Optimisation and freq of OMe substituted mo=61 MO coefficients +33 -13.053724 -10.886577 -9.202741 BOHR isosurface ID "isosurface1" select ({}) sign [xff0000] [x0000ff] /*file*/"file:/Volumes/USB2/Compuational/chlorocarbene/cube files/14_61_HOMO-3.cub"; isosurface ID "isosurface1" fill noMesh noDots notFrontOnly frontlit; -}p'+ %`'_'_'_(^'_'`%}6L '^)]*!*[+[+!*!*!)^(`$}+J ~%0 ^*!*[,Z,*~%0 P-('P-('P,)'P,[+[*](}(J (]*!+)'P-')O.%*O7O8N.$+O-~%0 *O-('Q+!)_%}CI )!+)'Q,~%0 *O8N8'%H8~%1 H8~%1 H8'%H8O,%+P+()Q)_%}sG ~%0 _'_'%(*'L'%*'*L%%7~%1 I7~%0 'G8%)F8%)F8%)F8%)F8%(D%%7~%1 D'$,~%0 *K'%))(M'_'}RF ~%0 _(]*!)/(L($*'*'~%0 D~;0 %(C'$7%)B~%0 %7%*B$~%0 7$+B$~%0 7$+A~%0 %7$+A'$7%)B'$7%)A)$*~%0 +''C)%~%0 *)K)1%N)^'}kE (!*!+Z+.)'~%0 C+-*~%0 (B1%-$*A)$6$+@(%6$+@(%6$+@(%6$+@(%6$+@)$6$+@1%-$*A*%~%0 (,%)A+-*'~%0 D+.'L+!)_%}]A '_'_'`%}~;0 $ )!+[,.%L,-)~%0 (B,,*%*A+,,$+@*%'~%0 -$+@*%4$+@)%4%,?)%4%,?)%5$,?*%'~%0 -$+@+,,$+@,,*%*A,-)~%0 (B--')$E+!*^~%0 }N$ '_'_'`%}~;0 = '^)!*])^'}~;0 $ )[,Z,Y--''(B-+*%*A,,+$+@+,,$+@++,%,?*,.$+?*,+$%$+?*,,%,?+,,$+@,+,$+@-+*%*A-,)%)B-.%)~%0 D,[*_%h~%0 _(]*!*](`%}q; %^)!+[+[+!)}~;0 $ )!,Y-5%D.,'~%0 )B.+)%*A-+*$,@,,*$,@+,+%,?+,-$+?+,*$%$+?+,+%,?,,*$-?-+*$,@-,)%*A.,'~%0 *B-4'E,[*}J$ (]*[+[+!*^'}o; ~%0 ]*[,Z,Z,[*^$!~%0 ^,Y-4%E.2)C-,'~%0 *B,,)$,A+-)$,A*-*$-@*-*%,@*-*%,@*-*$-@+-)$,A,,)$,A-,(%*B.,~%1 )C.3'E-[)}H$ )!+[,Z,[*^'}R~;0 +Z,Y-Z,[)^~%0 }A$ +Z-X.2(D,.$'*B,.~%0 %,A*/($,B)/($,B(/)$-A(/)$-A(0($,A*/($,A+.($,B,.%~%0 *C-2)E-3%H,]%d$`)!,Z,Z,[+^'}Q~;0 *Z-Y-Y,!)^'a$_*Z.W.0'F+3)E(6*E%3%%,U'$,U'$,U'$,U'$,D%2~%0 %,C'6+D)5)F,2'H.Y,}C$ ~%0 ^)!+Z-Y-Z+}6= )!,Z,Z,[*_~%0 f~%0 [,Y.Y-^(,'S~%0 +)S%+*K~%0 '%'$~%0 *K''$~%0 %%+K''$~%0 %%+K~%0 '%'$~%0 *R%+*Q~%0 +)Q','O*X.Y-!([%^)!*[,Z,[*}8= '^*!*!*])_~%0 '']*[,Z,[,!*X%~%0 )+%M'~%0 (*'K)%(*(J*%'%$~%0 )J*%'%$~%0 )J)%(*(K(%(*(L%~%0 )*'Q*[+Y-X-[+!(V)!*!*!*](}:= ~%0 _(^)])^')%_)!+Z-Z,[,V%~%0 +U(%*T*%)T+$)$%Q+$(%%Q+$(%%Q+$)$%Q*%)U)$*V~%0 %+Z,Y,Y-Y-Z+T'('U)])])^~%0 }|= ~%0 `~%0 `~%0 a$))!+Z-Y-Z-V$~%0 ,T)$+T*$*S,$)%$P,$)$~%0 O,$($(N,$($(N,$($'O,$)$~%0 O+$*T)$+U~%0 %,Y-X.X-Z+!)U~%0 *%W~%0 `~%0 }8@ %^*!,Y-Y.Y-T($,S*$+S+$*R-$)$'M-$($(M:L:L3$(M-$)$'N+$*%%O*$+T($,Y-X.X-Y-Z+]'}SA ~%0 ^*[-Y-Y.Y-T($,S*$+R,$*%~%0 M-$(%(L3$)L.