= 347.5 kJ/mol ZPE= 0.0905421 CONNECTIONS: o EQ50 o DDC295
[ TS588 ] Animation
C1 ENERGY= 383.5 kJ/mol Energy+ZPE= 356.9 kJ/mol ZPE= 0.0877429 CONNECTIONS: o EQ50 o DDC296
[ TS589 ] Animation
C1 ENERGY= 388.6 kJ/mol Energy+ZPE= 362.2 kJ/mol ZPE= 0.0878013 CONNECTIONS: o EQ50 o DDC297
[ TS590 ] Animation
C1 ENERGY= 503.7 kJ/mol Energy+ZPE= 476.6 kJ/mol ZPE= 0.0875415 CONNECTIONS: o EQ50 o DDC298
[ TS591 ] Animation
C1 ENERGY= 305.6 kJ/mol Energy+ZPE= 295.1 kJ/mol ZPE= 0.0938653 CONNECTIONS: o EQ51 o EQ51
[ TS592 ] Animation
C1 ENERGY= 284.0 kJ/mol Energy+ZPE= 272.8 kJ/mol ZPE= 0.0935931 CONNECTIONS: o EQ51 o DDC299
[ TS593 ] Animation
C1 ENERGY= 351.9 kJ/mol Energy+ZPE= 329.1 kJ/mol ZPE= 0.0891831 CONNECTIONS: o EQ51 o DDC300
[ TS594 ] Animation
Cs ENERGY= 290.8 kJ/mol Energy+ZPE= 278.7 kJ/mol ZPE= 0.0932620 CONNECTIONS: o EQ52 o EQ52
[ TS595 ] Animation
C1 ENERGY= 297.7 kJ/mol Energy+ZPE= 284.4 kJ/mol ZPE= 0.0927767 CONNECTIONS: o EQ52 o EQ52
[ TS596 ] Animation
C1 ENERGY= 494.1 kJ/mol Energy+ZPE= 467.9 kJ/mol ZPE= 0.0878983 CONNECTIONS: o EQ52 o DDC301
[ TS597 ] Animation
C1 ENERGY= 686.4 kJ/mol Energy+ZPE= 645.2 kJ/mol ZPE= 0.0821521 CONNECTIONS: o EQ52 o DDC302
[ TS598 ] Animation
C1 ENERGY= 686.6 kJ/mol Energy+ZPE= 645.5 kJ/mol ZPE= 0.0821976 CONNECTIONS: o EQ52 o DDC303
[ TS599 ] Animation
C1 ENERGY= 332.8 kJ/mol Energy+ZPE= 308.2 kJ/mol ZPE= 0.0884757 CONNECTIONS: o EQ53 o DDC304
[ TS600 ] Animation
C1 ENERGY= 309.9 kJ/mol Energy+ZPE= 306.6 kJ/mol ZPE= 0.0966089 CONNECTIONS: o EQ55 o EQ55
[ TS601 ] Animation
C1 ENERGY= 330.0 kJ/mol Energy+ZPE= 324.5 kJ/mol ZPE= 0.0957507 CONNECTIONS: o EQ55 o EQ56
[ TS602 ] Animation
C1 ENERGY= 336.7 kJ/mol Energy+ZPE= 333.0 kJ/mol ZPE= 0.0964630 CONNECTIONS: o EQ55 o EQ57
[ TS603 ] Animation
C1 ENERGY= 318.9 kJ/mol Energy+ZPE= 313.7 kJ/mol ZPE= 0.0958628 CONNECTIONS: o EQ55 o EQ62
[ TS604 ] Animation
C1 ENERGY= 336.5 kJ/mol Energy+ZPE= 330.1 kJ/mol ZPE= 0.0954354 CONNECTIONS: o EQ55 o EQ62
[ TS605 ] Animation
C1 ENERGY= 321.2 kJ/mol Energy+ZPE= 318.0 kJ/mol ZPE= 0.0966371 CONNECTIONS: o EQ55 o EQ67
[ TS606 ] Animation
C1 ENERGY= 395.0 kJ/mol Energy+ZPE= 371.0 kJ/mol ZPE= 0.0887058 CONNECTIONS: o EQ55 o DDC305
[ TS607 ] Animation
C1 ENERGY= 405.3 kJ/mol Energy+ZPE= 381.6 kJ/mol ZPE= 0.0888339 CONNECTIONS: o EQ55 o DDC306
[ TS608 ] Animation
C1 ENERGY= 412.4 kJ/mol Energy+ZPE= 388.9 kJ/mol ZPE= 0.0889171 CONNECTIONS: o EQ55 o DDC307
[ TS609 ] Animation
C1 ENERGY= 413.7 kJ/mol Energy+ZPE= 388.5 kJ/mol ZPE= 0.0882594 CONNECTIONS: o EQ55 o DDC308
[ TS610 ] Animation
C1 ENERGY= 311.6 kJ/mol Energy+ZPE= 308.6 kJ/mol ZPE= 0.0967191 CONNECTIONS: o EQ56 o EQ56
[ TS611 ] Animation
C1 ENERGY= 306.7 kJ/mol Energy+ZPE= 303.3 kJ/mol ZPE= 0.0965515 CONNECTIONS: o EQ56 o EQ57
[ TS612 ] Animation
C1 ENERGY= 326.7 kJ/mol Energy+ZPE= 320.9 kJ/mol ZPE= 0.0956524 CONNECTIONS: o EQ56 o EQ57
[ TS613 ] Animation
C1 ENERGY= 344.9 kJ/mol Energy+ZPE= 340.8 kJ/mol ZPE= 0.0963127 CONNECTIONS: o EQ56 o EQ62
[ TS614 ] Animation
C1 ENERGY= 344.5 kJ/mol Energy+ZPE= 340.2 kJ/mol ZPE= 0.0962153 CONNECTIONS: o EQ56 o EQ67
[ TS615 ] Animation
C1 ENERGY= 345.1 kJ/mol Energy+ZPE= 339.9 kJ/mol ZPE= 0.0958827 CONNECTIONS: o EQ56 o EQ67
[ TS616 ] Animation
C1 ENERGY= 414.3 kJ/mol Energy+ZPE= 392.3 kJ/mol ZPE= 0.0894795 CONNECTIONS: o EQ56 o EQ101
[ TS617 ] Animation
C1 ENERGY= 328.2 kJ/mol Energy+ZPE= 318.1 kJ/mol ZPE= 0.0940285 CONNECTIONS: o EQ56 o DDC309
[ TS618 ] Animation
C1 ENERGY= 396.9 kJ/mol Energy+ZPE= 373.5 kJ/mol ZPE= 0.0889542 CONNECTIONS: o EQ56 o DDC310
[ TS619 ] Animation
C1 ENERGY= 475.3 kJ/mol Energy+ZPE= 457.1 kJ/mol ZPE= 0.0909384 CONNECTIONS: o EQ56 o DDC311
[ TS620 ] Animation
C1 ENERGY= 559.0 kJ/mol Energy+ZPE= 541.8 kJ/mol ZPE= 0.0913009 CONNECTIONS: o EQ56 o DDC312
[ TS621 ] Animation
C1 ENERGY= 631.6 kJ/mol Energy+ZPE= 614.9 kJ/mol ZPE= 0.0914827 CONNECTIONS: o EQ56 o DDC313
[ TS622 ] Animation
C1 ENERGY= 314.2 kJ/mol Energy+ZPE= 310.7 kJ/mol ZPE= 0.0965381 CONNECTIONS: o EQ57 o EQ57
[ TS623 ] Animation
C1 ENERGY= 340.2 kJ/mol Energy+ZPE= 332.9 kJ/mol ZPE= 0.0950702 CONNECTIONS: o EQ57 o EQ62
[ TS624 ] Animation
C1 ENERGY= 347.9 kJ/mol Energy+ZPE= 342.1 kJ/mol ZPE= 0.0956670 CONNECTIONS: o EQ57 o EQ77
[ TS625 ] Animation
C1 ENERGY= 332.8 kJ/mol Energy+ZPE= 322.2 kJ/mol ZPE= 0.0938112 CONNECTIONS: o EQ57 o DDC314
[ TS626 ] Animation
C1 ENERGY= 408.8 kJ/mol Energy+ZPE= 383.5 kJ/mol ZPE= 0.0882311 CONNECTIONS: o EQ57 o DDC315
[ TS627 ] Animation
C1 ENERGY= 408.8 kJ/mol Energy+ZPE= 386.6 kJ/mol ZPE= 0.0894097 CONNECTIONS: o EQ57 o DDC316
[ TS628 ] Animation
C1 ENERGY= 431.6 kJ/mol Energy+ZPE= 405.7 kJ/mol ZPE= 0.0879948 CONNECTIONS: o EQ57 o DDC317
[ TS629 ] Animation
C1 ENERGY= 476.1 kJ/mol Energy+ZPE= 458.0 kJ/mol ZPE= 0.0909506 CONNECTIONS: o EQ57 o DDC318
[ TS630 ] Animation
C1 ENERGY= 553.6 kJ/mol Energy+ZPE= 537.7 kJ/mol ZPE= 0.0918193 CONNECTIONS: o EQ57 o DDC319
[ TS631 ] Animation
C1 ENERGY= 304.0 kJ/mol Energy+ZPE= 297.1 kJ/mol ZPE= 0.0952253 CONNECTIONS: o EQ58 o EQ58
[ TS632 ] Animation
Cs ENERGY= 310.8 kJ/mol Energy+ZPE= 303.7 kJ/mol ZPE= 0.0951526 CONNECTIONS: o EQ58 o EQ58
[ TS633 ] Animation
Cs ENERGY= 307.4 kJ/mol Energy+ZPE= 299.5 kJ/mol ZPE= 0.0948611 CONNECTIONS: o EQ58 o DDC320
[ TS634 ] Animation
C1 ENERGY= 310.0 kJ/mol Energy+ZPE= 290.5 kJ/mol ZPE= 0.0904348 CONNECTIONS: o EQ58 o DDC321
[ TS635 ] Animation
C1 ENERGY= 316.4 kJ/mol Energy+ZPE= 312.4 kJ/mol ZPE= 0.0963520 CONNECTIONS: o EQ59 o EQ59
[ TS636 ] Animation
C1 ENERGY= 693.9 kJ/mol Energy+ZPE= 678.8 kJ/mol ZPE= 0.0921256 CONNECTIONS: o EQ59 o EQ59
[ TS637 ] Animation
C1 ENERGY= 313.8 kJ/mol Energy+ZPE= 304.4 kJ/mol ZPE= 0.0942956 CONNECTIONS: o EQ59 o EQ60
[ TS638 ] Animation
C1 ENERGY= 312.5 kJ/mol Energy+ZPE= 308.1 kJ/mol ZPE= 0.0961786 CONNECTIONS: o EQ59 o EQ61
[ TS639 ] Animation
C1 ENERGY= 331.1 kJ/mol Energy+ZPE= 325.8 kJ/mol ZPE= 0.0958254 CONNECTIONS: o EQ59 o EQ66
[ TS640 ] Animation
C1 ENERGY= 367.4 kJ/mol Energy+ZPE= 360.2 kJ/mol ZPE= 0.0951242 CONNECTIONS: o EQ59 o EQ66
[ TS641 ] Animation
C1 ENERGY= 396.4 kJ/mol Energy+ZPE= 386.9 kJ/mol ZPE= 0.0942330 CONNECTIONS: o EQ59 o EQ68
[ TS642 ] Animation
C1 ENERGY= 398.8 kJ/mol Energy+ZPE= 381.5 kJ/mol ZPE= 0.0912794 CONNECTIONS: o EQ59 o DDC322
[ TS643 ] Animation
C1 ENERGY= 426.5 kJ/mol Energy+ZPE= 404.5 kJ/mol ZPE= 0.0894705 CONNECTIONS: o EQ59 o DDC323
[ TS644 ] Animation
C1 ENERGY= 433.2 kJ/mol Energy+ZPE= 416.7 kJ/mol ZPE= 0.0915867 CONNECTIONS: o EQ59 o DDC324
[ TS645 ] Animation
C1 ENERGY= 666.3 kJ/mol Energy+ZPE= 648.3 kJ/mol ZPE= 0.0910198 CONNECTIONS: o EQ59 o DDC325
[ TS646 ] Animation
C1 ENERGY= 716.1 kJ/mol Energy+ZPE= 683.0 kJ/mol ZPE= 0.0852638 CONNECTIONS: o EQ59 o DDC326
[ TS647 ] Animation
C1 ENERGY= 318.4 kJ/mol Energy+ZPE= 314.0 kJ/mol ZPE= 0.0961925 CONNECTIONS: o EQ60 o EQ60
[ TS648 ] Animation
C1 ENERGY= 675.0 kJ/mol Energy+ZPE= 655.2 kJ/mol ZPE= 0.0903232 CONNECTIONS: o EQ60 o EQ60
[ TS649 ] Animation
C1 ENERGY= 314.1 kJ/mol Energy+ZPE= 305.4 kJ/mol ZPE= 0.0945648 CONNECTIONS: o EQ60 o EQ61
[ TS650 ] Animation
C1 ENERGY= 393.9 kJ/mol Energy+ZPE= 384.6 kJ/mol ZPE= 0.0943034 CONNECTIONS: o EQ60 o EQ66
[ TS651 ] Animation
C1 ENERGY= 333.1 kJ/mol Energy+ZPE= 328.2 kJ/mol ZPE= 0.0959972 CONNECTIONS: o EQ60 o EQ68
[ TS652 ] Animation
C1 ENERGY= 660.0 kJ/mol Energy+ZPE= 640.2 kJ/mol ZPE= 0.0903056 CONNECTIONS: o EQ60 o EQ122
[ TS653 ] Animation
C1 ENERGY= 401.0 kJ/mol Energy+ZPE= 378.5 kJ/mol ZPE= 0.0892966 CONNECTIONS: o EQ60 o DDC327
[ TS654 ] Animation
C1 ENERGY= 402.7 kJ/mol Energy+ZPE= 380.8 kJ/mol ZPE= 0.0895213 CONNECTIONS: o EQ60 o DDC328
[ TS655 ] Animation
C1 ENERGY= 630.0 kJ/mol Energy+ZPE= 600.5 kJ/mol ZPE= 0.0866151 CONNECTIONS: o EQ60 o DDC329
[ TS656 ] Animation
C1 ENERGY= 692.1 kJ/mol Energy+ZPE= 662.0 kJ/mol ZPE= 0.0863828 CONNECTIONS: o EQ60 o DDC330
[ TS657 ] Animation
C1 ENERGY= 709.9 kJ/mol Energy+ZPE= 675.8 kJ/mol ZPE= 0.0848578 CONNECTIONS: o EQ60 o DDC331
[ TS658 ] Animation
C1 ENERGY= 762.0 kJ/mol Energy+ZPE= 723.0 kJ/mol ZPE= 0.0830079 CONNECTIONS: o EQ60 o DDC332
[ TS659 ] Animation
C1 ENERGY= 315.9 kJ/mol Energy+ZPE= 311.7 kJ/mol ZPE= 0.0962789 CONNECTIONS: o EQ61 o EQ61
[ TS660 ] Animation
C1 ENERGY= 334.2 kJ/mol Energy+ZPE= 328.2 kJ/mol ZPE= 0.0955666 CONNECTIONS: o EQ61 o EQ69
[ TS661 ] Animation
C1 ENERGY= 398.9 kJ/mol Energy+ZPE= 388.4 kJ/mol ZPE= 0.0938764 CONNECTIONS: o EQ61 o EQ69
[ TS662 ] Animation
C1 ENERGY= 430.7 kJ/mol Energy+ZPE= 414.6 kJ/mol ZPE= 0.0917242 CONNECTIONS: o EQ61 o EQ71
[ TS663 ] Animation
C1 ENERGY= 655.0 kJ/mol Energy+ZPE= 633.2 kJ/mol ZPE= 0.0895407 CONNECTIONS: o EQ61 o EQ121
[ TS664 ] Animation
C1 ENERGY= 331.4 kJ/mol Energy+ZPE= 326.1 kJ/mol ZPE= 0.0958557 CONNECTIONS: o EQ62 o EQ62
[ TS665 ] Animation
C1 ENERGY= 349.4 kJ/mol Energy+ZPE= 344.1 kJ/mol ZPE= 0.0958472 CONNECTIONS: o EQ62 o EQ78
[ TS666 ] Animation
C1 ENERGY= 404.4 kJ/mol Energy+ZPE= 380.0 kJ/mol ZPE= 0.0885713 CONNECTIONS: o EQ62 o DDC333
[ TS667 ] Animation
C1 ENERGY= 410.2 kJ/mol Energy+ZPE= 389.0 kJ/mol ZPE= 0.0897719 CONNECTIONS: o EQ62 o DDC334
[ TS668 ] Animation
C1 ENERGY= 414.8 kJ/mol Energy+ZPE= 390.5 kJ/mol ZPE= 0.0886125 CONNECTIONS: o EQ62 o DDC335
[ TS669 ] Animation
C1 ENERGY= 416.7 kJ/mol Energy+ZPE= 390.4 kJ/mol ZPE= 0.0878517 CONNECTIONS: o EQ62 o DDC336
[ TS670 ] Animation
C1 ENERGY= 418.3 kJ/mol Energy+ZPE= 393.2 kJ/mol ZPE= 0.0883163 CONNECTIONS: o EQ62 o DDC337
[ TS671 ] Animation
C1 ENERGY= 658.7 kJ/mol Energy+ZPE= 635.7 kJ/mol ZPE= 0.0890903 CONNECTIONS: o EQ62 o DDC338
[ TS672 ] Animation
Cs ENERGY= 371.7 kJ/mol Energy+ZPE= 365.7 kJ/mol ZPE= 0.0955699 CONNECTIONS: o EQ63 o EQ63
[ TS673 ] Animation
C1 ENERGY= 343.2 kJ/mol Energy+ZPE= 339.7 kJ/mol ZPE= 0.0965135 CONNECTIONS: o EQ63 o EQ70
[ TS674 ] Animation
C1 ENERGY= 348.9 kJ/mol Energy+ZPE= 343.9 kJ/mol ZPE= 0.0959598 CONNECTIONS: o EQ63 o EQ76
[ TS675 ] Animation
C1 ENERGY= 352.0 kJ/mol Energy+ZPE= 347.3 kJ/mol ZPE= 0.0960708 CONNECTIONS: o EQ63 o EQ76
[ TS676 ] Animation
C1 ENERGY= 318.3 kJ/mol Energy+ZPE= 311.0 kJ/mol ZPE= 0.0950864 CONNECTIONS: o EQ63 o DDC339
[ TS677 ] Animation
C1 ENERGY= 338.6 kJ/mol Energy+ZPE= 335.7 kJ/mol ZPE= 0.0967746 CONNECTIONS: o EQ63 o DDC340
[ TS678 ] Animation
C1 ENERGY= 345.3 kJ/mol Energy+ZPE= 342.1 kJ/mol ZPE= 0.0966584 CONNECTIONS: o EQ63 o DDC341
[ TS679 ] Animation
C1 ENERGY= 323.9 kJ/mol Energy+ZPE= 314.2 kJ/mol ZPE= 0.0941749 CONNECTIONS: o EQ64 o EQ65
[ TS680 ] Animation
C1 ENERGY= 341.9 kJ/mol Energy+ZPE= 332.6 kJ/mol ZPE= 0.0943313 CONNECTIONS: o EQ64 o EQ65
[ TS681 ] Animation
C1 ENERGY= 350.1 kJ/mol Energy+ZPE= 337.9 kJ/mol ZPE= 0.0932206 CONNECTIONS: o EQ64 o EQ65
[ TS682 ] Animation
C1 ENERGY= 437.5 kJ/mol Energy+ZPE= 423.6 kJ/mol ZPE= 0.0925652 CONNECTIONS: o EQ64 o EQ65
[ TS683 ] Animation
C1 ENERGY= 409.3 kJ/mol Energy+ZPE= 391.2 kJ/mol ZPE= 0.0909712 CONNECTIONS: o EQ64 o EQ88
[ TS684 ] Animation
C1 ENERGY= 657.6 kJ/mol Energy+ZPE= 636.9 kJ/mol ZPE= 0.0899777 CONNECTIONS: o EQ64 o EQ122
[ TS685 ] Animation
C1 ENERGY= 334.4 kJ/mol Energy+ZPE= 316.3 kJ/mol ZPE= 0.0909664 CONNECTIONS: o EQ64 o DDC342
[ TS686 ] Animation
C1 ENERGY= 397.2 kJ/mol Energy+ZPE= 380.9 kJ/mol ZPE= 0.0916380 CONNECTIONS: o EQ64 o DDC343
[ TS687 ] Animation
C1 ENERGY= 413.6 kJ/mol Energy+ZPE= 394.9 kJ/mol ZPE= 0.0907474 CONNECTIONS: o EQ64 o DDC344
[ TS688 ] Animation
C1 ENERGY= 414.5 kJ/mol Energy+ZPE= 398.3 kJ/mol ZPE= 0.0916899 CONNECTIONS: o EQ64 o DDC345
