%chk=000223327.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000223327

0 1
I -4.579748 1.627604 0.000251
O 0.634944 -1.794823 -0.000267
C -0.453921 0.288167 0.000077
C 0.978690 0.532603 0.000051
C -0.606153 -1.134328 -0.000092
C 1.593400 -0.756443 -0.000169
C -1.592176 1.089122 0.000112
C 1.791292 1.662805 0.000182
C -1.837862 -1.776003 -0.000096
C 2.966170 -0.958409 -0.000245
C -2.831838 0.444705 0.000176
C 3.180209 1.480879 0.000070
C -2.968025 -0.948289 0.000105
C 3.754308 0.199477 -0.000109
H -1.508386 2.176431 0.000312
H 1.356508 2.660295 0.000287
H -1.918226 -2.859916 -0.000144
H 3.398728 -1.954583 -0.000394
H -3.961183 -1.405116 0.000286
H 3.831848 2.353970 0.000174
H 4.840622 0.101151 -0.000168


%chk=000223327-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000223327

0 1
I -4.644766 1.670802 0.000342
O 0.641136 -1.808851 -0.000195
C -0.453562 0.267618 0.000087
C 0.986883 0.516196 0.000042
C -0.611965 -1.150961 -0.000057
C 1.608588 -0.768779 -0.000133
C -1.603992 1.089583 0.000205
C 1.804316 1.669948 0.000138
C -1.857666 -1.788844 -0.000065
C 2.994761 -0.962451 -0.000224
C -2.864618 0.454959 0.000193
C 3.207257 1.502433 0.000048
C -3.003950 -0.958300 0.000067
C 3.793437 0.206442 -0.000128
H -1.520814 2.180050 0.000325
H 1.364983 2.673203 0.000268
H -1.945150 -2.878271 -0.000164
H 3.431543 -1.964636 -0.000358
H -3.998213 -1.413098 0.000082
H 3.856702 2.384167 0.000119
H 4.884290 0.108091 -0.000193


