Title Card Required mo=40 MO coefficients +23 -9.285054 -10.447807 -9.094865 1 BOHR isosurface ID "isosurface1" select ({0:22}) sign color [xff0000] [x0000ff] cutoff 0.02 /*file*/"file:/D:/Cloud Storage/OneDrive/Imperial College London/Laboratories/Year 3/Computational Labs/Transition States and Reactivity/Multimedia/ENDOOPT_PM6_TS_PM6_TS_631GD_mo40.cub"; isosurface ID "isosurface1" fill noMesh noDots notFrontOnly frontlit; color isosurface translucent 0.5; -}x[) %-$M'*(K()(K()'}x% %.~%0 J'-~%0 K~%0 -~%0 }_E '+'J)))H+'+G+'+G+'*I)()}>% (+'J)))I))(K'+'}HD (+'I*)*F,',E,~%0 -E,~%0 -E,~%0 -F+~%0 ,H)()}a$ (()J*'*I*'*I)()K'*'}4C ~%0 -~%0 H+)*E-',D-~%0 .C.%.C.%.C.%.D-%-F+'+})$ ~%0 (~%0 N)~%0 *J*~%0 +I*~%0 +I*'*J(()L~%0 +%}UB )+)E,(,C.'-B.~%0 /A/%/A/%/A/%/B.%.D,~%0 -}'$ (~%0 (L+%*J+%+H,%+I*~%0 +I*'*J()'}wA ~%0 .'G**+C-(-B.~%0 /@0%/@0%0?0%0?0%/A/%/B-~%0 .J%(%P)%)K+%*I,%+H,%,G,%+I*'*J(()}uA (-(E,),B.'.@/~%0 0>1%0>1%0>1%0>1%0?0%0@.'-J~%1 'N*%)K+$,H,%,G,%,G,%,G+~%0 +I)()}tA )-)C-)-@/'/>0~%0 0>1%1=1%1=1%1=1%1=1%0@-)-H'~%0 'N*%*I,$,G-%,F-%,F-%,G+~%0 ,H)(*}rA *-)B-*-@.(/>0'0~;0 1~%0 1~;0 2%1~;0 2%1~;0 2%1=0'0>,-,G'~%0 (L+%+G-%,F-%-E-%-E-%-E,~%0 ,G*(*}rA ).*A-*-?/(/>0'0~;0 1~%0 1~;0 1~%0 2;1~%0 2;1'1;0)/>*1*E)~%0 *I,%,F-%-D.%-D.%.C.%-E,~%0 -F*(+}v% $.%K(+'J(+'K'+'}u~;0 (0)A-+,?/).=0(0~;0 1'1;1'1;1'1;0)0;.--=*%~%0 ('%)C,%+G-%-D.%.B/%.B/%.C-~%0 .C-',E+(+}>% $.%K(*)H*))H*))I)))I(+'}>~;0 %4~%0 B,-+?.+-=0)/~;0 0(1;0(1;0)0;/+/;-/-~;0 '~%0 )~%0 *~%0 'A-%,E.%.B/%.B/%/A/%/A.~%0 .C-'-D+(,};% (+'I*(*H+'+G+'+G*(+H(*)}s~;0 )0*?-,->.*/~;0 0)/~;0 /*0;/+/;-..;1''$,~;0 %~%0 +~%0 ,~%0 %@.%-C/%.B/%/A/%/A/%/A.~%0 /A.~%0 .D+(,I%-$}b$ )))H*(+G+'+G+'+G*(*I(*(}Y8 ~%0 -%K(+'J(*(J(*(K'*'N$,$}($ ~%0 5~%0 A+/+>--,>.+.~;0 .,.~;0 .--~;0 ,%$*%$,~;0 (%*')~%0 '=$~%0 -%-D.%.B/%.B/%/@0%/@0%/A.~%0 /A.~%0 .C-',G))(}`$ )))H+'+G+'+G+'+H)(*K~%0 +%}g$ ~%0 %%T~%0 %~%0 }S5 ~%0 -~%0 J(*)H*))H*(+G*(*I*'*J)')L'('}~%0 $ (3(@+/+>,.,>,.-=+0,=)%'((%(C+~%0 ,E.