[ TS689 ] Animation
C1 ENERGY= 426.9 kJ/mol Energy+ZPE= 412.5 kJ/mol ZPE= 0.0923908 CONNECTIONS: o EQ64 o DDC346
[ TS690 ] Animation
C1 ENERGY= 428.9 kJ/mol Energy+ZPE= 410.3 kJ/mol ZPE= 0.0907846 CONNECTIONS: o EQ64 o DDC347
[ TS691 ] Animation
C1 ENERGY= 436.5 kJ/mol Energy+ZPE= 418.5 kJ/mol ZPE= 0.0909878 CONNECTIONS: o EQ64 o DDC348
[ TS692 ] Animation
C1 ENERGY= 577.3 kJ/mol Energy+ZPE= 559.1 kJ/mol ZPE= 0.0909467 CONNECTIONS: o EQ64 o DDC349
[ TS693 ] Animation
C1 ENERGY= 606.7 kJ/mol Energy+ZPE= 564.5 kJ/mol ZPE= 0.0817931 CONNECTIONS: o EQ64 o DDC350
[ TS694 ] Animation
C1 ENERGY= 438.3 kJ/mol Energy+ZPE= 421.1 kJ/mol ZPE= 0.0913251 CONNECTIONS: o EQ65 o EQ80
[ TS695 ] Animation
C1 ENERGY= 416.2 kJ/mol Energy+ZPE= 398.4 kJ/mol ZPE= 0.0910756 CONNECTIONS: o EQ65 o EQ86
[ TS696 ] Animation
C1 ENERGY= 412.3 kJ/mol Energy+ZPE= 394.3 kJ/mol ZPE= 0.0909886 CONNECTIONS: o EQ65 o EQ93
[ TS697 ] Animation
C1 ENERGY= 417.7 kJ/mol Energy+ZPE= 398.4 kJ/mol ZPE= 0.0905265 CONNECTIONS: o EQ65 o EQ93
[ TS698 ] Animation
C1 ENERGY= 432.1 kJ/mol Energy+ZPE= 413.2 kJ/mol ZPE= 0.0906544 CONNECTIONS: o EQ65 o EQ94
[ TS699 ] Animation
C1 ENERGY= 661.3 kJ/mol Energy+ZPE= 640.3 kJ/mol ZPE= 0.0898517 CONNECTIONS: o EQ65 o EQ125
[ TS700 ] Animation
C1 ENERGY= 334.5 kJ/mol Energy+ZPE= 316.5 kJ/mol ZPE= 0.0910112 CONNECTIONS: o EQ65 o DDC351
[ TS701 ] Animation
C1 ENERGY= 399.1 kJ/mol Energy+ZPE= 382.8 kJ/mol ZPE= 0.0916538 CONNECTIONS: o EQ65 o DDC352
[ TS702 ] Animation
C1 ENERGY= 415.2 kJ/mol Energy+ZPE= 399.1 kJ/mol ZPE= 0.0917215 CONNECTIONS: o EQ65 o DDC353
[ TS703 ] Animation
C1 ENERGY= 423.0 kJ/mol Energy+ZPE= 403.9 kJ/mol ZPE= 0.0905760 CONNECTIONS: o EQ65 o DDC354
[ TS704 ] Animation
C1 ENERGY= 425.8 kJ/mol Energy+ZPE= 411.5 kJ/mol ZPE= 0.0924119 CONNECTIONS: o EQ65 o DDC355
[ TS705 ] Animation
C1 ENERGY= 484.2 kJ/mol Energy+ZPE= 457.6 kJ/mol ZPE= 0.0877190 CONNECTIONS: o EQ65 o DDC356
[ TS706 ] Animation
C1 ENERGY= 493.5 kJ/mol Energy+ZPE= 469.8 kJ/mol ZPE= 0.0888224 CONNECTIONS: o EQ65 o DDC357
[ TS707 ] Animation
C1 ENERGY= 332.2 kJ/mol Energy+ZPE= 325.7 kJ/mol ZPE= 0.0953997 CONNECTIONS: o EQ66 o EQ66
[ TS708 ] Animation
C1 ENERGY= 330.5 kJ/mol Energy+ZPE= 322.5 kJ/mol ZPE= 0.0948120 CONNECTIONS: o EQ66 o EQ69
[ TS709 ] Animation
C1 ENERGY= 686.6 kJ/mol Energy+ZPE= 664.2 kJ/mol ZPE= 0.0893359 CONNECTIONS: o EQ66 o EQ122
[ TS710 ] Animation
C1 ENERGY= 328.3 kJ/mol Energy+ZPE= 316.1 kJ/mol ZPE= 0.0931985 CONNECTIONS: o EQ66 o DDC358
[ TS711 ] Animation
C1 ENERGY= 394.5 kJ/mol Energy+ZPE= 373.3 kJ/mol ZPE= 0.0897700 CONNECTIONS: o EQ66 o DDC359
[ TS712 ] Animation
C1 ENERGY= 419.0 kJ/mol Energy+ZPE= 399.7 kJ/mol ZPE= 0.0905053 CONNECTIONS: o EQ66 o DDC360
[ TS713 ] Animation
C1 ENERGY= 423.2 kJ/mol Energy+ZPE= 399.9 kJ/mol ZPE= 0.0890047 CONNECTIONS: o EQ66 o DDC361
[ TS714 ] Animation
C1 ENERGY= 619.0 kJ/mol Energy+ZPE= 593.2 kJ/mol ZPE= 0.0880152 CONNECTIONS: o EQ66 o DDC362
[ TS715 ] Animation
C1 ENERGY= 350.6 kJ/mol Energy+ZPE= 343.8 kJ/mol ZPE= 0.0952752 CONNECTIONS: o EQ67 o EQ78
[ TS716 ] Animation
C1 ENERGY= 423.5 kJ/mol Energy+ZPE= 398.6 kJ/mol ZPE= 0.0883576 CONNECTIONS: o EQ67 o DDC363
[ TS717 ] Animation
C1 ENERGY= 334.5 kJ/mol Energy+ZPE= 327.1 kJ/mol ZPE= 0.0950483 CONNECTIONS: o EQ68 o EQ68
[ TS718 ] Animation
C1 ENERGY= 388.3 kJ/mol Energy+ZPE= 372.0 kJ/mol ZPE= 0.0916370 CONNECTIONS: o EQ68 o DDC364
[ TS719 ] Animation
C1 ENERGY= 399.0 kJ/mol Energy+ZPE= 375.1 kJ/mol ZPE= 0.0887495 CONNECTIONS: o EQ68 o DDC365
[ TS720 ] Animation
C1 ENERGY= 420.8 kJ/mol Energy+ZPE= 402.0 kJ/mol ZPE= 0.0907146 CONNECTIONS: o EQ68 o DDC366
[ TS721 ] Animation
C1 ENERGY= 494.3 kJ/mol Energy+ZPE= 464.2 kJ/mol ZPE= 0.0863986 CONNECTIONS: o EQ68 o DDC367
[ TS722 ] Animation
C1 ENERGY= 331.2 kJ/mol Energy+ZPE= 324.5 kJ/mol ZPE= 0.0952954 CONNECTIONS: o EQ69 o EQ69
[ TS723 ] Animation
C1 ENERGY= 441.8 kJ/mol Energy+ZPE= 424.2 kJ/mol ZPE= 0.0911723 CONNECTIONS: o EQ69 o EQ72
[ TS724 ] Animation
C1 ENERGY= 329.9 kJ/mol Energy+ZPE= 317.6 kJ/mol ZPE= 0.0931946 CONNECTIONS: o EQ69 o DDC368
[ TS725 ] Animation
C1 ENERGY= 392.2 kJ/mol Energy+ZPE= 371.5 kJ/mol ZPE= 0.0899667 CONNECTIONS: o EQ69 o DDC369
[ TS726 ] Animation
Cs ENERGY= 353.9 kJ/mol Energy+ZPE= 349.3 kJ/mol ZPE= 0.0961007 CONNECTIONS: o EQ70 o EQ70
[ TS727 ] Animation
C1 ENERGY= 348.5 kJ/mol Energy+ZPE= 344.6 kJ/mol ZPE= 0.0963693 CONNECTIONS: o EQ70 o EQ71
[ TS728 ] Animation
C1 ENERGY= 349.5 kJ/mol Energy+ZPE= 345.7 kJ/mol ZPE= 0.0964145 CONNECTIONS: o EQ70 o EQ72
[ TS729 ] Animation
C1 ENERGY= 366.3 kJ/mol Energy+ZPE= 357.4 kJ/mol ZPE= 0.0944869 CONNECTIONS: o EQ70 o EQ72
[ TS730 ] Animation
C1 ENERGY= 334.7 kJ/mol Energy+ZPE= 330.3 kJ/mol ZPE= 0.0961967 CONNECTIONS: o EQ70 o EQ73
[ TS731 ] Animation
C1 ENERGY= 352.7 kJ/mol Energy+ZPE= 348.5 kJ/mol ZPE= 0.0962639 CONNECTIONS: o EQ70 o EQ76
[ TS732 ] Animation
C1 ENERGY= 406.8 kJ/mol Energy+ZPE= 389.0 kJ/mol ZPE= 0.0910879 CONNECTIONS: o EQ70 o DDC370
[ TS733 ] Animation
C1 ENERGY= 407.7 kJ/mol Energy+ZPE= 388.1 kJ/mol ZPE= 0.0903832 CONNECTIONS: o EQ70 o DDC371
[ TS734 ] Animation
C1 ENERGY= 412.4 kJ/mol Energy+ZPE= 394.6 kJ/mol ZPE= 0.0910655 CONNECTIONS: o EQ70 o DDC372
[ TS735 ] Animation
C1 ENERGY= 413.4 kJ/mol Energy+ZPE= 394.7 kJ/mol ZPE= 0.0907543 CONNECTIONS: o EQ70 o DDC373
[ TS736 ] Animation
C1 ENERGY= 414.6 kJ/mol Energy+ZPE= 394.0 kJ/mol ZPE= 0.0900296 CONNECTIONS: o EQ70 o DDC374
[ TS737 ] Animation
C1 ENERGY= 488.6 kJ/mol Energy+ZPE= 463.2 kJ/mol ZPE= 0.0881713 CONNECTIONS: o EQ70 o DDC375
[ TS738 ] Animation
C1 ENERGY= 337.8 kJ/mol Energy+ZPE= 333.3 kJ/mol ZPE= 0.0961517 CONNECTIONS: o EQ71 o EQ72
[ TS739 ] Animation
C1 ENERGY= 357.5 kJ/mol Energy+ZPE= 351.9 kJ/mol ZPE= 0.0957184 CONNECTIONS: o EQ71 o EQ72
[ TS740 ] Animation
C1 ENERGY= 335.2 kJ/mol Energy+ZPE= 330.5 kJ/mol ZPE= 0.0960626 CONNECTIONS: o EQ71 o EQ74
[ TS741 ] Animation
C1 ENERGY= 353.4 kJ/mol Energy+ZPE= 349.0 kJ/mol ZPE= 0.0962032 CONNECTIONS: o EQ71 o EQ79
[ TS742 ] Animation
C1 ENERGY= 337.4 kJ/mol Energy+ZPE= 334.2 kJ/mol ZPE= 0.0966416 CONNECTIONS: o EQ71 o DDC376
[ TS743 ] Animation
C1 ENERGY= 342.6 kJ/mol Energy+ZPE= 339.0 kJ/mol ZPE= 0.0964923 CONNECTIONS: o EQ72 o DDC377
[ TS744 ] Animation
C1 ENERGY= 396.7 kJ/mol Energy+ZPE= 372.1 kJ/mol ZPE= 0.0885087 CONNECTIONS: o EQ72 o DDC378
[ TS745 ] Animation
C1 ENERGY= 557.1 kJ/mol Energy+ZPE= 533.4 kJ/mol ZPE= 0.0888453 CONNECTIONS: o EQ72 o DDC379
[ TS746 ] Animation
C1 ENERGY= 607.4 kJ/mol Energy+ZPE= 594.0 kJ/mol ZPE= 0.0927711 CONNECTIONS: o EQ72 o DDC380
[ TS747 ] Animation
Cs ENERGY= 340.2 kJ/mol Energy+ZPE= 335.0 kJ/mol ZPE= 0.0958613 CONNECTIONS: o EQ74 o EQ74
[ TS748 ] Animation
Cs ENERGY= 475.9 kJ/mol Energy+ZPE= 464.0 kJ/mol ZPE= 0.0933211 CONNECTIONS: o EQ74 o DDC381
[ TS749 ] Animation
C1 ENERGY= 381.8 kJ/mol Energy+ZPE= 372.3 kJ/mol ZPE= 0.0942301 CONNECTIONS: o EQ76 o EQ79
[ TS750 ] Animation
C1 ENERGY= 347.7 kJ/mol Energy+ZPE= 341.6 kJ/mol ZPE= 0.0955441 CONNECTIONS: o EQ77 o EQ78
[ TS751 ] Animation
C1 ENERGY= 412.4 kJ/mol Energy+ZPE= 387.0 kJ/mol ZPE= 0.0881890 CONNECTIONS: o EQ77 o DDC382
[ TS752 ] Animation
C1 ENERGY= 429.0 kJ/mol Energy+ZPE= 403.4 kJ/mol ZPE= 0.0881110 CONNECTIONS: o EQ78 o DDC383
[ TS753 ] Animation
C1 ENERGY= 550.2 kJ/mol Energy+ZPE= 525.1 kJ/mol ZPE= 0.0882982 CONNECTIONS: o EQ78 o DDC384
[ TS754 ] Animation
C1 ENERGY= 353.5 kJ/mol Energy+ZPE= 348.5 kJ/mol ZPE= 0.0959436 CONNECTIONS: o EQ79 o DDC385
[ TS755 ] Animation
C1 ENERGY= 359.3 kJ/mol Energy+ZPE= 353.4 kJ/mol ZPE= 0.0956130 CONNECTIONS: o EQ79 o DDC386
[ TS756 ] Animation
C1 ENERGY= 400.9 kJ/mol Energy+ZPE= 380.4 kJ/mol ZPE= 0.0900535 CONNECTIONS: o EQ79 o DDC387
[ TS757 ] Animation
C1 ENERGY= 392.1 kJ/mol Energy+ZPE= 384.7 kJ/mol ZPE= 0.0950491 CONNECTIONS: o EQ80 o EQ81
[ TS758 ] Animation
C1 ENERGY= 388.0 kJ/mol Energy+ZPE= 377.4 kJ/mol ZPE= 0.0938246 CONNECTIONS: o EQ80 o EQ83
[ TS759 ] Animation
C1 ENERGY= 416.0 kJ/mol Energy+ZPE= 401.9 kJ/mol ZPE= 0.0924844 CONNECTIONS: o EQ80 o EQ83
[ TS760 ] Animation
C1 ENERGY= 404.8 kJ/mol Energy+ZPE= 390.9 kJ/mol ZPE= 0.0925571 CONNECTIONS: o EQ80 o EQ89
[ TS761 ] Animation
C1 ENERGY= 408.0 kJ/mol Energy+ZPE= 388.2 kJ/mol ZPE= 0.0903014 CONNECTIONS: o EQ80 o EQ90
[ TS762 ] Animation
C1 ENERGY= 372.1 kJ/mol Energy+ZPE= 359.1 kJ/mol ZPE= 0.0929172 CONNECTIONS: o EQ80 o DDC388
[ TS763 ] Animation
C1 ENERGY= 394.1 kJ/mol Energy+ZPE= 372.3 kJ/mol ZPE= 0.0895624 CONNECTIONS: o EQ80 o DDC389
[ TS764 ] Animation
C1 ENERGY= 401.4 kJ/mol Energy+ZPE= 380.1 kJ/mol ZPE= 0.0897466 CONNECTIONS: o EQ80 o DDC390
[ TS765 ] Animation
C1 ENERGY= 506.3 kJ/mol Energy+ZPE= 481.0 kJ/mol ZPE= 0.0882058 CONNECTIONS: o EQ80 o DDC391
[ TS766 ] Animation
C1 ENERGY= 399.1 kJ/mol Energy+ZPE= 388.5 kJ/mol ZPE= 0.0938066 CONNECTIONS: o EQ81 o EQ82
[ TS767 ] Animation
C1 ENERGY= 405.5 kJ/mol Energy+ZPE= 394.0 kJ/mol ZPE= 0.0934645 CONNECTIONS: o EQ81 o EQ82
[ TS768 ] Animation
C1 ENERGY= 406.8 kJ/mol Energy+ZPE= 390.8 kJ/mol ZPE= 0.0917535 CONNECTIONS: o EQ81 o EQ82
[ TS769 ] Animation
C1 ENERGY= 408.2 kJ/mol Energy+ZPE= 389.7 kJ/mol ZPE= 0.0908090 CONNECTIONS: o EQ81 o EQ93
[ TS770 ] Animation
C1 ENERGY= 416.8 kJ/mol Energy+ZPE= 396.4 kJ/mol ZPE= 0.0900816 CONNECTIONS: o EQ81 o EQ94
[ TS771 ] Animation
C1 ENERGY= 369.5 kJ/mol Energy+ZPE= 355.7 kJ/mol ZPE= 0.0926140 CONNECTIONS: o EQ81 o DDC392
[ TS772 ] Animation
C1 ENERGY= 402.6 kJ/mol Energy+ZPE= 380.8 kJ/mol ZPE= 0.0895467 CONNECTIONS: o EQ81 o DDC393
[ TS773 ] Animation
C1 ENERGY= 403.6 kJ/mol Energy+ZPE= 381.4 kJ/mol ZPE= 0.0894161 CONNECTIONS: o EQ81 o DDC394
[ TS774 ] Animation
C1 ENERGY= 416.6 kJ/mol Energy+ZPE= 407.1 kJ/mol ZPE= 0.0942536 CONNECTIONS: o EQ82 o EQ83
[ TS775 ] Animation
C1 ENERGY= 382.2 kJ/mol Energy+ZPE= 367.5 kJ/mol ZPE= 0.0922706 CONNECTIONS: o EQ82 o DDC395
[ TS776 ] Animation
C1 ENERGY= 409.9 kJ/mol Energy+ZPE= 387.2 kJ/mol ZPE= 0.0892126 CONNECTIONS: o EQ82 o DDC396
[ TS777 ] Animation
C1 ENERGY= 384.2 kJ/mol Energy+ZPE= 369.2 kJ/mol ZPE= 0.0921342 CONNECTIONS: o EQ83 o DDC397
[ TS778 ] Animation
C1 ENERGY= 409.1 kJ/mol Energy+ZPE= 387.1 kJ/mol ZPE= 0.0894774 CONNECTIONS: o EQ83 o DDC398
[ TS779 ] Animation
C1 ENERGY= 458.2 kJ/mol Energy+ZPE= 436.7 kJ/mol ZPE= 0.0896566 CONNECTIONS: o EQ83 o DDC399
[ TS780 ] Animation
C1 ENERGY= 410.4 kJ/mol Energy+ZPE= 400.0 kJ/mol ZPE= 0.0938963 CONNECTIONS: o EQ84 o EQ85
[ TS781 ] Animation
C1 ENERGY= 410.3 kJ/mol Energy+ZPE= 399.8 kJ/mol ZPE= 0.0938780 CONNECTIONS: o EQ84 o EQ92
[ TS782 ] Animation
C1 ENERGY= 408.4 kJ/mol Energy+ZPE= 398.9 kJ/mol ZPE= 0.0942381 CONNECTIONS: o EQ84 o EQ97
[ TS783 ] Animation
C1 ENERGY= 412.4 kJ/mol Energy+ZPE= 403.5 kJ/mol ZPE= 0.0944722 CONNECTIONS: o EQ84 o EQ98
[ TS784 ] Animation
C1 ENERGY= 393.3 kJ/mol Energy+ZPE= 382.9 kJ/mol ZPE= 0.0938861 CONNECTIONS: o EQ84 o DDC400
[ TS785 ] Animation
C1 ENERGY= 411.9 kJ/mol Energy+ZPE= 403.3 kJ/mol ZPE= 0.0945884 CONNECTIONS: o EQ84 o DDC401
[ TS786 ] Animation
C1 ENERGY= 469.4 kJ/mol Energy+ZPE= 446.3 kJ/mol ZPE= 0.0890804 CONNECTIONS: o EQ84 o DDC402
[ TS787 ] Animation
C1 ENERGY= 515.5 kJ/mol Energy+ZPE= 484.5 kJ/mol ZPE= 0.0860601 CONNECTIONS: o EQ84 o DDC403
[ TS788 ] Animation
C1 ENERGY= 407.1 kJ/mol Energy+ZPE= 398.0 kJ/mol ZPE= 0.0943891 CONNECTIONS: o EQ85 o EQ95
[ TS789 ] Animation
C1 ENERGY= 431.7 kJ/mol Energy+ZPE= 421.1 kJ/mol ZPE= 0.0938166 CONNECTIONS: o EQ85 o EQ95
[ TS790 ] Animation