$/K.$/K.$'$)L-$($)L4$'N3S)$,U%%-X.X-Y-Z+!(}SA ~%0 ^*[,Z-Y-Z-T($,S*$+R3%(L-$($*K.$'$*K.$/K.$/K.$'$*K3$*K3%(M3~%0 %N3U%%-X.X-Y-Y,!(}6B *!,Z-Y-Z,U($+T*$*'%M3%)K-$($*K.$~%0 %+J.$~%0 $,J.$~%0 $,J.$~%0 $,J.$'$*K-$(%)L2~%0 'N($+Z,Y-Y-Y,Z+]~%0 }8B )!,Z-Z-Z,V~%0 %+U)$*~%1 N1~%0 )K-%~%0 %+J.%%%+J.%$%,J.%$%,J.%%$,J.$~%0 %+K,$'~%0 )L+$)~%0 'N($+Z,Y-X-Y,[*}vB ~%0 _*!,Z-Z,!*W($)''M+%'~%0 )L,~%0 $~%0 +K-(,J.(-I.(-I.(,K-)+K,$~%1 *M)%(''T*[+Z,Y,Z+[(}K? '^(^(_'}?$ ~%0 _*!,[,[,!*_'(~%0 P(-)M+*+K-(,K-(,K-(,K-(,L+*+L*,)O%''('T)[+Y-Y+Z*]'}L$ %`'^(_'`%}I: (^)!*!+[*])V(~%1 X)]+!+!+])}O$ (P(+*N**+L+),L,(,L+*+M)++!)^~%0 T(!*Z,Y+[*!(_$((^)!*!*!*])^~%0 }$9 '^)!+[+Z,[+T~%0 '+S)%*T*%(V+!+!*^(}R$ ~%0 _)Q$-*O(++N(++O~%0 ,*])^'}7$ (!*[+Z+Z+$'V)%*U'~%0 *!+Z,Z,[+[*](}|8 (]*!+Z,Z,Z,S'~%0 ,S(%,S*$*T0W+!*^(}9% ~%0 _(^)])](_'}w$ '])[+Z+$'V*$)U)%*T(%,T%',Z,Z,Z,[*])}{8 (]*[,Z,Z,Z,S'~%0 ,S(%,S)$+T*$)V*$~%0 Y)_(}`~%0 $b%}C~%0 '^)[*%$X*$)U)$+T(%+T'~%0 ,T%',Z,Z,Z,[*](}#9 ~%0 ^*!+Z,Z,Z,T~%1 ,S'~%0 +T(%+T)%)V)%'X(`~%0 }k* %_(](%~%0 X(%)U(%+T(%+U~%1 ,Z,Z,Z,Z,[*](}b9 (]*[+[,Z,Z+U%'+U~%1 *V'~%0 )W'~%1 [%}7, %`~%0 '$Z~%1 (W~%0 ')V~%1 +[+[,Z,Z,[*](_~%0 }e9 $`(])]*[+[*])](_~%0 }(/ ~%0 _(^)!*!+!*!*](_~%0 }p; %`'_'_~%0 `~%0 }t1 ~%0 `~%0 `'_'`%})J $}zL $}u{ %`'_'_'`%}v, '_'_'_~%0 };B %_)])])])^'}6, ~%0 ^)])])])^'}SA '^)]*!*!*](}5, '^(]*!*!)])_%}P~;0 %}?' (]*!*!*])^'!%b%}E) %`~%0 d~%0 ^)!*!*!*!)_~%0 }K~%0 %}%9 %}?' (])]*])[*[($$!(^(_'a$}8' '_'^(^(_~%0 $~%0 ^)])!*](_%}o@ ~%0 _(_'!%$'[($$!)])])^(_~%0 }S~%0 $`'^)])])](_~%0 $~%0 _'^(_~%0 }]C ~%0 _(^)])])^(_~%0 }S~%0 $`(])])])])](}kE '^)])])])^(`$}8' '_(])])])](`$}-E ~%0 `'_(^(^'`%}^( '_(^(^'_'}WC %a%a%}P$ %a~%0 `%}k* %a%a%}$% %a%}VA $a%}u1 %a%};~%0 , -}>5 %N$$%}6~%0 %%%8$%~%0 }S$ $%%O~%0 H$$%%%}v% ~%0 %$D%%%}a$ %%%H%}]' %I(H'}/) %9%7'}^( %:%%~%0 7%$%}.3 %$%}h+ %$%}x9 %4'/'5%~%0 %}~%1 $%~%0 5$%%:~%0 9~%0 /%%%+%-%$%3%}0% $%~%0 3$J%/~%0 .%7%'%0~%0 =~%0 6'}c$ 'A$9$2%%$5%*~%0 1%1$$%K%9%}.% ~%0 7~%0 %$}Q$ %7%}4% (},% ~%0 8%%~%0 }W~;0 %:%$%}X' %'%0%}z9 ~%0 9~%0 $%}.$ $$%$%4%$%/%}~%0 $ %%$$%6~%0 }:$ %.%%%}C% ~%1 %