%-C/%.B/%/@0%/@0%/@0%/A/%/A.~%0 .C-~%0 -F+'*}_$ (*(I*(*H+'*I)(*J$$%*%$$K'-'H)+(H+'*I*~%0 +J)~%0 )O%(%}t4 (+(H*)*G*(+F,'+F,'+G+~%0 ,H*~%0 +J)~%0 *L('(O%(~%0 I(3'A*1)@*1)A~%0 6'E)()H,~%0 ,E-~%0 .B/%.B/%/@0%/@0%/@0%/A/%/A/%.C-~%0 -F+~%0 +L~%0 )~%0 }+$ ~%0 ,~%0 K))(K()(K%$$*%$%I(,(G***F+)*G+'+G+'*I*')N%)%}s4 (+(H*)*F,'+F,',E,~%0 ,F,~%0 ,G+~%0 +I*~%0 +J)~%0 )M(''P%)$L$6$}^$ )(*G,',D-~%0 .B.~%0 .B/%/A/%/A/%/A/%/A/%.C.%.D-%-F+~%0 +K('(}v% (-'G*+)F+)*F+(+F+(+G*(+H)))}M5 (+(H*)*F,'+F,',E,~%0 ,F,~%0 ,G,%,H+%+J)~%0 *L(~%0 (}x% (*)G+(,D-'-B.~%0 .B.~%0 /A.~%0 /A.~%0 /A/%.C.%.C.%-E-%,H+%+K('(}v% (,(G***F+)*F+)*F+(+G*))I(+'}N5 (+(H*)*F+(+F,'+F,~%0 ,G+~%0 ,G+~%0 +I*~%0 +J)~%0 )P$(%Q%*~%0 N~%0 *'}>% )**F+(,D-'-C-'-C-'-C-~%0 .C-~%0 .D-%-F,%,H+%+J)~%0 *M~%0 (~%0 }y% '-'H)+)G)**G*)*G)**H(+(},6 ~%0 -%K(*)H*)*G*(+G+'+G+'*I*~%0 +J)')M~%0 (~%0 },$ ()'L(()K()'}>% (,(G***F+)+E+(,E,',F+'+H*~%0 +J)~%0 *L(~%0 )O%)$R%)%P'''O'''}@% ~%0 .'I',(I',(I'-~%0 }C7 ~%0 -%K(+'J)))I)(*I)()K(((O$+$}-$ ~%0 +~%0 K)(*I)(*I)))K%,~%0 }x% ~%0 -~%0 K'+'K'*'M')~%0 O~%0 )%}f$ ~%0 )~%0 M)'(L)~%0 )M('(N~%0 ('}D~;0 $.$N%,%}x% )))H*(+G+'+G*(*I(*(}^) (*(J*'*I*~%0 +I*~%0 *K)~%0 *L'((}L? ~%0 -~%0 I*)*F+(+F,'+F+(+G*))J~%0 -~%0 }j' %1$I)+)G*(+F,'+G+~%0 ,G+~%0 +I*')L'((}K? (+(H*)*F+(+F+(,E+(+G*)*H(+(}h' (-(F***F+(,E,',E,'+G+'+H*'*J()'}J? )+(G+)*F+(,E+(,E+)+E+)*G)+(}1' ~%0 /~%0 G*+)F+)+E+(,E,',E,',F+'+H)(*K~%0 +~%0 }K? ',(H)**F+)*F+)+E+)*G)**G(,(}0' '.'G),)F**+E+)+E+)+E+)*G*)*H(*(}(@ '-~%0 I)+(H)**F***G)**G)+(I'-~%0 }2' %0%I(-(F*+)F*+)F***G)+)H(+(}=A '-~%0 J',(H(,(I',(I'-~%0 }H( %0%I'.'H(-(G(-'I~%0 .'}L>( -}r5 '$%('$%}t~%0 '$%%)}q~%0 ~%0 $%%($%}p~%0 )$%**}z' ('~%0 $%2('~%0 $%}^( '$%@)$%6(5~%0 $%}9( ~%0 %%5*~;0 %%'$%2)%%}U( )%%7'$%0%%~%0 5%}g( *,'~;0 '%%5'}+( %%~%0 '~%0 %%$%/~%0 %%%%/'%~%0 ,%/%}9~%0 ('(5)$%8$%%}V( %'~%0 )~%0 .~%0 %~%0 %%%$-%%(,%/~%0 }j% ~%0 %%4(E~%0 $%}r( (7+7($~%0 }>5 ~%0 $%}7' (%~%0 '(%~%0 +)($%%}r~%0 (}H' %'$%%1~%0 %~%0 )(%~%0