C1 ENERGY= 416.1 kJ/mol Energy+ZPE= 405.9 kJ/mol ZPE= 0.0939882 CONNECTIONS: o EQ85 o EQ98
[ TS791 ] Animation
C1 ENERGY= 394.0 kJ/mol Energy+ZPE= 383.9 kJ/mol ZPE= 0.0940084 CONNECTIONS: o EQ85 o DDC404
[ TS792 ] Animation
C1 ENERGY= 431.2 kJ/mol Energy+ZPE= 419.8 kJ/mol ZPE= 0.0935253 CONNECTIONS: o EQ85 o DDC405
[ TS793 ] Animation
C1 ENERGY= 458.3 kJ/mol Energy+ZPE= 439.7 kJ/mol ZPE= 0.0907788 CONNECTIONS: o EQ85 o DDC406
[ TS794 ] Animation
C1 ENERGY= 467.9 kJ/mol Energy+ZPE= 444.8 kJ/mol ZPE= 0.0890506 CONNECTIONS: o EQ85 o DDC407
[ TS795 ] Animation
C1 ENERGY= 404.7 kJ/mol Energy+ZPE= 382.1 kJ/mol ZPE= 0.0892616 CONNECTIONS: o EQ86 o EQ96
[ TS796 ] Animation
C1 ENERGY= 399.8 kJ/mol Energy+ZPE= 377.3 kJ/mol ZPE= 0.0893087 CONNECTIONS: o EQ86 o DDC408
[ TS797 ] Animation
C1 ENERGY= 403.8 kJ/mol Energy+ZPE= 381.1 kJ/mol ZPE= 0.0892303 CONNECTIONS: o EQ86 o DDC409
[ TS798 ] Animation
C1 ENERGY= 407.5 kJ/mol Energy+ZPE= 385.5 kJ/mol ZPE= 0.0894716 CONNECTIONS: o EQ86 o DDC410
[ TS799 ] Animation
C1 ENERGY= 490.7 kJ/mol Energy+ZPE= 463.3 kJ/mol ZPE= 0.0874142 CONNECTIONS: o EQ86 o DDC411
[ TS800 ] Animation
C1 ENERGY= 403.2 kJ/mol Energy+ZPE= 386.3 kJ/mol ZPE= 0.0914065 CONNECTIONS: o EQ87 o EQ94
[ TS801 ] Animation
C1 ENERGY= 403.2 kJ/mol Energy+ZPE= 380.9 kJ/mol ZPE= 0.0893600 CONNECTIONS: o EQ87 o DDC412
[ TS802 ] Animation
C1 ENERGY= 408.8 kJ/mol Energy+ZPE= 386.8 kJ/mol ZPE= 0.0894842 CONNECTIONS: o EQ87 o DDC413
[ TS803 ] Animation
C1 ENERGY= 401.7 kJ/mol Energy+ZPE= 385.0 kJ/mol ZPE= 0.0915043 CONNECTIONS: o EQ88 o EQ93
[ TS804 ] Animation
C1 ENERGY= 404.4 kJ/mol Energy+ZPE= 382.2 kJ/mol ZPE= 0.0894198 CONNECTIONS: o EQ88 o DDC414
[ TS805 ] Animation
C1 ENERGY= 412.1 kJ/mol Energy+ZPE= 390.0 kJ/mol ZPE= 0.0894516 CONNECTIONS: o EQ88 o DDC415
[ TS806 ] Animation
C1 ENERGY= 488.3 kJ/mol Energy+ZPE= 466.7 kJ/mol ZPE= 0.0896454 CONNECTIONS: o EQ88 o DDC416
[ TS807 ] Animation
C1 ENERGY= 400.3 kJ/mol Energy+ZPE= 382.1 kJ/mol ZPE= 0.0909421 CONNECTIONS: o EQ89 o EQ90
[ TS808 ] Animation
C1 ENERGY= 403.5 kJ/mol Energy+ZPE= 381.1 kJ/mol ZPE= 0.0893363 CONNECTIONS: o EQ90 o DDC417
[ TS809 ] Animation
C1 ENERGY= 409.7 kJ/mol Energy+ZPE= 387.8 kJ/mol ZPE= 0.0895212 CONNECTIONS: o EQ90 o DDC418
[ TS810 ] Animation
C1 ENERGY= 410.9 kJ/mol Energy+ZPE= 388.5 kJ/mol ZPE= 0.0893321 CONNECTIONS: o EQ90 o DDC419
[ TS811 ] Animation
C1 ENERGY= 419.8 kJ/mol Energy+ZPE= 405.0 kJ/mol ZPE= 0.0922305 CONNECTIONS: o EQ91 o EQ106
[ TS812 ] Animation
C1 ENERGY= 404.7 kJ/mol Energy+ZPE= 385.2 kJ/mol ZPE= 0.0904195 CONNECTIONS: o EQ91 o DDC420
[ TS813 ] Animation
C1 ENERGY= 418.3 kJ/mol Energy+ZPE= 401.0 kJ/mol ZPE= 0.0912672 CONNECTIONS: o EQ91 o DDC421
[ TS814 ] Animation
C1 ENERGY= 493.7 kJ/mol Energy+ZPE= 465.6 kJ/mol ZPE= 0.0871635 CONNECTIONS: o EQ91 o DDC422
[ TS815 ] Animation
C1 ENERGY= 412.2 kJ/mol Energy+ZPE= 403.1 kJ/mol ZPE= 0.0944017 CONNECTIONS: o EQ92 o EQ100
[ TS816 ] Animation
C1 ENERGY= 416.8 kJ/mol Energy+ZPE= 406.7 kJ/mol ZPE= 0.0940124 CONNECTIONS: o EQ92 o EQ104
[ TS817 ] Animation
C1 ENERGY= 437.7 kJ/mol Energy+ZPE= 426.9 kJ/mol ZPE= 0.0937534 CONNECTIONS: o EQ92 o EQ104
[ TS818 ] Animation
C1 ENERGY= 477.4 kJ/mol Energy+ZPE= 466.2 kJ/mol ZPE= 0.0935930 CONNECTIONS: o EQ92 o EQ104
[ TS819 ] Animation
C1 ENERGY= 420.5 kJ/mol Energy+ZPE= 410.8 kJ/mol ZPE= 0.0941495 CONNECTIONS: o EQ92 o DDC423
[ TS820 ] Animation
C1 ENERGY= 436.2 kJ/mol Energy+ZPE= 424.6 kJ/mol ZPE= 0.0934592 CONNECTIONS: o EQ92 o DDC424
[ TS821 ] Animation
C1 ENERGY= 472.9 kJ/mol Energy+ZPE= 452.6 kJ/mol ZPE= 0.0901114 CONNECTIONS: o EQ92 o DDC425
[ TS822 ] Animation
C1 ENERGY= 546.0 kJ/mol Energy+ZPE= 511.1 kJ/mol ZPE= 0.0845859 CONNECTIONS: o EQ92 o DDC426
[ TS823 ] Animation
C1 ENERGY= 406.6 kJ/mol Energy+ZPE= 384.6 kJ/mol ZPE= 0.0894702 CONNECTIONS: o EQ93 o DDC427
[ TS824 ] Animation
C1 ENERGY= 414.9 kJ/mol Energy+ZPE= 393.0 kJ/mol ZPE= 0.0895314 CONNECTIONS: o EQ93 o DDC428
[ TS825 ] Animation
C1 ENERGY= 483.4 kJ/mol Energy+ZPE= 463.2 kJ/mol ZPE= 0.0901566 CONNECTIONS: o EQ93 o DDC429
[ TS826 ] Animation
C1 ENERGY= 406.2 kJ/mol Energy+ZPE= 383.5 kJ/mol ZPE= 0.0892295 CONNECTIONS: o EQ94 o DDC430
[ TS827 ] Animation
C1 ENERGY= 412.9 kJ/mol Energy+ZPE= 390.8 kJ/mol ZPE= 0.0894401 CONNECTIONS: o EQ94 o DDC431
[ TS828 ] Animation
C1 ENERGY= 503.2 kJ/mol Energy+ZPE= 480.7 kJ/mol ZPE= 0.0892992 CONNECTIONS: o EQ94 o DDC432
[ TS829 ] Animation
C1 ENERGY= 440.0 kJ/mol Energy+ZPE= 429.8 kJ/mol ZPE= 0.0939696 CONNECTIONS: o EQ95 o EQ95
[ TS830 ] Animation
C1 ENERGY= 417.6 kJ/mol Energy+ZPE= 406.7 kJ/mol ZPE= 0.0937119 CONNECTIONS: o EQ95 o EQ97
[ TS831 ] Animation
C1 ENERGY= 415.2 kJ/mol Energy+ZPE= 405.5 kJ/mol ZPE= 0.0941565 CONNECTIONS: o EQ95 o EQ99
[ TS832 ] Animation
C1 ENERGY= 767.4 kJ/mol Energy+ZPE= 742.6 kJ/mol ZPE= 0.0884316 CONNECTIONS: o EQ95 o EQ123
[ TS833 ] Animation
C1 ENERGY= 774.0 kJ/mol Energy+ZPE= 748.0 kJ/mol ZPE= 0.0879596 CONNECTIONS: o EQ95 o EQ123
[ TS834 ] Animation
C1 ENERGY= 407.6 kJ/mol Energy+ZPE= 396.8 kJ/mol ZPE= 0.0937538 CONNECTIONS: o EQ95 o DDC433
[ TS835 ] Animation
C1 ENERGY= 404.7 kJ/mol Energy+ZPE= 381.9 kJ/mol ZPE= 0.0891612 CONNECTIONS: o EQ96 o DDC434
[ TS836 ] Animation
C1 ENERGY= 417.9 kJ/mol Energy+ZPE= 407.9 kJ/mol ZPE= 0.0940506 CONNECTIONS: o EQ97 o EQ99
[ TS837 ] Animation
C1 ENERGY= 419.1 kJ/mol Energy+ZPE= 407.0 kJ/mol ZPE= 0.0932642 CONNECTIONS: o EQ97 o EQ104
[ TS838 ] Animation
C1 ENERGY= 409.8 kJ/mol Energy+ZPE= 399.0 kJ/mol ZPE= 0.0937638 CONNECTIONS: o EQ97 o DDC435
[ TS839 ] Animation
C1 ENERGY= 409.9 kJ/mol Energy+ZPE= 399.9 kJ/mol ZPE= 0.0940509 CONNECTIONS: o EQ98 o EQ99
[ TS840 ] Animation
C1 ENERGY= 415.2 kJ/mol Energy+ZPE= 403.9 kJ/mol ZPE= 0.0935583 CONNECTIONS: o EQ98 o EQ100
[ TS841 ] Animation
C1 ENERGY= 446.3 kJ/mol Energy+ZPE= 434.5 kJ/mol ZPE= 0.0933479 CONNECTIONS: o EQ98 o EQ100
[ TS842 ] Animation
C1 ENERGY= 460.4 kJ/mol Energy+ZPE= 445.8 kJ/mol ZPE= 0.0923032 CONNECTIONS: o EQ98 o DDC436
[ TS843 ] Animation
C1 ENERGY= 509.9 kJ/mol Energy+ZPE= 480.8 kJ/mol ZPE= 0.0867620 CONNECTIONS: o EQ98 o DDC437
[ TS844 ] Animation
C1 ENERGY= 418.9 kJ/mol Energy+ZPE= 407.0 kJ/mol ZPE= 0.0933201 CONNECTIONS: o EQ99 o EQ103
[ TS845 ] Animation
C1 ENERGY= 443.2 kJ/mol Energy+ZPE= 431.8 kJ/mol ZPE= 0.0935264 CONNECTIONS: o EQ99 o EQ103
[ TS846 ] Animation
C1 ENERGY= 447.7 kJ/mol Energy+ZPE= 429.9 kJ/mol ZPE= 0.0910631 CONNECTIONS: o EQ99 o DDC438
[ TS847 ] Animation
C1 ENERGY= 427.2 kJ/mol Energy+ZPE= 415.0 kJ/mol ZPE= 0.0932036 CONNECTIONS: o EQ100 o EQ100
[ TS848 ] Animation
C1 ENERGY= 416.1 kJ/mol Energy+ZPE= 406.3 kJ/mol ZPE= 0.0941102 CONNECTIONS: o EQ100 o EQ103
[ TS849 ] Animation
C1 ENERGY= 439.5 kJ/mol Energy+ZPE= 428.0 kJ/mol ZPE= 0.0934930 CONNECTIONS: o EQ100 o EQ103
[ TS850 ] Animation
C1 ENERGY= 465.6 kJ/mol Energy+ZPE= 448.9 kJ/mol ZPE= 0.0915057 CONNECTIONS: o EQ100 o EQ103
[ TS851 ] Animation
C1 ENERGY= 415.7 kJ/mol Energy+ZPE= 394.6 kJ/mol ZPE= 0.0898082 CONNECTIONS: o EQ101 o DDC439
[ TS852 ] Animation
C1 ENERGY= 423.8 kJ/mol Energy+ZPE= 399.3 kJ/mol ZPE= 0.0885374 CONNECTIONS: o EQ101 o DDC440
[ TS853 ] Animation
C1 ENERGY= 429.7 kJ/mol Energy+ZPE= 421.2 kJ/mol ZPE= 0.0946409 CONNECTIONS: o EQ102 o EQ102
[ TS854 ] Animation
C1 ENERGY= 434.3 kJ/mol Energy+ZPE= 424.9 kJ/mol ZPE= 0.0942787 CONNECTIONS: o EQ102 o EQ105
[ TS855 ] Animation
C1 ENERGY= 435.9 kJ/mol Energy+ZPE= 425.6 kJ/mol ZPE= 0.0939283 CONNECTIONS: o EQ102 o EQ105
[ TS856 ] Animation
C1 ENERGY= 427.8 kJ/mol Energy+ZPE= 418.4 kJ/mol ZPE= 0.0942958 CONNECTIONS: o EQ102 o EQ107
[ TS857 ] Animation
C1 ENERGY= 445.1 kJ/mol Energy+ZPE= 435.0 kJ/mol ZPE= 0.0940188 CONNECTIONS: o EQ102 o EQ110
[ TS858 ] Animation
C1 ENERGY= 446.2 kJ/mol Energy+ZPE= 436.4 kJ/mol ZPE= 0.0941118 CONNECTIONS: o EQ102 o EQ110
[ TS859 ] Animation
C1 ENERGY= 449.3 kJ/mol Energy+ZPE= 437.7 kJ/mol ZPE= 0.0934610 CONNECTIONS: o EQ102 o EQ111
[ TS860 ] Animation
C1 ENERGY= 548.8 kJ/mol Energy+ZPE= 527.5 kJ/mol ZPE= 0.0897479 CONNECTIONS: o EQ102 o EQ115
[ TS861 ] Animation
C1 ENERGY= 544.7 kJ/mol Energy+ZPE= 523.3 kJ/mol ZPE= 0.0897124 CONNECTIONS: o EQ102 o DDC441
[ TS862 ] Animation
C1 ENERGY= 665.9 kJ/mol Energy+ZPE= 631.3 kJ/mol ZPE= 0.0846773 CONNECTIONS: o EQ102 o DDC442
[ TS863 ] Animation
C1 ENERGY= 428.2 kJ/mol Energy+ZPE= 415.9 kJ/mol ZPE= 0.0931857 CONNECTIONS: o EQ103 o EQ103
[ TS864 ] Animation
C1 ENERGY= 419.0 kJ/mol Energy+ZPE= 408.9 kJ/mol ZPE= 0.0940007 CONNECTIONS: o EQ103 o EQ104
[ TS865 ] Animation
C1 ENERGY= 445.0 kJ/mol Energy+ZPE= 427.4 kJ/mol ZPE= 0.0911673 CONNECTIONS: o EQ103 o DDC443
[ TS866 ] Animation
C1 ENERGY= 802.4 kJ/mol Energy+ZPE= 762.2 kJ/mol ZPE= 0.0825335 CONNECTIONS: o EQ103 o DDC444
[ TS867 ] Animation
C1 ENERGY= 803.3 kJ/mol Energy+ZPE= 763.0 kJ/mol ZPE= 0.0825247 CONNECTIONS: o EQ103 o DDC445
[ TS868 ] Animation
C1 ENERGY= 547.3 kJ/mol Energy+ZPE= 526.3 kJ/mol ZPE= 0.0898533 CONNECTIONS: o EQ104 o DDC446
[ TS869 ] Animation
C1 ENERGY= 797.4 kJ/mol Energy+ZPE= 757.4 kJ/mol ZPE= 0.0826235 CONNECTIONS: o EQ104 o DDC447
[ TS870 ] Animation
C1 ENERGY= 432.3 kJ/mol Energy+ZPE= 423.4 kJ/mol ZPE= 0.0944793 CONNECTIONS: o EQ105 o EQ105
[ TS871 ] Animation
C1 ENERGY= 426.9 kJ/mol Energy+ZPE= 417.9 kJ/mol ZPE= 0.0944199 CONNECTIONS: o EQ105 o EQ107
[ TS872 ] Animation
C1 ENERGY= 449.7 kJ/mol Energy+ZPE= 437.8 kJ/mol ZPE= 0.0933109 CONNECTIONS: o EQ105 o EQ110
[ TS873 ] Animation
C1 ENERGY= 442.6 kJ/mol Energy+ZPE= 432.6 kJ/mol ZPE= 0.0940505 CONNECTIONS: o EQ105 o EQ111
[ TS874 ] Animation
C1 ENERGY= 446.9 kJ/mol Energy+ZPE= 436.5 kJ/mol ZPE= 0.0938818 CONNECTIONS: o EQ105 o EQ111
[ TS875 ] Animation
C1 ENERGY= 437.0 kJ/mol Energy+ZPE= 424.9 kJ/mol ZPE= 0.0932612 CONNECTIONS: o EQ105 o DDC448
[ TS876 ] Animation
C1 ENERGY= 550.7 kJ/mol Energy+ZPE= 527.5 kJ/mol ZPE= 0.0890404 CONNECTIONS: o EQ105 o DDC449
[ TS877 ] Animation
C1 ENERGY= 791.3 kJ/mol Energy+ZPE= 764.1 kJ/mol ZPE= 0.0874851 CONNECTIONS: o EQ105 o DDC450
[ TS878 ] Animation
Cs ENERGY= 426.4 kJ/mol Energy+ZPE= 410.3 kJ/mol ZPE= 0.0917266 CONNECTIONS: o EQ106 o EQ106
[ TS879 ] Animation
C1 ENERGY= 507.1 kJ/mol Energy+ZPE= 478.6 kJ/mol ZPE= 0.0870210 CONNECTIONS: o EQ106 o DDC451
[ TS880 ] Animation
C1 ENERGY= 432.4 kJ/mol Energy+ZPE= 423.3 kJ/mol ZPE= 0.0943880 CONNECTIONS: o EQ107 o EQ107
[ TS881 ] Animation
C1 ENERGY= 445.1 kJ/mol Energy+ZPE= 434.6 kJ/mol ZPE= 0.0938685 CONNECTIONS: o EQ107 o EQ112
[ TS882 ] Animation
C1 ENERGY= 447.4 kJ/mol Energy+ZPE= 437.0 kJ/mol ZPE= 0.0938846 CONNECTIONS: o EQ107 o EQ112
[ TS883 ] Animation
C1 ENERGY= 451.7 kJ/mol Energy+ZPE= 439.3 kJ/mol ZPE= 0.0931505 CONNECTIONS: o EQ107 o EQ112
[ TS884 ] Animation
C1 ENERGY= 528.3 kJ/mol Energy+ZPE= 511.1 kJ/mol ZPE= 0.0913141 CONNECTIONS: o EQ107 o DDC452
[ TS885 ] Animation
C1 ENERGY= 607.9 kJ/mol Energy+ZPE= 570.8 kJ/mol ZPE= 0.0837412 CONNECTIONS: o EQ107 o DDC453
[ TS886 ] Animation
Cs ENERGY= 446.4 kJ/mol Energy+ZPE= 427.4 kJ/mol ZPE= 0.0906389 CONNECTIONS: o EQ108 o EQ108
[ TS887 ] Animation
C1 ENERGY= 449.1 kJ/mol Energy+ZPE= 428.9 kJ/mol ZPE= 0.0901671 CONNECTIONS: o EQ108 o EQ109
[ TS888 ] Animation
C1 ENERGY= 450.0 kJ/mol Energy+ZPE= 429.7 kJ/mol ZPE= 0.0901149 CONNECTIONS: o EQ108 o EQ109
[ TS889 ] Animation
C1 ENERGY= 449.4 kJ/mol Energy+ZPE= 428.8 kJ/mol ZPE= 0.0900182 CONNECTIONS: o EQ108 o EQ113
[ TS890 ] Animation
C1 ENERGY= 473.4 kJ/mol Energy+ZPE= 451.4 kJ/mol ZPE= 0.0894696 CONNECTIONS: o EQ108 o EQ113
[ TS891 ] Animation
C1 ENERGY= 432.6 kJ/mol Energy+ZPE= 402.1 kJ/mol ZPE= 0.0862559 CONNECTIONS: o EQ109 o DDC454
[ TS892 ] Animation
C1 ENERGY= 461.1 kJ/mol Energy+ZPE= 432.4 kJ/mol ZPE= 0.0869298 CONNECTIONS: o EQ109 o DDC455
[ TS893 ] Animation
C1 ENERGY= 447.6 kJ/mol Energy+ZPE= 437.7 kJ/mol ZPE= 0.0940834 CONNECTIONS: o EQ110 o EQ110
[ TS894 ] Animation
C1 ENERGY= 451.2 kJ/mol Energy+ZPE= 440.7 kJ/mol ZPE= 0.0938601 CONNECTIONS: o EQ110 o EQ111
[ TS895 ] Animation
C1 ENERGY= 445.2 kJ/mol Energy+ZPE= 435.2 kJ/mol ZPE= 0.0940580 CONNECTIONS: o EQ110 o EQ112
[ TS896 ] Animation
C1 ENERGY= 459.4 kJ/mol Energy+ZPE= 445.3 kJ/mol ZPE= 0.0925090 CONNECTIONS: o EQ110 o DDC456
[ TS897 ] Animation
C1 ENERGY= 684.8 kJ/mol Energy+ZPE= 647.6 kJ/mol ZPE= 0.0837004 CONNECTIONS: o EQ110 o DDC457
[ TS898 ] Animation
C1 ENERGY= 767.0 kJ/mol Energy+ZPE= 749.3 kJ/mol ZPE= 0.0911374 CONNECTIONS: o EQ110 o DDC458
[ TS899 ] Animation
C1 ENERGY= 828.2 kJ/mol Energy+ZPE= 794.1 kJ/mol ZPE= 0.0848638 CONNECTIONS: o EQ110 o DDC459
[ TS900 ] Animation
C1 ENERGY= 451.6 kJ/mol Energy+ZPE= 441.6 kJ/mol ZPE= 0.0940338 CONNECTIONS: o EQ111 o EQ111
[ TS901 ] Animation
C1 ENERGY= 447.5 kJ/mol Energy+ZPE= 437.2 kJ/mol ZPE= 0.0939447 CONNECTIONS: o EQ111 o EQ112
[ TS902 ] Animation
C1 ENERGY= 574.8 kJ/mol Energy+ZPE= 551.9 kJ/mol ZPE= 0.0891456 CONNECTIONS: o EQ111 o EQ114
[ TS903 ] Animation
C1 ENERGY= 671.8 kJ/mol Energy+ZPE= 636.1 kJ/mol ZPE= 0.0842512 CONNECTIONS: o EQ111 o DDC460
[ TS904 ] Animation
C1 ENERGY= 450.1 kJ/mol Energy+ZPE= 440.1 kJ/mol ZPE= 0.0940635 CONNECTIONS: o EQ112 o EQ112
[ TS905 ] Animation
C1 ENERGY= 575.7 kJ/mol Energy+ZPE= 552.4 kJ/mol ZPE= 0.0889870 CONNECTIONS: o EQ112 o EQ115
[ TS906 ] Animation
C1 ENERGY= 910.9 kJ/mol Energy+ZPE= 863.6 kJ/mol ZPE= 0.0798562 CONNECTIONS: o EQ112 o DDC461
[ TS907 ] Animation
Cs ENERGY= 465.4 kJ/mol Energy+ZPE= 443.4 kJ/mol ZPE= 0.0894699 CONNECTIONS: o EQ113 o EQ113
[ TS908 ] Animation
C1 ENERGY= 454.7 kJ/mol Energy+ZPE= 434.2 kJ/mol ZPE= 0.0900342 CONNECTIONS: o EQ113 o DDC462
[ TS909 ] Animation
C1 ENERGY= 528.7 kJ/mol Energy+ZPE= 517.1 kJ/mol ZPE= 0.0934377 CONNECTIONS: o EQ114 o EQ114
[ TS910 ] Animation
C1 ENERGY= 539.6 kJ/mol Energy+ZPE= 524.2 kJ/mol ZPE= 0.0919900 CONNECTIONS: o EQ114 o EQ115
[ TS911 ] Animation
C1 ENERGY= 544.3 kJ/mol Energy+ZPE= 530.5 kJ/mol ZPE= 0.0925909 CONNECTIONS: o EQ114 o EQ117
[ TS912 ] Animation
C1 ENERGY= 578.7 kJ/mol Energy+ZPE= 563.1 kJ/mol ZPE= 0.0919180 CONNECTIONS: o EQ114 o EQ117
[ TS913 ] Animation
C1 ENERGY= 521.3 kJ/mol Energy+ZPE= 508.2 kJ/mol ZPE= 0.0928560 CONNECTIONS: o EQ114 o DDC463
[ TS914 ] Animation
C1 ENERGY= 530.4 kJ/mol Energy+ZPE= 516.3 kJ/mol ZPE= 0.0924927 CONNECTIONS: o EQ114 o DDC464
[ TS915 ] Animation
C1 ENERGY= 551.1 kJ/mol Energy+ZPE= 535.6 kJ/mol ZPE= 0.0919759 CONNECTIONS: o EQ114 o DDC465
[ TS916 ] Animation
C1 ENERGY= 605.9 kJ/mol Energy+ZPE= 579.4 kJ/mol ZPE= 0.0877546 CONNECTIONS: o EQ114 o DDC466
[ TS917 ] Animation
C1 ENERGY= 529.0 kJ/mol Energy+ZPE= 517.0 kJ/mol ZPE= 0.0932719 CONNECTIONS: o EQ115 o EQ115
[ TS918 ] Animation
C1 ENERGY= 581.3 kJ/mol Energy+ZPE= 564.8 kJ/mol ZPE= 0.0915870 CONNECTIONS: o EQ115 o EQ115
[ TS919 ] Animation
C1 ENERGY= 546.3 kJ/mol Energy+ZPE= 532.1 kJ/mol ZPE= 0.0924595 CONNECTIONS: o EQ115 o EQ118
[ TS920 ] Animation
C1 ENERGY= 579.0 kJ/mol Energy+ZPE= 563.3 kJ/mol ZPE= 0.0918973 CONNECTIONS: o EQ115 o EQ118
[ TS921 ] Animation
C1 ENERGY= 605.1 kJ/mol Energy+ZPE= 579.2 kJ/mol ZPE= 0.0879823 CONNECTIONS: o EQ115 o EQ120
[ TS922 ] Animation
C1 ENERGY= 527.9 kJ/mol Energy+ZPE= 514.8 kJ/mol ZPE= 0.0928838 CONNECTIONS: o EQ115 o DDC467
[ TS923 ] Animation
C1 ENERGY= 531.8 kJ/mol Energy+ZPE= 517.4 kJ/mol ZPE= 0.0923739 CONNECTIONS: o EQ115 o DDC468
[ TS924 ] Animation
C1 ENERGY= 546.7 kJ/mol Energy+ZPE= 532.3 kJ/mol ZPE= 0.0923673 CONNECTIONS: o EQ115 o DDC469
[ TS925 ] Animation
C1 ENERGY= 612.4 kJ/mol Energy+ZPE= 583.5 kJ/mol ZPE= 0.0868717 CONNECTIONS: o EQ115 o DDC470
[ TS926 ] Animation
C1 ENERGY= 616.1 kJ/mol Energy+ZPE= 588.2 kJ/mol ZPE= 0.0872437 CONNECTIONS: o EQ115 o DDC471
[ TS927 ] Animation
C1 ENERGY= 802.9 kJ/mol Energy+ZPE= 768.2 kJ/mol ZPE= 0.0846396 CONNECTIONS: o EQ115 o DDC472
[ TS928 ] Animation
C1 ENERGY= 548.4 kJ/mol Energy+ZPE= 525.5 kJ/mol ZPE= 0.0891498 CONNECTIONS: o EQ116 o DDC473
[ TS929 ] Animation
C1 ENERGY= 552.6 kJ/mol Energy+ZPE= 528.5 kJ/mol ZPE= 0.0886768 CONNECTIONS: o EQ116 o DDC474
[ TS930 ] Animation
C1 ENERGY= 552.9 kJ/mol Energy+ZPE= 538.0 kJ/mol ZPE= 0.0921868 CONNECTIONS: o EQ118 o EQ118
[ TS931 ] Animation
C1 ENERGY= 551.2 kJ/mol Energy+ZPE= 525.5 kJ/mol ZPE= 0.0880622 CONNECTIONS: o EQ119 o DDC475
[ TS932 ] Animation
C1 ENERGY= 555.8 kJ/mol Energy+ZPE= 535.3 kJ/mol ZPE= 0.0900424 CONNECTIONS: o EQ119 o DDC476
[ TS933 ] Animation
C1 ENERGY= 556.3 kJ/mol Energy+ZPE= 532.7 kJ/mol ZPE= 0.0888898 CONNECTIONS: o EQ119 o DDC477
[ TS934 ] Animation
C1 ENERGY= 558.7 kJ/mol Energy+ZPE= 535.2 kJ/mol ZPE= 0.0889119 CONNECTIONS: o EQ119 o DDC478
[ TS935 ] Animation
C1 ENERGY= 564.2 kJ/mol Energy+ZPE= 540.3 kJ/mol ZPE= 0.0887450 CONNECTIONS: o EQ119 o DDC479
[ TS936 ] Animation
C1 ENERGY= 612.2 kJ/mol Energy+ZPE= 585.9 kJ/mol ZPE= 0.0878515 CONNECTIONS: o EQ120 o EQ120
[ TS937 ] Animation
C1 ENERGY= 605.1 kJ/mol Energy+ZPE= 579.0 kJ/mol ZPE= 0.0879250 CONNECTIONS: o EQ120 o DDC480
[ TS938 ] Animation
C1 ENERGY= 615.6 kJ/mol Energy+ZPE= 580.8 kJ/mol ZPE= 0.0845888 CONNECTIONS: o EQ120 o DDC481
[ TS939 ] Animation
C1 ENERGY= 659.1 kJ/mol Energy+ZPE= 639.2 kJ/mol ZPE= 0.0902686 CONNECTIONS: o EQ121 o EQ121
[ TS940 ] Animation
C1 ENERGY= 659.2 kJ/mol Energy+ZPE= 641.2 kJ/mol ZPE= 0.0910062 CONNECTIONS: o EQ121 o EQ121
[ TS941 ] Animation
C1 ENERGY= 658.0 kJ/mol Energy+ZPE= 639.9 kJ/mol ZPE= 0.0909757 CONNECTIONS: o EQ121 o EQ124
[ TS942 ] Animation
C1 ENERGY= 691.1 kJ/mol Energy+ZPE= 669.7 kJ/mol ZPE= 0.0897184 CONNECTIONS: o EQ121 o EQ124
[ TS943 ] Animation
C1 ENERGY= 661.7 kJ/mol Energy+ZPE= 645.4 kJ/mol ZPE= 0.0916344 CONNECTIONS: o EQ121 o EQ125
[ TS944 ] Animation
C1 ENERGY= 690.6 kJ/mol Energy+ZPE= 663.9 kJ/mol ZPE= 0.0876858 CONNECTIONS: o EQ121 o DDC482
[ TS945 ] Animation
C1 ENERGY= 697.3 kJ/mol Energy+ZPE= 667.1 kJ/mol ZPE= 0.0863598 CONNECTIONS: o EQ121 o DDC483
[ TS946 ] Animation
C1 ENERGY= 712.4 kJ/mol Energy+ZPE= 675.0 kJ/mol ZPE= 0.0836041 CONNECTIONS: o EQ121 o DDC484
[ TS947 ] Animation
C1 ENERGY= 657.6 kJ/mol Energy+ZPE= 641.9 kJ/mol ZPE= 0.0918643 CONNECTIONS: o EQ122 o EQ122
[ TS948 ] Animation
C1 ENERGY= 661.0 kJ/mol Energy+ZPE= 644.7 kJ/mol ZPE= 0.0916540 CONNECTIONS: o EQ122 o EQ124
[ TS949 ] Animation
C1 ENERGY= 656.9 kJ/mol Energy+ZPE= 639.9 kJ/mol ZPE= 0.0914006 CONNECTIONS: o EQ122 o EQ125
[ TS950 ] Animation
C1 ENERGY= 691.2 kJ/mol Energy+ZPE= 670.5 kJ/mol ZPE= 0.0899818 CONNECTIONS: o EQ122 o EQ125
[ TS951 ] Animation
C1 ENERGY= 660.6 kJ/mol Energy+ZPE= 634.5 kJ/mol ZPE= 0.0879268 CONNECTIONS: o EQ122 o DDC485
[ TS952 ] Animation
C1 ENERGY= 667.5 kJ/mol Energy+ZPE= 646.1 kJ/mol ZPE= 0.0896914 CONNECTIONS: o EQ122 o DDC486
[ TS953 ] Animation
C1 ENERGY= 701.3 kJ/mol Energy+ZPE= 678.8 kJ/mol ZPE= 0.0892851 CONNECTIONS: o EQ122 o DDC487
[ TS954 ] Animation
C1 ENERGY= 706.6 kJ/mol Energy+ZPE= 683.4 kJ/mol ZPE= 0.0890410 CONNECTIONS: o EQ122 o DDC488
[ TS955 ] Animation
C1 ENERGY= 678.9 kJ/mol Energy+ZPE= 666.9 kJ/mol ZPE= 0.0932771 CONNECTIONS: o EQ123 o EQ123
[ TS956 ] Animation
C1 ENERGY= 654.8 kJ/mol Energy+ZPE= 640.3 kJ/mol ZPE= 0.0923240 CONNECTIONS: o EQ123 o DDC489
[ TS957 ] Animation
C1 ENERGY= 676.5 kJ/mol Energy+ZPE= 664.8 kJ/mol ZPE= 0.0934027 CONNECTIONS: o EQ123 o DDC490
[ TS958 ] Animation
C1 ENERGY= 690.9 kJ/mol Energy+ZPE= 669.9 kJ/mol ZPE= 0.0898797 CONNECTIONS: o EQ123 o DDC491
[ TS959 ] Animation
C1 ENERGY= 704.9 kJ/mol Energy+ZPE= 682.6 kJ/mol ZPE= 0.0893570 CONNECTIONS: o EQ123 o DDC492
[ TS960 ] Animation
C1 ENERGY= 662.8 kJ/mol Energy+ZPE= 645.1 kJ/mol ZPE= 0.0911299 CONNECTIONS: o EQ124 o EQ124
[ TS961 ] Animation
C1 ENERGY= 661.8 kJ/mol Energy+ZPE= 633.8 kJ/mol ZPE= 0.0872022 CONNECTIONS: o EQ124 o DDC493
[ TS962 ] Animation
C1 ENERGY= 681.2 kJ/mol Energy+ZPE= 660.2 kJ/mol ZPE= 0.0898777 CONNECTIONS: o EQ124 o DDC494
[ TS963 ] Animation
C1 ENERGY= 693.1 kJ/mol Energy+ZPE= 666.1 kJ/mol ZPE= 0.0875912 CONNECTIONS: o EQ124 o DDC495
[ TS964 ] Animation
C1 ENERGY= 699.9 kJ/mol Energy+ZPE= 669.6 kJ/mol ZPE= 0.0863342 CONNECTIONS: o EQ124 o DDC496
[ TS965 ] Animation
C1 ENERGY= 660.3 kJ/mol Energy+ZPE= 644.3 kJ/mol ZPE= 0.0917834 CONNECTIONS: o EQ125 o EQ125
[ TS966 ] Animation
C1 ENERGY= 664.7 kJ/mol Energy+ZPE= 638.7 kJ/mol ZPE= 0.0879708 CONNECTIONS: o EQ125 o DDC497
[ TS967 ] Animation
C1 ENERGY= 671.0 kJ/mol Energy+ZPE= 649.3 kJ/mol ZPE= 0.0895794 CONNECTIONS: o EQ125 o DDC498
[ TS968 ] Animation
C1 ENERGY= 695.3 kJ/mol Energy+ZPE= 665.8 kJ/mol ZPE= 0.0866149 CONNECTIONS: o EQ125 o DDC499
[ TS969 ] Animation
C1 ENERGY= 705.4 kJ/mol Energy+ZPE= 682.5 kJ/mol ZPE= 0.0891367 CONNECTIONS: o EQ125 o DDC500
[ TS970 ] Animation
C1 ENERGY= 709.5 kJ/mol Energy+ZPE= 685.3 kJ/mol ZPE= 0.0886545 CONNECTIONS: o EQ125 o DDC501
[ TS971 ] Animation
C1 ENERGY= 681.7 kJ/mol Energy+ZPE= 667.5 kJ/mol ZPE= 0.0924386 CONNECTIONS: o EQ126 o DDC502
[ TS972 ] Animation
C1 ENERGY= 690.2 kJ/mol Energy+ZPE= 675.7 kJ/mol ZPE= 0.0923304 CONNECTIONS: o EQ126 o DDC503
[ TS973 ] Animation
C1 ENERGY= 724.6 kJ/mol Energy+ZPE= 706.8 kJ/mol ZPE= 0.0910650 CONNECTIONS: o EQ126 o DDC504
[ TS974 ] Animation
C1 ENERGY= 840.5 kJ/mol Energy+ZPE= 803.5 kJ/mol ZPE= 0.0837692 CONNECTIONS: o EQ126 o DDC505
[ TS975 ] Animation
C1 ENERGY= 84.8 kJ/mol Energy+ZPE= 67.7 kJ/mol ZPE= 0.0913637 CONNECTIONS: o DDC507 o DDC506
[ TS976 ] Animation
C1 ENERGY= 199.2 kJ/mol Energy+ZPE= 174.8 kJ/mol ZPE= 0.0885711 CONNECTIONS: o DDC509 o DDC508
[ TS977 ] Animation
C1 ENERGY= 220.5 kJ/mol Energy+ZPE= 199.4 kJ/mol ZPE= 0.0898086 CONNECTIONS: o DDC511 o DDC510
[ TS978 ] Animation
C1 ENERGY= 284.3 kJ/mol Energy+ZPE= 258.9 kJ/mol ZPE= 0.0882005 CONNECTIONS: o DDC513 o DDC512
[ TS979 ] Animation
C1 ENERGY= 285.0 kJ/mol Energy+ZPE= 250.6 kJ/mol ZPE= 0.0847472 CONNECTIONS: o DDC515 o DDC514
[ TS980 ] Animation
C1 ENERGY= 315.1 kJ/mol Energy+ZPE= 301.6 kJ/mol ZPE= 0.0927168 CONNECTIONS: o DDC517 o DDC516
[ TS981 ] Animation
C1 ENERGY= 317.2 kJ/mol Energy+ZPE= 303.5 kJ/mol ZPE= 0.0926517 CONNECTIONS: o DDC519 o DDC518
[ TS982 ] Animation
C1 ENERGY= 317.4 kJ/mol Energy+ZPE= 303.7 kJ/mol ZPE= 0.0926267 CONNECTIONS: o DDC521 o DDC520
[ TS983 ] Animation
Cs ENERGY= 327.7 kJ/mol Energy+ZPE= 317.5 kJ/mol ZPE= 0.0939619 CONNECTIONS: o DDC523 o DDC522
[ TS984 ] Animation
C1 ENERGY= 329.5 kJ/mol Energy+ZPE= 303.1 kJ/mol ZPE= 0.0878044 CONNECTIONS: o DDC525 o DDC524
[ TS985 ] Animation
C1 ENERGY= 331.9 kJ/mol Energy+ZPE= 311.8 kJ/mol ZPE= 0.0901969 CONNECTIONS: o DDC527 o DDC526
[ TS986 ] Animation
C1 ENERGY= 332.3 kJ/mol Energy+ZPE= 317.7 kJ/mol ZPE= 0.0923049 CONNECTIONS: o DDC529 o DDC528
[ TS987 ] Animation
C1 ENERGY= 335.8 kJ/mol Energy+ZPE= 319.5 kJ/mol ZPE= 0.0916643 CONNECTIONS: o DDC531 o DDC530
[ TS988 ] Animation
C1 ENERGY= 336.7 kJ/mol Energy+ZPE= 320.2 kJ/mol ZPE= 0.0915748 CONNECTIONS: o DDC533 o DDC532
[ TS989 ] Animation
C1 ENERGY= 338.1 kJ/mol Energy+ZPE= 321.5 kJ/mol ZPE= 0.0915516 CONNECTIONS: o DDC535 o DDC534
[ TS990 ] Animation
C1 ENERGY= 343.1 kJ/mol Energy+ZPE= 326.9 kJ/mol ZPE= 0.0916967 CONNECTIONS: o DDC537 o DDC536
[ TS991 ] Animation
C1 ENERGY= 344.4 kJ/mol Energy+ZPE= 328.2 kJ/mol ZPE= 0.0917034 CONNECTIONS: o DDC539 o DDC538
[ TS992 ] Animation
C1 ENERGY= 344.8 kJ/mol Energy+ZPE= 313.7 kJ/mol ZPE= 0.0860137 CONNECTIONS: o DDC541 o DDC540
[ TS993 ] Animation
C1 ENERGY= 349.0 kJ/mol Energy+ZPE= 331.7 kJ/mol ZPE= 0.0912729 CONNECTIONS: o DDC543 o DDC542
[ TS994 ] Animation
C1 ENERGY= 349.3 kJ/mol Energy+ZPE= 332.2 kJ/mol ZPE= 0.0913452 CONNECTIONS: o DDC545 o DDC544
[ TS995 ] Animation
C1 ENERGY= 349.7 kJ/mol Energy+ZPE= 331.5 kJ/mol ZPE= 0.0909426 CONNECTIONS: o DDC547 o DDC546
[ TS996 ] Animation
C1 ENERGY= 352.5 kJ/mol Energy+ZPE= 334.3 kJ/mol ZPE= 0.0909105 CONNECTIONS: o DDC549 o DDC548
[ TS997 ] Animation
C1 ENERGY= 354.4 kJ/mol Energy+ZPE= 331.8 kJ/mol ZPE= 0.0892692 CONNECTIONS: o DDC551 o DDC550
[ TS998 ] Animation
C1 ENERGY= 354.7 kJ/mol Energy+ZPE= 336.6 kJ/mol ZPE= 0.0909725 CONNECTIONS: o DDC553 o DDC552
[ TS999 ] Animation
C1 ENERGY= 368.0 kJ/mol Energy+ZPE= 351.6 kJ/mol ZPE= 0.0915991 CONNECTIONS: o DDC555 o DDC554
[ TS1000 ] Animation
C1 ENERGY= 372.7 kJ/mol Energy+ZPE= 340.1 kJ/mol ZPE= 0.0854351 CONNECTIONS: o DDC557 o DDC556
[ TS1001 ] Animation
C1 ENERGY= 377.9 kJ/mol Energy+ZPE= 344.2 kJ/mol ZPE= 0.0850367 CONNECTIONS: o DDC559 o DDC558
[ TS1002 ] Animation
C1 ENERGY= 381.1 kJ/mol Energy+ZPE= 355.3 kJ/mol ZPE= 0.0880272 CONNECTIONS: o DDC561 o DDC560
[ TS1003 ] Animation
C1 ENERGY= 392.3 kJ/mol Energy+ZPE= 370.1 kJ/mol ZPE= 0.0894180 CONNECTIONS: o DDC563 o DDC562
[ TS1004 ] Animation
C1 ENERGY= 393.7 kJ/mol Energy+ZPE= 368.7 kJ/mol ZPE= 0.0883279 CONNECTIONS: o DDC565 o DDC564
[ TS1005 ] Animation
C1 ENERGY= 395.0 kJ/mol Energy+ZPE= 360.8 kJ/mol ZPE= 0.0848390 CONNECTIONS: o DDC567 o DDC566
[ TS1006 ] Animation
C1 ENERGY= 399.8 kJ/mol Energy+ZPE= 377.8 kJ/mol ZPE= 0.0894727 CONNECTIONS: o DDC569 o DDC568
[ TS1007 ] Animation
C1 ENERGY= 400.2 kJ/mol Energy+ZPE= 377.2 kJ/mol ZPE= 0.0890870 CONNECTIONS: o DDC571 o DDC570
[ TS1008 ] Animation
C1 ENERGY= 403.2 kJ/mol Energy+ZPE= 380.6 kJ/mol ZPE= 0.0892586 CONNECTIONS: o DDC573 o DDC572
[ TS1009 ] Animation
C1 ENERGY= 404.9 kJ/mol Energy+ZPE= 381.5 kJ/mol ZPE= 0.0889408 CONNECTIONS: o DDC575 o DDC574
[ TS1010 ] Animation
C1 ENERGY= 405.9 kJ/mol Energy+ZPE= 391.4 kJ/mol ZPE= 0.0923490 CONNECTIONS: o DDC577 o DDC576
[ TS1011 ] Animation
C1 ENERGY= 407.7 kJ/mol Energy+ZPE= 384.7 kJ/mol ZPE= 0.0890914 CONNECTIONS: o DDC579 o DDC578
[ TS1012 ] Animation
C1 ENERGY= 408.3 kJ/mol Energy+ZPE= 387.0 kJ/mol ZPE= 0.0897376 CONNECTIONS: o DDC581 o DDC580
[ TS1013 ] Animation
C1 ENERGY= 409.3 kJ/mol Energy+ZPE= 387.0 kJ/mol ZPE= 0.0893787 CONNECTIONS: o DDC583 o DDC582
[ TS1014 ] Animation
C1 ENERGY= 409.6 kJ/mol Energy+ZPE= 386.1 kJ/mol ZPE= 0.0888923 CONNECTIONS: o DDC585 o DDC584
[ TS1015 ] Animation
C1 ENERGY= 411.5 kJ/mol Energy+ZPE= 387.0 kJ/mol ZPE= 0.0885283 CONNECTIONS: o DDC587 o DDC586
[ TS1016 ] Animation
C1 ENERGY= 413.5 kJ/mol Energy+ZPE= 390.9 kJ/mol ZPE= 0.0892469 CONNECTIONS: o DDC589 o DDC588
[ TS1017 ] Animation
C1 ENERGY= 414.0 kJ/mol Energy+ZPE= 389.9 kJ/mol ZPE= 0.0886713 CONNECTIONS: o DDC591 o DDC590
[ TS1018 ] Animation
C1 ENERGY= 421.2 kJ/mol Energy+ZPE= 396.4 kJ/mol ZPE= 0.0884010 CONNECTIONS: o DDC593 o DDC592
[ TS1019 ] Animation
C1 ENERGY= 421.4 kJ/mol Energy+ZPE= 396.7 kJ/mol ZPE= 0.0884633 CONNECTIONS: o DDC595 o DDC594
[ TS1020 ] Animation
C1 ENERGY= 423.2 kJ/mol Energy+ZPE= 397.0 kJ/mol ZPE= 0.0878672 CONNECTIONS: o DDC597 o DDC596
[ TS1021 ] Animation
C1 ENERGY= 425.1 kJ/mol Energy+ZPE= 398.0 kJ/mol ZPE= 0.0875368 CONNECTIONS: o DDC599 o DDC598
[ TS1022 ] Animation
C1 ENERGY= 426.0 kJ/mol Energy+ZPE= 406.7 kJ/mol ZPE= 0.0905201 CONNECTIONS: o DDC601 o DDC600
[ TS1023 ] Animation
C1 ENERGY= 429.8 kJ/mol Energy+ZPE= 411.9 kJ/mol ZPE= 0.0910434 CONNECTIONS: o DDC603 o DDC602
[ TS1024 ] Animation
C1 ENERGY= 432.0 kJ/mol Energy+ZPE= 409.5 kJ/mol ZPE= 0.0892762 CONNECTIONS: o DDC605 o DDC604
[ TS1025 ] Animation
C1 ENERGY= 432.1 kJ/mol Energy+ZPE= 412.8 kJ/mol ZPE= 0.0905191 CONNECTIONS: o DDC607 o DDC606
[ TS1026 ] Animation
C1 ENERGY= 432.8 kJ/mol Energy+ZPE= 410.8 kJ/mol ZPE= 0.0894700 CONNECTIONS: o DDC609 o DDC608
[ TS1027 ] Animation
C1 ENERGY= 435.3 kJ/mol Energy+ZPE= 396.0 kJ/mol ZPE= 0.0829011 CONNECTIONS: o DDC611 o DDC610
[ TS1028 ] Animation
C1 ENERGY= 441.3 kJ/mol Energy+ZPE= 420.0 kJ/mol ZPE= 0.0897411 CONNECTIONS: o DDC613 o DDC612
[ TS1029 ] Animation
C1 ENERGY= 442.4 kJ/mol Energy+ZPE= 410.0 kJ/mol ZPE= 0.0855084 CONNECTIONS: o DDC615 o DDC614
[ TS1030 ] Animation
C1 ENERGY= 443.4 kJ/mol Energy+ZPE= 408.6 kJ/mol ZPE= 0.0846025 CONNECTIONS: o DDC617 o DDC616
[ TS1031 ] Animation
C1 ENERGY= 447.5 kJ/mol Energy+ZPE= 434.1 kJ/mol ZPE= 0.0927537 CONNECTIONS: o DDC619 o DDC618
[ TS1032 ] Animation
C1 ENERGY= 450.8 kJ/mol Energy+ZPE= 423.7 kJ/mol ZPE= 0.0875268 CONNECTIONS: o DDC621 o DDC620
[ TS1033 ] Animation
C1 ENERGY= 452.9 kJ/mol Energy+ZPE= 440.0 kJ/mol ZPE= 0.0929452 CONNECTIONS: o DDC623 o DDC622
[ TS1034 ] Animation
C1 ENERGY= 457.8 kJ/mol Energy+ZPE= 429.9 kJ/mol ZPE= 0.0872233 CONNECTIONS: o DDC625 o DDC624
[ TS1035 ] Animation
C1 ENERGY= 459.1 kJ/mol Energy+ZPE= 422.9 kJ/mol ZPE= 0.0840681 CONNECTIONS: o DDC627 o DDC626
[ TS1036 ] Animation
C1 ENERGY= 461.1 kJ/mol Energy+ZPE= 432.7 kJ/mol ZPE= 0.0870277 CONNECTIONS: o DDC629 o DDC628
[ TS1037 ] Animation
C1 ENERGY= 462.6 kJ/mol Energy+ZPE= 443.0 kJ/mol ZPE= 0.0904036 CONNECTIONS: o DDC631 o DDC630
[ TS1038 ] Animation
C1 ENERGY= 464.6 kJ/mol Energy+ZPE= 435.3 kJ/mol ZPE= 0.0866831 CONNECTIONS: o DDC633 o DDC632
[ TS1039 ] Animation
C1 ENERGY= 466.6 kJ/mol Energy+ZPE= 445.0 kJ/mol ZPE= 0.0896286 CONNECTIONS: o DDC635 o DDC634
[ TS1040 ] Animation
C1 ENERGY= 469.4 kJ/mol Energy+ZPE= 444.0 kJ/mol ZPE= 0.0881880 CONNECTIONS: o DDC637 o DDC636
[ TS1041 ] Animation
C1 ENERGY= 470.6 kJ/mol Energy+ZPE= 451.5 kJ/mol ZPE= 0.0905702 CONNECTIONS: o DDC639 o DDC638
[ TS1042 ] Animation
C1 ENERGY= 471.4 kJ/mol Energy+ZPE= 453.3 kJ/mol ZPE= 0.0909678 CONNECTIONS: o DDC641 o DDC640
[ TS1043 ] Animation
C1 ENERGY= 472.7 kJ/mol Energy+ZPE= 449.7 kJ/mol ZPE= 0.0890974 CONNECTIONS: o DDC643 o DDC642
[ TS1044 ] Animation
Cs ENERGY= 472.9 kJ/mol Energy+ZPE= 443.6 kJ/mol ZPE= 0.0867052 CONNECTIONS: o DDC645 o DDC644
[ TS1045 ] Animation
C1 ENERGY= 473.4 kJ/mol Energy+ZPE= 450.2 kJ/mol ZPE= 0.0890197 CONNECTIONS: o DDC647 o DDC646
[ TS1046 ] Animation
C1 ENERGY= 476.1 kJ/mol Energy+ZPE= 435.3 kJ/mol ZPE= 0.0823167 CONNECTIONS: o DDC649 o DDC648
[ TS1047 ] Animation
C1 ENERGY= 477.5 kJ/mol Energy+ZPE= 452.5 kJ/mol ZPE= 0.0883252 CONNECTIONS: o DDC651 o DDC650
[ TS1048 ] Animation
C1 ENERGY= 477.6 kJ/mol Energy+ZPE= 462.0 kJ/mol ZPE= 0.0919075 CONNECTIONS: o DDC653 o DDC652
[ TS1049 ] Animation
C1 ENERGY= 479.6 kJ/mol Energy+ZPE= 449.6 kJ/mol ZPE= 0.0864343 CONNECTIONS: o DDC655 o DDC654
[ TS1050 ] Animation
C1 ENERGY= 479.7 kJ/mol Energy+ZPE= 449.8 kJ/mol ZPE= 0.0864836 CONNECTIONS: o DDC657 o DDC656
[ TS1051 ] Animation
Cs ENERGY= 482.6 kJ/mol Energy+ZPE= 452.6 kJ/mol ZPE= 0.0864348 CONNECTIONS: o DDC659 o DDC658
[ TS1052 ] Animation
C1 ENERGY= 483.3 kJ/mol Energy+ZPE= 458.8 kJ/mol ZPE= 0.0885232 CONNECTIONS: o DDC661 o DDC660
[ TS1053 ] Animation
C1 ENERGY= 483.3 kJ/mol Energy+ZPE= 448.4 kJ/mol ZPE= 0.0845816 CONNECTIONS: o DDC663 o DDC662
[ TS1054 ] Animation
C1 ENERGY= 485.6 kJ/mol Energy+ZPE= 462.1 kJ/mol ZPE= 0.0889152 CONNECTIONS: o DDC665 o DDC664
[ TS1055 ] Animation
C1 ENERGY= 487.2 kJ/mol Energy+ZPE= 461.9 kJ/mol ZPE= 0.0882223 CONNECTIONS: o DDC667 o DDC666
[ TS1056 ] Animation
C1 ENERGY= 490.1 kJ/mol Energy+ZPE= 467.2 kJ/mol ZPE= 0.0891290 CONNECTIONS: o DDC669 o DDC668
[ TS1057 ] Animation
C1 ENERGY= 490.9 kJ/mol Energy+ZPE= 464.8 kJ/mol ZPE= 0.0879154 CONNECTIONS: o DDC671 o DDC670
[ TS1058 ] Animation
C1 ENERGY= 495.1 kJ/mol Energy+ZPE= 466.1 kJ/mol ZPE= 0.0868158 CONNECTIONS: o DDC673 o DDC672
[ TS1059 ] Animation
C1 ENERGY= 501.9 kJ/mol Energy+ZPE= 464.0 kJ/mol ZPE= 0.0834304 CONNECTIONS: o DDC675 o DDC674
[ TS1060 ] Animation
C1 ENERGY= 502.7 kJ/mol Energy+ZPE= 476.3 kJ/mol ZPE= 0.0878111 CONNECTIONS: o DDC677 o DDC676
[ TS1061 ] Animation
C1 ENERGY= 502.8 kJ/mol Energy+ZPE= 465.0 kJ/mol ZPE= 0.0834591 CONNECTIONS: o DDC679 o DDC678
[ TS1062 ] Animation
C1 ENERGY= 503.5 kJ/mol Energy+ZPE= 470.2 kJ/mol ZPE= 0.0851717 CONNECTIONS: o DDC681 o DDC680
[ TS1063 ] Animation
C1 ENERGY= 506.0 kJ/mol Energy+ZPE= 466.6 kJ/mol ZPE= 0.0828379 CONNECTIONS: o DDC683 o DDC682
[ TS1064 ] Animation
C1 ENERGY= 508.2 kJ/mol Energy+ZPE= 482.9 kJ/mol ZPE= 0.0882336 CONNECTIONS: o DDC685 o DDC684
[ TS1065 ] Animation
C1 ENERGY= 509.9 kJ/mol Energy+ZPE= 482.5 kJ/mol ZPE= 0.0874406 CONNECTIONS: o DDC687 o DDC686
[ TS1066 ] Animation
C1 ENERGY= 511.3 kJ/mol Energy+ZPE= 475.3 kJ/mol ZPE= 0.0841338 CONNECTIONS: o DDC689 o DDC688
[ TS1067 ] Animation
C1 ENERGY= 517.5 kJ/mol Energy+ZPE= 493.5 kJ/mol ZPE= 0.0887029 CONNECTIONS: o DDC691 o DDC690
[ TS1068 ] Animation
C1 ENERGY= 517.9 kJ/mol Energy+ZPE= 478.5 kJ/mol ZPE= 0.0828628 CONNECTIONS: o DDC693 o DDC692
[ TS1069 ] Animation
C1 ENERGY= 522.2 kJ/mol Energy+ZPE= 500.9 kJ/mol ZPE= 0.0897582 CONNECTIONS: o DDC695 o DDC694
[ TS1070 ] Animation
Cs ENERGY= 523.1 kJ/mol Energy+ZPE= 491.3 kJ/mol ZPE= 0.0857599 CONNECTIONS: o DDC697 o DDC696
[ TS1071 ] Animation
C1 ENERGY= 523.2 kJ/mol Energy+ZPE= 492.5 kJ/mol ZPE= 0.0861788 CONNECTIONS: o DDC699 o DDC698
[ TS1072 ] Animation
C1 ENERGY= 527.2 kJ/mol Energy+ZPE= 500.2 kJ/mol ZPE= 0.0875721 CONNECTIONS: o DDC701 o DDC700
[ TS1073 ] Animation
Cs ENERGY= 529.2 kJ/mol Energy+ZPE= 496.0 kJ/mol ZPE= 0.0852283 CONNECTIONS: o DDC703 o DDC702
[ TS1074 ] Animation
C1 ENERGY= 529.2 kJ/mol Energy+ZPE= 499.1 kJ/mol ZPE= 0.0863806 CONNECTIONS: o DDC705 o DDC704
[ TS1075 ] Animation
C1 ENERGY= 530.6 kJ/mol Energy+ZPE= 497.9 kJ/mol ZPE= 0.0853915 CONNECTIONS: o DDC707 o DDC706
[ TS1076 ] Animation
C1 ENERGY= 531.6 kJ/mol Energy+ZPE= 499.5 kJ/mol ZPE= 0.0856324 CONNECTIONS: o DDC709 o DDC708
[ TS1077 ] Animation
C1 ENERGY= 535.3 kJ/mol Energy+ZPE= 496.3 kJ/mol ZPE= 0.0830146 CONNECTIONS: o DDC711 o DDC710
[ TS1078 ] Animation
C1 ENERGY= 540.5 kJ/mol Energy+ZPE= 507.5 kJ/mol ZPE= 0.0853099 CONNECTIONS: o DDC713 o DDC712
[ TS1079 ] Animation
C1 ENERGY= 543.5 kJ/mol Energy+ZPE= 508.1 kJ/mol ZPE= 0.0843891 CONNECTIONS: o DDC715 o DDC714
[ TS1080 ] Animation
C1 ENERGY= 544.3 kJ/mol Energy+ZPE= 515.2 kJ/mol ZPE= 0.0867657 CONNECTIONS: o DDC717 o DDC716
[ TS1081 ] Animation
C1 ENERGY= 544.5 kJ/mol Energy+ZPE= 523.3 kJ/mol ZPE= 0.0898049 CONNECTIONS: o DDC719 o DDC718
[ TS1082 ] Animation
C1 ENERGY= 546.6 kJ/mol Energy+ZPE= 524.2 kJ/mol ZPE= 0.0893430 CONNECTIONS: o DDC721 o DDC720
[ TS1083 ] Animation
C1 ENERGY= 549.4 kJ/mol Energy+ZPE= 517.5 kJ/mol ZPE= 0.0856944 CONNECTIONS: o DDC723 o DDC722
[ TS1084 ] Animation
C1 ENERGY= 549.6 kJ/mol Energy+ZPE= 526.4 kJ/mol ZPE= 0.0890140 CONNECTIONS: o DDC725 o DDC724
[ TS1085 ] Animation
C1 ENERGY= 549.7 kJ/mol Energy+ZPE= 526.7 kJ/mol ZPE= 0.0890926 CONNECTIONS: o DDC727 o DDC726
[ TS1086 ] Animation
C1 ENERGY= 551.7 kJ/mol Energy+ZPE= 528.4 kJ/mol ZPE= 0.0889865 CONNECTIONS: o DDC729 o DDC728
[ TS1087 ] Animation
C1 ENERGY= 551.9 kJ/mol Energy+ZPE= 528.6 kJ/mol ZPE= 0.0889918 CONNECTIONS: o DDC731 o DDC730
[ TS1088 ] Animation
C1 ENERGY= 554.5 kJ/mol Energy+ZPE= 517.4 kJ/mol ZPE= 0.0837317 CONNECTIONS: o DDC733 o DDC732
[ TS1089 ] Animation
C1 ENERGY= 556.3 kJ/mol Energy+ZPE= 531.6 kJ/mol ZPE= 0.0884536 CONNECTIONS: o DDC735 o DDC734
[ TS1090 ] Animation
C1 ENERGY= 556.7 kJ/mol Energy+ZPE= 539.2 kJ/mol ZPE= 0.0911823 CONNECTIONS: o DDC737 o DDC736
[ TS1091 ] Animation
C1 ENERGY= 562.4 kJ/mol Energy+ZPE= 528.8 kJ/mol ZPE= 0.0850627 CONNECTIONS: o DDC739 o DDC738
[ TS1092 ] Animation
C1 ENERGY= 564.9 kJ/mol Energy+ZPE= 540.5 kJ/mol ZPE= 0.0885720 CONNECTIONS: o DDC741 o DDC740
[ TS1093 ] Animation
C1 ENERGY= 565.3 kJ/mol Energy+ZPE= 542.2 kJ/mol ZPE= 0.0890648 CONNECTIONS: o DDC743 o DDC742
[ TS1094 ] Animation
C1 ENERGY= 568.2 kJ/mol Energy+ZPE= 530.8 kJ/mol ZPE= 0.0836151 CONNECTIONS: o DDC745 o DDC744
[ TS1095 ] Animation
C1 ENERGY= 569.9 kJ/mol Energy+ZPE= 546.3 kJ/mol ZPE= 0.0888730 CONNECTIONS: o DDC747 o DDC746
[ TS1096 ] Animation
C1 ENERGY= 570.2 kJ/mol Energy+ZPE= 546.1 kJ/mol ZPE= 0.0886917 CONNECTIONS: o DDC749 o DDC748
[ TS1097 ] Animation
C1 ENERGY= 573.0 kJ/mol Energy+ZPE= 548.5 kJ/mol ZPE= 0.0885358 CONNECTIONS: o DDC751 o DDC750
[ TS1098 ] Animation
Cs ENERGY= 579.4 kJ/mol Energy+ZPE= 535.3 kJ/mol ZPE= 0.0810754 CONNECTIONS: o DDC753 o DDC752
[ TS1099 ] Animation
C1 ENERGY= 593.6 kJ/mol Energy+ZPE= 556.2 kJ/mol ZPE= 0.0836069 CONNECTIONS: o DDC755 o DDC754
[ TS1100 ] Animation
C1 ENERGY= 594.1 kJ/mol Energy+ZPE= 557.9 kJ/mol ZPE= 0.0840867 CONNECTIONS: o DDC757 o DDC756
[ TS1101 ] Animation
C1 ENERGY= 596.5 kJ/mol Energy+ZPE= 562.4 kJ/mol ZPE= 0.0848690 CONNECTIONS: o DDC759 o DDC758
[ TS1102 ] Animation
C1 ENERGY= 608.9 kJ/mol Energy+ZPE= 566.0 kJ/mol ZPE= 0.0815230 CONNECTIONS: o DDC761 o DDC760
[ TS1103 ] Animation
C1 ENERGY= 610.8 kJ/mol Energy+ZPE= 594.2 kJ/mol ZPE= 0.0915524 CONNECTIONS: o DDC763 o DDC762
[ TS1104 ] Animation
C1 ENERGY= 611.5 kJ/mol Energy+ZPE= 572.5 kJ/mol ZPE= 0.0829986 CONNECTIONS: o DDC765 o DDC764
[ TS1105 ] Animation
C1 ENERGY= 613.3 kJ/mol Energy+ZPE= 566.1 kJ/mol ZPE= 0.0798901 CONNECTIONS: o DDC767 o DDC766
[ TS1106 ] Animation
C1 ENERGY= 614.3 kJ/mol Energy+ZPE= 598.4 kJ/mol ZPE= 0.0918028 CONNECTIONS: o DDC769 o DDC768
[ TS1107 ] Animation
C1 ENERGY= 615.1 kJ/mol Energy+ZPE= 569.0 kJ/mol ZPE= 0.0802874 CONNECTIONS: o DDC771 o DDC770
[ TS1108 ] Animation
C1 ENERGY= 621.8 kJ/mol Energy+ZPE= 581.7 kJ/mol ZPE= 0.0825969 CONNECTIONS: o DDC773 o DDC772
[ TS1109 ] Animation
C1 ENERGY= 627.2 kJ/mol Energy+ZPE= 613.3 kJ/mol ZPE= 0.0925592 CONNECTIONS: o DDC775 o DDC774
[ TS1110 ] Animation
C1 ENERGY= 627.8 kJ/mol Energy+ZPE= 602.7 kJ/mol ZPE= 0.0882898 CONNECTIONS: o DDC777 o DDC776
[ TS1111 ] Animation
C1 ENERGY= 627.9 kJ/mol Energy+ZPE= 588.2 kJ/mol ZPE= 0.0827374 CONNECTIONS: o DDC779 o DDC778
[ TS1112 ] Animation
C1 ENERGY= 631.0 kJ/mol Energy+ZPE= 607.9 kJ/mol ZPE= 0.0890671 CONNECTIONS: o DDC781 o DDC780
[ TS1113 ] Animation
C1 ENERGY= 639.0 kJ/mol Energy+ZPE= 600.1 kJ/mol ZPE= 0.0830413 CONNECTIONS: o DDC783 o DDC782
[ TS1114 ] Animation
C1 ENERGY= 644.6 kJ/mol Energy+ZPE= 611.9 kJ/mol ZPE= 0.0853901 CONNECTIONS: o DDC785 o DDC784
[ TS1115 ] Animation
C1 ENERGY= 645.4 kJ/mol Energy+ZPE= 617.6 kJ/mol ZPE= 0.0872894 CONNECTIONS: o DDC787 o DDC786
[ TS1116 ] Animation
C1 ENERGY= 650.5 kJ/mol Energy+ZPE= 605.2 kJ/mol ZPE= 0.0806098 CONNECTIONS: o DDC789 o DDC788
[ TS1117 ] Animation
C1 ENERGY= 651.4 kJ/mol Energy+ZPE= 623.5 kJ/mol ZPE= 0.0872243 CONNECTIONS: o DDC791 o DDC790
[ TS1118 ] Animation
Cs ENERGY= 652.9 kJ/mol Energy+ZPE= 601.0 kJ/mol ZPE= 0.0780912 CONNECTIONS: o DDC793 o DDC792
[ TS1119 ] Animation
Cs ENERGY= 654.4 kJ/mol Energy+ZPE= 606.9 kJ/mol ZPE= 0.0797572 CONNECTIONS: o DDC795 o DDC794
[ TS1120 ] Animation
C1 ENERGY= 657.4 kJ/mol Energy+ZPE= 615.7 kJ/mol ZPE= 0.0819927 CONNECTIONS: o DDC797 o DDC796
[ TS1121 ] Animation
C1 ENERGY= 665.7 kJ/mol Energy+ZPE= 627.7 kJ/mol ZPE= 0.0833994 CONNECTIONS: o DDC799 o DDC798
[ TS1122 ] Animation
C1 ENERGY= 671.0 kJ/mol Energy+ZPE= 642.0 kJ/mol ZPE= 0.0868187 CONNECTIONS: o DDC801 o DDC800
[ TS1123 ] Animation
C1 ENERGY= 678.5 kJ/mol Energy+ZPE= 635.0 kJ/mol ZPE= 0.0813077 CONNECTIONS: o DDC803 o DDC802
[ TS1124 ] Animation
C1 ENERGY= 688.5 kJ/mol Energy+ZPE= 655.6 kJ/mol ZPE= 0.0853318 CONNECTIONS: o DDC805 o DDC804
[ TS1125 ] Animation
C1 ENERGY= 690.6 kJ/mol Energy+ZPE= 650.4 kJ/mol ZPE= 0.0825630 CONNECTIONS: o DDC807 o DDC806
[ TS1126 ] Animation
C1 ENERGY= 693.2 kJ/mol Energy+ZPE= 641.0 kJ/mol ZPE= 0.0779680 CONNECTIONS: o DDC809 o DDC808
[ TS1127 ] Animation
C1 ENERGY= 697.8 kJ/mol Energy+ZPE= 676.7 kJ/mol ZPE= 0.0898406 CONNECTIONS: o DDC811 o DDC810
[ TS1128 ] Animation
C1 ENERGY= 707.5 kJ/mol Energy+ZPE= 673.3 kJ/mol ZPE= 0.0848183 CONNECTIONS: o DDC813 o DDC812
[ TS1129 ] Animation
C1 ENERGY= 710.8 kJ/mol Energy+ZPE= 688.8 kJ/mol ZPE= 0.0894714 CONNECTIONS: o DDC815 o DDC814
[ TS1130 ] Animation
C1 ENERGY= 713.0 kJ/mol Energy+ZPE= 677.3 kJ/mol ZPE= 0.0842698 CONNECTIONS: o DDC817 o DDC816
[ TS1131 ] Animation
C1 ENERGY= 717.7 kJ/mol Energy+ZPE= 680.6 kJ/mol ZPE= 0.0837360 CONNECTIONS: o DDC819 o DDC818
[ TS1132 ] Animation
C1 ENERGY= 720.6 kJ/mol Energy+ZPE= 680.7 kJ/mol ZPE= 0.0826800 CONNECTIONS: o DDC821 o DDC820
[ TS1133 ] Animation
C1 ENERGY= 723.0 kJ/mol Energy+ZPE= 671.0 kJ/mol ZPE= 0.0780654 CONNECTIONS: o DDC823 o DDC822
[ TS1134 ] Animation
C1 ENERGY= 726.4 kJ/mol Energy+ZPE= 707.9 kJ/mol ZPE= 0.0908164 CONNECTIONS: o DDC825 o DDC824
[ TS1135 ] Animation
C1 ENERGY= 729.8 kJ/mol Energy+ZPE= 706.1 kJ/mol ZPE= 0.0888379 CONNECTIONS: o DDC827 o DDC826
[ TS1136 ] Animation
C1 ENERGY= 730.7 kJ/mol Energy+ZPE= 706.8 kJ/mol ZPE= 0.0887739 CONNECTIONS: o DDC829 o DDC828
[ TS1137 ] Animation
C1 ENERGY= 770.6 kJ/mol Energy+ZPE= 744.3 kJ/mol ZPE= 0.0878304 CONNECTIONS: o DDC831 o DDC830
[ TS1138 ] Animation
Cs ENERGY= 801.3 kJ/mol Energy+ZPE= 779.9 kJ/mol ZPE= 0.0897117 CONNECTIONS: o DDC833 o DDC832
[ TS1139 ] Animation
C1 ENERGY= 813.4 kJ/mol Energy+ZPE= 774.5 kJ/mol ZPE= 0.0830395 CONNECTIONS: o DDC835 o DDC834
[ TS1140 ] Animation
C1 ENERGY= 828.3 kJ/mol Energy+ZPE= 789.3 kJ/mol ZPE= 0.0830173 CONNECTIONS: o DDC837 o DDC836
[ TS1141 ] Animation
C1 ENERGY= 838.8 kJ/mol Energy+ZPE= 799.6 kJ/mol ZPE= 0.0829314 CONNECTIONS: o DDC839 o DDC838
[ TS1142 ] Animation
C1 ENERGY= 869.5 kJ/mol Energy+ZPE= 846.5 kJ/mol ZPE= 0.0891035 CONNECTIONS: o DDC841 o DDC840
[ TS1143 ] Animation
C1 ENERGY= 289.2 kJ/mol Energy+ZPE= 276.8 kJ/mol ZPE= 0.0931439 CONNECTIONS: o xx o EQ52
[ DDC0 ] C1 ENERGY= 65.8 kJ/mol FRAGMENTS: H5C2N H2O CONNECTIONS: o TS9 o EQ0
[ DDC1 ] C1 ENERGY= 86.6 kJ/mol FRAGMENTS: H5C2N H2O CONNECTIONS: o TS10 o EQ0
[ DDC2 ] C1 ENERGY= 267.5 kJ/mol FRAGMENTS: H4C2O H3N CONNECTIONS: o TS11 o EQ0
[ DDC3 ] C1 ENERGY= 165.7 kJ/mol FRAGMENTS: H4C H3CNO CONNECTIONS: o TS12 o EQ0
[ DDC4 ] C1 ENERGY= 405.5 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS13 o EQ0
[ DDC5 ] C1 ENERGY= 100.6 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS14 o EQ0
[ DDC6 ] C1 ENERGY= 484.5 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS15 o EQ0
[ DDC7 ] C1 ENERGY= 223.6 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS16 o EQ0
[ DDC8 ] C1 ENERGY= 291.6 kJ/mol FRAGMENTS: H4CO H3CN CONNECTIONS: o TS17 o EQ0
[ DDC9 ] C1 ENERGY= 24.5 kJ/mol FRAGMENTS: H4C2O H3N CONNECTIONS: o TS28 o EQ1
[ DDC10 ] C1 ENERGY= 256.8 kJ/mol FRAGMENTS: H4C2O H3N CONNECTIONS: o TS29 o EQ1
[ DDC11 ] C1 ENERGY= 162.9 kJ/mol FRAGMENTS: H4C H3CNO CONNECTIONS: o TS30 o EQ1
[ DDC12 ] C1 ENERGY= 75.1 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS31 o EQ1
[ DDC13 ] C1 ENERGY= 127.5 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS32 o EQ1
[ DDC14 ] C1 ENERGY= 435.6 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS33 o EQ1
[ DDC15 ] C1 ENERGY= 205.5 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS34 o EQ1
[ DDC16 ] C1 ENERGY= 440.8 kJ/mol FRAGMENTS: H5CNO H2C CONNECTIONS: o TS35 o EQ1
[ DDC17 ] C1 ENERGY= 191.5 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS36 o EQ1
[ DDC18 ] C1 ENERGY= 65.3 kJ/mol FRAGMENTS: H5C2N H2O CONNECTIONS: o TS45 o EQ2
[ DDC19 ] C1 ENERGY= 65.7 kJ/mol FRAGMENTS: H5C2N H2O CONNECTIONS: o TS46 o EQ2
[ DDC20 ] C1 ENERGY= 83.5 kJ/mol FRAGMENTS: H5C2N H2O CONNECTIONS: o TS47 o EQ2
[ DDC21 ] C1 ENERGY= 188.2 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS48 o EQ2
[ DDC22 ] C1 ENERGY= 227.6 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS49 o EQ2
[ DDC23 ] C1 ENERGY= 468.7 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS50 o EQ2
[ DDC24 ] C1 ENERGY= 434.9 kJ/mol FRAGMENTS: H5CNO H2C CONNECTIONS: o TS51 o EQ2
[ DDC25 ] C1 ENERGY= 456.7 kJ/mol FRAGMENTS: H2C H5CNO CONNECTIONS: o TS52 o EQ2
[ DDC26 ] C1 ENERGY= 288.2 kJ/mol FRAGMENTS: H4CO H3CN CONNECTIONS: o TS53 o EQ2
[ DDC27 ] C1 ENERGY= 64.5 kJ/mol FRAGMENTS: H5C2N H2O CONNECTIONS: o TS57 o EQ3
[ DDC28 ] C1 ENERGY= 104.1 kJ/mol FRAGMENTS: H4C2O H3N CONNECTIONS: o TS58 o EQ3
[ DDC29 ] C1 ENERGY= 51.6 kJ/mol FRAGMENTS: H4C2O H3N CONNECTIONS: o TS59 o EQ3
[ DDC30 ] C1 ENERGY= 63.0 kJ/mol FRAGMENTS: H4C H3CNO CONNECTIONS: o TS60 o EQ3
[ DDC31 ] C1 ENERGY= 432.9 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS61 o EQ3
[ DDC32 ] C1 ENERGY= 452.7 kJ/mol FRAGMENTS: H5CNO H2C CONNECTIONS: o TS62 o EQ3
[ DDC33 ] C1 ENERGY= 461.5 kJ/mol FRAGMENTS: H5CNO H2C CONNECTIONS: o TS63 o EQ3
[ DDC34 ] C1 ENERGY= 237.0 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS64 o EQ3
[ DDC35 ] C1 ENERGY= 431.4 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS65 o EQ3
[ DDC36 ] C1 ENERGY= 161.6 kJ/mol FRAGMENTS: H4C2O H3N CONNECTIONS: o TS71 o EQ4
[ DDC37 ] C1 ENERGY= 263.9 kJ/mol FRAGMENTS: H4C2O H3N CONNECTIONS: o TS72 o EQ4
[ DDC38 ] C1 ENERGY= 41.6 kJ/mol FRAGMENTS: H3CNO H4C CONNECTIONS: o TS73 o EQ4
[ DDC39 ] C1 ENERGY= 34.7 kJ/mol FRAGMENTS: H3CNO H4C CONNECTIONS: o TS74 o EQ4
[ DDC40 ] C1 ENERGY= 310.3 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS75 o EQ4
[ DDC41 ] C1 ENERGY= 315.7 kJ/mol FRAGMENTS: H4CNO H3C CONNECTIONS: o TS76 o EQ4
[ DDC42 ] C1 ENERGY= 457.0 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS77 o EQ4
[ DDC43 ] C1 ENERGY= 426.3 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS78 o EQ4
[ DDC44 ] C1 ENERGY= 483.5 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS79 o EQ4
[ DDC45 ] C1 ENERGY= 197.0 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS80 o EQ4
[ DDC46 ] C1 ENERGY= 4.6 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS85 o EQ5
[ DDC47 ] C1 ENERGY= 78.2 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS86 o EQ5
[ DDC48 ] C1 ENERGY= 187.5 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS87 o EQ5
[ DDC49 ] C1 ENERGY= 190.1 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS88 o EQ5
[ DDC50 ] C1 ENERGY= 438.8 kJ/mol FRAGMENTS: H2C H5CNO CONNECTIONS: o TS89 o EQ5
[ DDC51 ] C1 ENERGY= -30.8 kJ/mol FRAGMENTS: H3CNO H4C CONNECTIONS: o TS91 o EQ6
[ DDC52 ] C1 ENERGY= 142.4 kJ/mol FRAGMENTS: H4C H3CNO CONNECTIONS: o TS92 o EQ6
[ DDC53 ] C1 ENERGY= 429.7 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS93 o EQ6
[ DDC54 ] C1 ENERGY= 194.5 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS94 o EQ6
[ DDC55 ] C1 ENERGY= 473.6 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS95 o EQ6
[ DDC56 ] C1 ENERGY= 122.8 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS116 o EQ7
[ DDC57 ] C1 ENERGY= 35.6 kJ/mol FRAGMENTS: H4C2O H3N CONNECTIONS: o TS117 o EQ7
[ DDC58 ] C1 ENERGY= 334.6 kJ/mol FRAGMENTS: H2CO H5CN CONNECTIONS: o TS118 o EQ7
[ DDC59 ] C1 ENERGY= 121.0 kJ/mol FRAGMENTS: H5C2N H2O CONNECTIONS: o TS119 o EQ7
[ DDC60 ] C1 ENERGY= 128.7 kJ/mol FRAGMENTS: H5C2N H2O CONNECTIONS: o TS120 o EQ7
[ DDC61 ] C1 ENERGY= 285.2 kJ/mol FRAGMENTS: H4CO H3CN CONNECTIONS: o TS121 o EQ7
[ DDC62 ] C1 ENERGY= 320.6 kJ/mol FRAGMENTS: H3CO H4CN CONNECTIONS: o TS122 o EQ7
[ DDC63 ] C1 ENERGY= 322.9 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS123 o EQ7
[ DDC64 ] C1 ENERGY= 309.4 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS124 o EQ7
[ DDC65 ] C1 ENERGY= 320.8 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS125 o EQ7
[ DDC66 ] C1 ENERGY= 87.4 kJ/mol FRAGMENTS: H6C2N HO CONNECTIONS: o TS126 o EQ7
[ DDC67 ] C1 ENERGY= 216.3 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS127 o EQ7
[ DDC68 ] C1 ENERGY= 93.1 kJ/mol FRAGMENTS: H2CO H5CN CONNECTIONS: o TS128 o EQ7
[ DDC69 ] C1 ENERGY= 346.6 kJ/mol FRAGMENTS: H2CO H5CN CONNECTIONS: o TS129 o EQ7
[ DDC70 ] C1 ENERGY= 361.8 kJ/mol FRAGMENTS: H2CO H5CN CONNECTIONS: o TS130 o EQ7
[ DDC71 ] C1 ENERGY= 252.3 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS131 o EQ7
[ DDC72 ] C1 ENERGY= 415.1 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS132 o EQ7
[ DDC73 ] C1 ENERGY= 116.0 kJ/mol FRAGMENTS: H4CO H3CN CONNECTIONS: o TS141 o EQ8
[ DDC74 ] C1 ENERGY= 383.2 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS142 o EQ8
[ DDC75 ] C1 ENERGY= 362.2 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS143 o EQ8
[ DDC76 ] C1 ENERGY= 375.1 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS144 o EQ8
[ DDC77 ] C1 ENERGY= 186.4 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS145 o EQ8
[ DDC78 ] C1 ENERGY= 229.0 kJ/mol FRAGMENTS: H2CO H3CN H H CONNECTIONS: o TS156 o EQ9
[ DDC79 ] C1 ENERGY= 319.7 kJ/mol FRAGMENTS: H4C2O H3N CONNECTIONS: o TS157 o EQ9
[ DDC80 ] C1 ENERGY= 374.5 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS158 o EQ9
[ DDC81 ] C1 ENERGY= 357.3 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS159 o EQ9
[ DDC82 ] C1 ENERGY= 358.3 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS160 o EQ9
[ DDC83 ] C1 ENERGY= 374.2 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS161 o EQ9
[ DDC84 ] C1 ENERGY= 312.0 kJ/mol FRAGMENTS: H7C2NO CONNECTIONS: o TS162 o EQ9
[ DDC85 ] C1 ENERGY= 103.8 kJ/mol FRAGMENTS: H5C2N H2O CONNECTIONS: o TS172 o EQ10
[ DDC86 ] C1 ENERGY= 226.5 kJ/mol FRAGMENTS: H2CO H3CN H H CONNECTIONS: o TS173 o EQ10
[ DDC87 ] C1 ENERGY= 315.9 kJ/mol FRAGMENTS: H3CO H4CN CONNECTIONS: o TS174 o EQ10
[ DDC88 ] C1 ENERGY= 323.4 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS175 o EQ10
[ DDC89 ] C1 ENERGY= 340.3 kJ/mol FRAGMENTS: H3CO H4CN CONNECTIONS: o TS176 o EQ10
[ DDC90 ] C1 ENERGY= 314.7 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS177 o EQ10
[ DDC91 ] C1 ENERGY= 333.0 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS189 o EQ11
[ DDC92 ] C1 ENERGY= 332.8 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS190 o EQ11
[ DDC93 ] C1 ENERGY= 107.3 kJ/mol FRAGMENTS: H3CNO H4C CONNECTIONS: o TS191 o EQ11
[ DDC94 ] C1 ENERGY= 83.7 kJ/mol FRAGMENTS: H2CO H5CN CONNECTIONS: o TS198 o EQ12
[ DDC95 ] C1 ENERGY= 312.0 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS199 o EQ12
[ DDC96 ] C1 ENERGY= 331.6 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS200 o EQ12
[ DDC97 ] C1 ENERGY= 339.5 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS201 o EQ12
[ DDC98 ] C1 ENERGY= 317.7 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS208 o EQ13
[ DDC99 ] C1 ENERGY= 319.9 kJ/mol FRAGMENTS: H5CN H2CO CONNECTIONS: o TS209 o EQ13
[ DDC100 ] C1 ENERGY= 322.0 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS210 o EQ13
[ DDC101 ] C1 ENERGY= 315.7 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS211 o EQ13
[ DDC102 ] C1 ENERGY= 128.2 kJ/mol FRAGMENTS: H5C2N H2O CONNECTIONS: o TS224 o EQ14
[ DDC103 ] C1 ENERGY= 348.2 kJ/mol FRAGMENTS: H2CO H5CN CONNECTIONS: o TS225 o EQ14
[ DDC104 ] C1 ENERGY= 297.0 kJ/mol FRAGMENTS: H4CO H3CN CONNECTIONS: o TS226 o EQ14
[ DDC105 ] C1 ENERGY= 101.6 kJ/mol FRAGMENTS: H2CO H5CN CONNECTIONS: o TS227 o EQ14
[ DDC106 ] C1 ENERGY= 183.5 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS228 o EQ14
[ DDC107 ] C1 ENERGY= 135.5 kJ/mol FRAGMENTS: H4C2O H3N CONNECTIONS: o TS229 o EQ14
[ DDC108 ] C1 ENERGY= 102.4 kJ/mol FRAGMENTS: H5C2N H2O CONNECTIONS: o TS234 o EQ15
[ DDC109 ] C1 ENERGY= 332.6 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS235 o EQ15
[ DDC110 ] C1 ENERGY= 336.8 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS236 o EQ15
[ DDC111 ] C1 ENERGY= 125.5 kJ/mol FRAGMENTS: H3CNO H4C CONNECTIONS: o TS237 o EQ15
[ DDC112 ] C1 ENERGY= 133.9 kJ/mol FRAGMENTS: H3CN H4CO CONNECTIONS: o TS238 o EQ15
[ DDC113 ] C1 ENERGY= 141.2 kJ/mol FRAGMENTS: H6C2N HO CONNECTIONS: o TS250 o EQ16
[ DDC114 ] C1 ENERGY= 351.6 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS251 o EQ16
[ DDC115 ] C1 ENERGY= 118.8 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS252 o EQ16
[ DDC116 ] C1 ENERGY= 87.6 kJ/mol FRAGMENTS: H5C2N H2O CONNECTIONS: o TS253 o EQ16
[ DDC117 ] C1 ENERGY= 114.0 kJ/mol FRAGMENTS: H4CO H3CN CONNECTIONS: o TS254 o EQ16
[ DDC118 ] C1 ENERGY= 154.0 kJ/mol FRAGMENTS: H4CO H3CN CONNECTIONS: o TS255 o EQ16
[ DDC119 ] C1 ENERGY= 399.6 kJ/mol FRAGMENTS: H4CO H3CN CONNECTIONS: o TS256 o EQ16
[ DDC120 ] C1 ENERGY= 300.7 kJ/mol FRAGMENTS: H4CO H3CN CONNECTIONS: o TS257 o EQ16
[ DDC121 ] C1 ENERGY= 260.7 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS262 o EQ17
[ DDC122 ] C1 ENERGY= 81.1 kJ/mol FRAGMENTS: H6C2N HO CONNECTIONS: o TS263 o EQ17
[ DDC123 ] C1 ENERGY= 166.1 kJ/mol FRAGMENTS: H4C2O H3N CONNECTIONS: o TS264 o EQ17
[ DDC124 ] C1 ENERGY= 288.1 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS265 o EQ17
[ DDC125 ] C1 ENERGY= 74.8 kJ/mol FRAGMENTS: H5C2N H2O CONNECTIONS: o TS266 o EQ17
[ DDC126 ] C1 ENERGY= 92.8 kJ/mol FRAGMENTS: H7C2NO CONNECTIONS: o TS267 o EQ17
[ DDC127 ] C1 ENERGY= 199.0 kJ/mol FRAGMENTS: HCO H6CN CONNECTIONS: o TS268 o EQ17
[ DDC128 ] C1 ENERGY= 168.4 kJ/mol FRAGMENTS: H4C2O H3N CONNECTIONS: o TS278 o EQ18
[ DDC129 ] C1 ENERGY= 289.8 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS279 o EQ18
[ DDC130 ] C1 ENERGY= 72.3 kJ/mol FRAGMENTS: H5C2N H2O CONNECTIONS: o TS280 o EQ18
[ DDC131 ] C1 ENERGY= 368.5 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS281 o EQ18
[ DDC132 ] C1 ENERGY= 209.4 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS282 o EQ18
[ DDC133 ] C1 ENERGY= 237.0 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS283 o EQ18
[ DDC134 ] C1 ENERGY= 131.5 kJ/mol FRAGMENTS: H5C2N H2O CONNECTIONS: o TS289 o EQ19
[ DDC135 ] C1 ENERGY= 327.8 kJ/mol FRAGMENTS: H2CO H5CN CONNECTIONS: o TS290 o EQ19
[ DDC136 ] C1 ENERGY= 349.9 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS291 o EQ19
[ DDC137 ] C1 ENERGY= 299.5 kJ/mol FRAGMENTS: H4CO H3CN CONNECTIONS: o TS292 o EQ19
[ DDC138 ] C1 ENERGY= 174.3 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS293 o EQ19
[ DDC139 ] C1 ENERGY= 339.2 kJ/mol FRAGMENTS: H2CO H5CN CONNECTIONS: o TS294 o EQ19
[ DDC140 ] C1 ENERGY= 92.7 kJ/mol FRAGMENTS: H7C2NO CONNECTIONS: o TS303 o EQ20
[ DDC141 ] C1 ENERGY= 354.3 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS304 o EQ20
[ DDC142 ] C1 ENERGY= 315.0 kJ/mol FRAGMENTS: H4C2O H3N CONNECTIONS: o TS305 o EQ20
[ DDC143 ] C1 ENERGY= 252.5 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS306 o EQ20
[ DDC144 ] C1 ENERGY= 379.4 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS307 o EQ20
[ DDC145 ] C1 ENERGY= 384.5 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS308 o EQ20
[ DDC146 ] C1 ENERGY= 393.1 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS309 o EQ20
[ DDC147 ] C1 ENERGY= 379.7 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS310 o EQ20
[ DDC148 ] C1 ENERGY= 92.5 kJ/mol FRAGMENTS: H7C2NO CONNECTIONS: o TS311 o EQ20
[ DDC149 ] C1 ENERGY= 285.0 kJ/mol FRAGMENTS: H4CO H3CN CONNECTIONS: o TS320 o EQ21
[ DDC150 ] C1 ENERGY= 290.1 kJ/mol FRAGMENTS: H4CO H3CN CONNECTIONS: o TS321 o EQ21
[ DDC151 ] C1 ENERGY= 332.2 kJ/mol FRAGMENTS: H5CN H2CO CONNECTIONS: o TS322 o EQ21
[ DDC152 ] C1 ENERGY= 161.4 kJ/mol FRAGMENTS: H4CO H3CN CONNECTIONS: o TS323 o EQ21
[ DDC153 ] C1 ENERGY= 360.1 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS324 o EQ21
[ DDC154 ] C1 ENERGY= 429.4 kJ/mol FRAGMENTS: H4C2O H3N CONNECTIONS: o TS325 o EQ21
[ DDC155 ] C1 ENERGY= 332.2 kJ/mol FRAGMENTS: H2CO H5CN CONNECTIONS: o TS326 o EQ21
[ DDC156 ] C1 ENERGY= 340.3 kJ/mol FRAGMENTS: H3CO H4CN CONNECTIONS: o TS332 o EQ22
[ DDC157 ] C1 ENERGY= 300.5 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS333 o EQ22
[ DDC158 ] C1 ENERGY= 368.0 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS334 o EQ22
[ DDC159 ] C1 ENERGY= 141.8 kJ/mol FRAGMENTS: H4CO H3CN CONNECTIONS: o TS335 o EQ22
[ DDC160 ] C1 ENERGY= 354.9 kJ/mol FRAGMENTS: H2CO H5CN CONNECTIONS: o TS336 o EQ22
[ DDC161 ] C1 ENERGY= 145.6 kJ/mol FRAGMENTS: H4C2O H3N CONNECTIONS: o TS337 o EQ22
[ DDC162 ] C1 ENERGY= 349.5 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS342 o EQ23
[ DDC163 ] C1 ENERGY= 311.5 kJ/mol FRAGMENTS: H4CO H3CN CONNECTIONS: o TS343 o EQ23
[ DDC164 ] C1 ENERGY= 183.8 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS344 o EQ23
[ DDC165 ] C1 ENERGY= 188.5 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS347 o EQ24
[ DDC166 ] C1 ENERGY= 305.9 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS348 o EQ24
[ DDC167 ] C1 ENERGY= 370.4 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS349 o EQ24
[ DDC168 ] C1 ENERGY= 134.7 kJ/mol FRAGMENTS: H4CO H3CN CONNECTIONS: o TS350 o EQ24
[ DDC169 ] C1 ENERGY= 222.2 kJ/mol FRAGMENTS: H4C2O H3N CONNECTIONS: o TS351 o EQ24
[ DDC170 ] C1 ENERGY= 180.1 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS352 o EQ24
[ DDC171 ] C1 ENERGY= 336.1 kJ/mol FRAGMENTS: H2CO H5CN CONNECTIONS: o TS353 o EQ24
[ DDC172 ] C1 ENERGY= 97.5 kJ/mol FRAGMENTS: H7C2NO CONNECTIONS: o TS354 o EQ24
[ DDC173 ] C1 ENERGY= 180.8 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS355 o EQ24
[ DDC174 ] C1 ENERGY= 318.5 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS361 o EQ25
[ DDC175 ] C1 ENERGY= 358.9 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS362 o EQ25
[ DDC176 ] C1 ENERGY= 356.7 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS363 o EQ25
[ DDC177 ] C1 ENERGY= 174.1 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS364 o EQ25
[ DDC178 ] C1 ENERGY= 129.1 kJ/mol FRAGMENTS: H5C2N H2O CONNECTIONS: o TS365 o EQ25
[ DDC179 ] C1 ENERGY= 364.5 kJ/mol FRAGMENTS: H6C2O HN CONNECTIONS: o TS366 o EQ25
[ DDC180 ] C1 ENERGY= 307.0 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS370 o EQ26
[ DDC181 ] C1 ENERGY= 245.1 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS371 o EQ26
[ DDC182 ] C1 ENERGY= 90.9 kJ/mol FRAGMENTS: H7C2NO CONNECTIONS: o TS372 o EQ26
[ DDC183 ] C1 ENERGY= 228.1 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS376 o EQ27
[ DDC184 ] C1 ENERGY= 378.7 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS377 o EQ27
[ DDC185 ] C1 ENERGY= 388.3 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS378 o EQ27
[ DDC186 ] C1 ENERGY= 35.3 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS381 o EQ28
[ DDC187 ] C1 ENERGY= 135.5 kJ/mol FRAGMENTS: H3CNO H4C CONNECTIONS: o TS382 o EQ28
[ DDC188 ] C1 ENERGY= 315.8 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS387 o EQ29
[ DDC189 ] C1 ENERGY= 239.5 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS388 o EQ29
[ DDC190 ] C1 ENERGY= 359.4 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS391 o EQ30
[ DDC191 ] C1 ENERGY= 195.9 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS392 o EQ30
[ DDC192 ] C1 ENERGY= 38.8 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS396 o EQ31
[ DDC193 ] C1 ENERGY= 315.5 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS397 o EQ31
[ DDC194 ] C1 ENERGY= 219.8 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS398 o EQ31
[ DDC195 ] C1 ENERGY= 334.6 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS399 o EQ31
[ DDC196 ] C1 ENERGY= 329.9 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS400 o EQ31
[ DDC197 ] C1 ENERGY= 88.4 kJ/mol FRAGMENTS: H3CNO H4C CONNECTIONS: o TS401 o EQ31
[ DDC198 ] C1 ENERGY= 81.3 kJ/mol FRAGMENTS: H5C2N H2O CONNECTIONS: o TS409 o EQ32
[ DDC199 ] C1 ENERGY= 414.7 kJ/mol FRAGMENTS: H6C2 HNO CONNECTIONS: o TS410 o EQ32
[ DDC200 ] C1 ENERGY= 303.3 kJ/mol FRAGMENTS: H6C2N HO CONNECTIONS: o TS411 o EQ32
[ DDC201 ] C1 ENERGY= 323.1 kJ/mol FRAGMENTS: H7C2NO CONNECTIONS: o TS412 o EQ32
[ DDC202 ] C1 ENERGY= 374.4 kJ/mol FRAGMENTS: H3CNO H4C CONNECTIONS: o TS413 o EQ32
[ DDC203 ] C1 ENERGY= 358.2 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS414 o EQ32
[ DDC204 ] C1 ENERGY= 411.0 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS415 o EQ32
[ DDC205 ] C1 ENERGY= 611.4 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS416 o EQ32
[ DDC206 ] C1 ENERGY= 574.2 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS417 o EQ32
[ DDC207 ] C1 ENERGY= 79.1 kJ/mol FRAGMENTS: H5C2N H2O CONNECTIONS: o TS427 o EQ33
[ DDC208 ] C1 ENERGY= 391.7 kJ/mol FRAGMENTS: H7C2NO CONNECTIONS: o TS428 o EQ33
[ DDC209 ] C1 ENERGY= 299.4 kJ/mol FRAGMENTS: H6C2N HO CONNECTIONS: o TS429 o EQ33
[ DDC210 ] C1 ENERGY= 356.4 kJ/mol FRAGMENTS: H3CNO H4C CONNECTIONS: o TS430 o EQ33
[ DDC211 ] C1 ENERGY= 350.0 kJ/mol FRAGMENTS: H3CNO H4C CONNECTIONS: o TS431 o EQ33
[ DDC212 ] C1 ENERGY= 501.7 kJ/mol FRAGMENTS: H4C2 H3NO CONNECTIONS: o TS432 o EQ33
[ DDC213 ] C1 ENERGY= 237.8 kJ/mol FRAGMENTS: H5C2N H2O CONNECTIONS: o TS433 o EQ33
[ DDC214 ] C1 ENERGY= 363.1 kJ/mol FRAGMENTS: H3CNO H4C CONNECTIONS: o TS434 o EQ33
[ DDC215 ] C1 ENERGY= 139.9 kJ/mol FRAGMENTS: H3CN H4CO CONNECTIONS: o TS435 o EQ33
[ DDC216 ] C1 ENERGY= 357.1 kJ/mol FRAGMENTS: H3CNO H4C CONNECTIONS: o TS436 o EQ33
[ DDC217 ] C1 ENERGY= 627.2 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS437 o EQ33
[ DDC218 ] C1 ENERGY= 277.5 kJ/mol FRAGMENTS: H4C2 H3NO CONNECTIONS: o TS444 o EQ34
[ DDC219 ] C1 ENERGY= 389.5 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS445 o EQ34
[ DDC220 ] C1 ENERGY= 262.8 kJ/mol FRAGMENTS: H6C2 HNO CONNECTIONS: o TS446 o EQ34
[ DDC221 ] C1 ENERGY= 82.6 kJ/mol FRAGMENTS: H6C2N HO CONNECTIONS: o TS447 o EQ34
[ DDC222 ] C1 ENERGY= 287.8 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS448 o EQ34
[ DDC223 ] C1 ENERGY= 272.1 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS449 o EQ34
[ DDC224 ] C1 ENERGY= 421.7 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS450 o EQ34
[ DDC225 ] C1 ENERGY= 610.5 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS451 o EQ34
[ DDC226 ] Cs ENERGY= 340.5 kJ/mol FRAGMENTS: H4C2 H3NO CONNECTIONS: o TS463 o EQ35
[ DDC227 ] C1 ENERGY= 60.3 kJ/mol FRAGMENTS: H4C2O H3N CONNECTIONS: o TS464 o EQ35
[ DDC228 ] C1 ENERGY= 64.0 kJ/mol FRAGMENTS: H4C2O H3N CONNECTIONS: o TS465 o EQ35
[ DDC229 ] C1 ENERGY= 118.5 kJ/mol FRAGMENTS: H4C2O H3N CONNECTIONS: o TS466 o EQ35
[ DDC230 ] C1 ENERGY= 409.9 kJ/mol FRAGMENTS: H3CNO H4C CONNECTIONS: o TS467 o EQ35
[ DDC231 ] C1 ENERGY= 455.9 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS468 o EQ35
[ DDC232 ] C1 ENERGY= 455.6 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS469 o EQ35
[ DDC233 ] C1 ENERGY= 438.7 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS470 o EQ35
[ DDC234 ] C1 ENERGY= 34.9 kJ/mol FRAGMENTS: H5C2O H2N CONNECTIONS: o TS471 o EQ35
[ DDC235 ] C1 ENERGY= 32.0 kJ/mol FRAGMENTS: H5C2O H2N CONNECTIONS: o TS472 o EQ35
[ DDC236 ] C1 ENERGY= 445.8 kJ/mol FRAGMENTS: H5C2O H2N CONNECTIONS: o TS473 o EQ35
[ DDC237 ] C1 ENERGY= 375.2 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS474 o EQ35
[ DDC238 ] C1 ENERGY= 470.2 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS475 o EQ35
[ DDC239 ] C1 ENERGY= 635.9 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS476 o EQ35
[ DDC240 ] C1 ENERGY= 884.3 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS477 o EQ35
[ DDC241 ] C1 ENERGY= 451.2 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS484 o EQ36
[ DDC242 ] C1 ENERGY= 332.3 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS485 o EQ36
[ DDC243 ] C1 ENERGY= 365.5 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS486 o EQ36
[ DDC244 ] C1 ENERGY= 444.3 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS487 o EQ36
[ DDC245 ] C1 ENERGY= 444.3 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS493 o EQ37
[ DDC246 ] C1 ENERGY= 75.0 kJ/mol FRAGMENTS: H5C2O H2N CONNECTIONS: o TS494 o EQ37
[ DDC247 ] C1 ENERGY= 417.8 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS495 o EQ37
[ DDC248 ] C1 ENERGY= 250.4 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS499 o EQ38
[ DDC249 ] C1 ENERGY= 398.4 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS500 o EQ38
[ DDC250 ] C1 ENERGY= 257.0 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS505 o EQ39
[ DDC251 ] C1 ENERGY= 363.4 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS506 o EQ39
[ DDC252 ] C1 ENERGY= 586.5 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS507 o EQ39
[ DDC253 ] C1 ENERGY= 213.5 kJ/mol FRAGMENTS: H3CNO H4C CONNECTIONS: o TS511 o EQ40
[ DDC254 ] C1 ENERGY= 403.4 kJ/mol FRAGMENTS: H5C2N H2O CONNECTIONS: o TS512 o EQ40
[ DDC255 ] C1 ENERGY= 355.0 kJ/mol FRAGMENTS: H3CNO H4C CONNECTIONS: o TS513 o EQ40
[ DDC256 ] C1 ENERGY= 452.6 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS514 o EQ40
[ DDC257 ] C1 ENERGY= 629.2 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS515 o EQ40
[ DDC258 ] C1 ENERGY= 549.7 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS516 o EQ40
[ DDC259 ] C1 ENERGY= 582.4 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS517 o EQ40
[ DDC260 ] C1 ENERGY= 424.4 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS523 o EQ41
[ DDC261 ] C1 ENERGY= 61.4 kJ/mol FRAGMENTS: H4C2O H3N CONNECTIONS: o TS524 o EQ41
[ DDC262 ] C1 ENERGY= 424.1 kJ/mol FRAGMENTS: H4C2 HNO H H CONNECTIONS: o TS525 o EQ41
[ DDC263 ] C1 ENERGY= 389.0 kJ/mol FRAGMENTS: H3CNO H4C CONNECTIONS: o TS526 o EQ41
[ DDC264 ] C1 ENERGY= 423.0 kJ/mol FRAGMENTS: H3CNO H4C CONNECTIONS: o TS527 o EQ41
[ DDC265 ] C1 ENERGY= 465.5 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS528 o EQ41
[ DDC266 ] C1 ENERGY= 419.6 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS529 o EQ41
[ DDC267 ] C1 ENERGY= 597.0 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS530 o EQ41
[ DDC268 ] C1 ENERGY= 673.2 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS531 o EQ41
[ DDC269 ] C1 ENERGY= 44.5 kJ/mol FRAGMENTS: H5C2N H2O CONNECTIONS: o TS536 o EQ42
[ DDC270 ] C1 ENERGY= 231.1 kJ/mol FRAGMENTS: H3C2N H2O H H CONNECTIONS: o TS537 o EQ42
[ DDC271 ] C1 ENERGY= 69.1 kJ/mol FRAGMENTS: H6C2N HO CONNECTIONS: o TS542 o EQ43
[ DDC272 ] C1 ENERGY= 102.7 kJ/mol FRAGMENTS: H5C2N H2O CONNECTIONS: o TS543 o EQ43
[ DDC273 ] C1 ENERGY= 231.8 kJ/mol FRAGMENTS: H5C2N H2O CONNECTIONS: o TS546 o EQ44
[ DDC274 ] C1 ENERGY= 234.5 kJ/mol FRAGMENTS: H5C2N H2O CONNECTIONS: o TS547 o EQ44
[ DDC275 ] C1 ENERGY= 252.5 kJ/mol FRAGMENTS: H5C2N H2O CONNECTIONS: o TS548 o EQ44
[ DDC276 ] C1 ENERGY= 544.0 kJ/mol FRAGMENTS: H6C2N HO CONNECTIONS: o TS549 o EQ44
[ DDC277 ] C1 ENERGY= 536.6 kJ/mol FRAGMENTS: H6C2N HO CONNECTIONS: o TS550 o EQ44
[ DDC278 ] C1 ENERGY= 96.0 kJ/mol FRAGMENTS: H4CO H3CN CONNECTIONS: o TS557 o EQ45
[ DDC279 ] C1 ENERGY= 304.5 kJ/mol FRAGMENTS: H7C2NO CONNECTIONS: o TS558 o EQ45
[ DDC280 ] Cs ENERGY= 251.3 kJ/mol FRAGMENTS: H5C2 H2NO CONNECTIONS: o TS562 o EQ46
[ DDC281 ] C1 ENERGY= 274.5 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS563 o EQ46
[ DDC282 ] C1 ENERGY= 275.0 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS564 o EQ46
[ DDC283 ] C1 ENERGY= 650.5 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS565 o EQ46
[ DDC284 ] C1 ENERGY= 463.1 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS566 o EQ46
[ DDC285 ] C1 ENERGY= 251.3 kJ/mol FRAGMENTS: H6C2 HNO CONNECTIONS: o TS568 o EQ47
[ DDC286 ] C1 ENERGY= 277.5 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS569 o EQ47
[ DDC287 ] C1 ENERGY= 427.7 kJ/mol FRAGMENTS: H4C2 HNO H H CONNECTIONS: o TS570 o EQ47
[ DDC288 ] C1 ENERGY= 708.2 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS571 o EQ47
[ DDC289 ] C1 ENERGY= 84.1 kJ/mol FRAGMENTS: H2CO H5CN CONNECTIONS: o TS577 o EQ48
[ DDC290 ] C1 ENERGY= 107.4 kJ/mol FRAGMENTS: H2CO H5CN CONNECTIONS: o TS578 o EQ48
[ DDC291 ] C1 ENERGY= 96.1 kJ/mol FRAGMENTS: H2CO H5CN CONNECTIONS: o TS579 o EQ48
[ DDC292 ] C1 ENERGY= 334.9 kJ/mol FRAGMENTS: H3CO H4CN CONNECTIONS: o TS580 o EQ48
[ DDC293 ] C1 ENERGY= 82.9 kJ/mol FRAGMENTS: H4C2O H3N CONNECTIONS: o TS581 o EQ48
[ DDC294 ] C1 ENERGY= 266.1 kJ/mol FRAGMENTS: H4C2O H3N CONNECTIONS: o TS586 o EQ50
[ DDC295 ] C1 ENERGY= 232.8 kJ/mol FRAGMENTS: H5C2N H2O CONNECTIONS: o TS587 o EQ50
[ DDC296 ] C1 ENERGY= 142.4 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS588 o EQ50
[ DDC297 ] C1 ENERGY= 88.4 kJ/mol FRAGMENTS: H6C2NO H CONNECTIONS: o TS589 o EQ50
[ DDC298 ] C1 ENERGY= 168.9 kJ/mol FRAGMENTS: H4C H3CNO CONNECTIONS: o TS590 o EQ50
[ DDC299 ] C1 ENERGY= 266.6 kJ/mol FRAGMENTS: H4C2O H3N CONNECTIONS: o TS592 o EQ51
[ DDC300 ] C1 ENERGY= 17.1 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS593 o EQ51
[ DDC301 ] C1 ENERGY= 104.8 kJ/mol FRAGMENTS: CO H4C H3N CONNECTIONS: o TS596 o EQ52
[ DDC302 ] C1 ENERGY= 630.5 kJ/mol FRAGMENTS: H2CO H3CN H H CONNECTIONS: o TS597 o EQ52
[ DDC303 ] C1 ENERGY= 628.1 kJ/mol FRAGMENTS: H2CO H3CN H H CONNECTIONS: o TS598 o EQ52
[ DDC304 ] C1 ENERGY= 150.8 kJ/mol FRAGMENTS: CO H5CN H H CONNECTIONS: o TS599 o EQ53
[ DDC305 ] C1 ENERGY= 121.5 kJ/mol FRAGMENTS: H4C2O H3N CONNECTIONS: o TS606 o EQ55
[ DDC306 ] C1 ENERGY= 171.7 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS607 o EQ55
[ DDC307 ] C1 ENERGY= 160.7 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS608 o EQ55
[ DDC308 ] C1 ENERGY= 169.7 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS609 o EQ55
[ DDC309 ] C1 ENERGY= 104.6 kJ/mol FRAGMENTS: H5C2N H2O CONNECTIONS: o TS617 o EQ56
[ DDC310 ] C1 ENERGY= 111.6 kJ/mol FRAGMENTS: H4C2O H3N CONNECTIONS: o TS618 o EQ56
[ DDC311 ] C1 ENERGY= 345.3 kJ/mol FRAGMENTS: H6C2N HO CONNECTIONS: o TS619 o EQ56
[ DDC312 ] C1 ENERGY= 214.4 kJ/mol FRAGMENTS: H7C2NO CONNECTIONS: o TS620 o EQ56
[ DDC313 ] C1 ENERGY= 225.5 kJ/mol FRAGMENTS: H7C2NO CONNECTIONS: o TS621 o EQ56
[ DDC314 ] C1 ENERGY= 115.7 kJ/mol FRAGMENTS: H5C2N H2O CONNECTIONS: o TS625 o EQ57
[ DDC315 ] C1 ENERGY= 127.1 kJ/mol FRAGMENTS: H4C2O H3N CONNECTIONS: o TS626 o EQ57
[ DDC316 ] C1 ENERGY= 181.8 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS627 o EQ57
[ DDC317 ] C1 ENERGY= 172.0 kJ/mol FRAGMENTS: H5C2NO H H CONNECTIONS: o TS628 o EQ57
[ DDC318 ] C1 ENERGY