%chk=000179806.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179806

0 1
O -1.636801 -0.537559 0.344187
O 1.922625 2.655079 0.498064
O -0.551644 3.425314 0.505477
O 2.757165 -2.102626 0.247923
C -2.620415 0.520791 0.650574
C -2.242871 1.835579 -0.012547
C 0.130235 1.144286 0.393432
C -0.316128 -0.199363 0.353537
C -0.820796 2.258991 0.335534
C 0.565194 -1.293967 0.299702
C 2.458710 0.301784 0.424076
C 1.526151 1.357825 0.442330
C -3.928837 -0.029511 0.136500
C 1.946353 -1.009140 0.320567
C 3.930821 0.572962 0.530226
C 0.066939 -2.697751 0.240116
C -5.118852 0.311225 0.796263
C -3.964221 -0.859081 -0.991865
C 4.681266 0.179264 -0.707543
C -6.339401 -0.173880 0.319842
C -5.187964 -1.346429 -1.459804
C 5.873771 -0.436371 -0.723495
C -6.375665 -1.002658 -0.807051
C 6.555593 -0.776540 -2.013077
C 6.626144 -0.832204 0.508195
H -2.603511 0.598629 1.763391
H -2.957344 2.636249 0.271307
H -2.323637 1.764891 -1.119185
H 4.105927 1.663506 0.717448
H 4.338097 0.067088 1.436205
H -0.933182 -2.753278 -0.213313
H 0.742736 -3.336894 -0.346888
H -0.003670 -3.132252 1.247739
H -5.097324 0.952035 1.676161
H -3.031764 -1.129733 -1.490734
H 4.174841 0.447941 -1.636139
H 2.928466 2.738020 0.500042
H -7.264368 0.092561 0.829041
H -5.214224 -1.994561 -2.334498
H 3.721874 -1.857052 0.157255
H -7.328451 -1.380583 -1.173948
H 6.634848 -1.864578 -2.146209
H 7.576569 -0.371303 -2.044409
H 6.027788 -0.383396 -2.892218
H 7.485743 -0.164611 0.668901
H 7.024730 -1.852896 0.433904
H 6.011880 -0.785400 1.418886


%chk=000179806-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179806

0 1
O -1.633006 -0.549525 -0.017520
O 1.867513 2.809811 0.608846
O -0.724670 3.527743 0.356201
O 2.913898 -1.931276 -0.118760
C -2.633305 0.422208 0.507846
C -2.356844 1.797648 -0.119813
C 0.095560 1.222114 0.241713
C -0.291217 -0.148912 0.056614
C -0.933997 2.289247 0.199236
C 0.635342 -1.207193 -0.080573
C 2.472402 0.458135 0.240821
C 1.500844 1.484022 0.361564
C -4.014786 -0.119186 0.195992
C 2.006911 -0.871451 0.000031
C 3.968696 0.713060 0.433526
C 0.168325 -2.631565 -0.286696
C -5.086575 0.151464 1.081796
C -4.267122 -0.839154 -0.997781
C 4.847622 0.099270 -0.652907
C -6.396881 -0.277322 0.773856
C -5.575350 -1.276709 -1.300921
C 6.036786 -0.561501 -0.491615
C -6.645361 -0.992977 -0.420084
C 6.813509 -1.056573 -1.700143
C 6.690061 -0.850434 0.848504
H -2.483787 0.484353 1.606855
H -3.075725 2.549831 0.246534
H -2.479360 1.725842 -1.219193
H 4.186153 1.803514 0.437747
H 4.280307 0.355464 1.434281
H -0.392725 -2.732802 -1.234213
H 1.026510 -3.319020 -0.308367
H -0.523531 -2.938502 0.518259
H -4.897711 0.697465 2.014897
H -3.433270 -1.070247 -1.668230
H 4.490091 0.275989 -1.678325
H 2.855027 2.898456 0.625164
H -7.218529 -0.061220 1.465810
H -5.760895 -1.839796 -2.222618
H 3.839273 -1.576282 -0.277577
H -7.660030 -1.331375 -0.658078
H 6.969988 -2.151877 -1.650790
H 7.820271 -0.595546 -1.731921
H 6.299021 -0.823015 -2.647502
H 7.632315 -0.275428 0.942647
H 6.965466 -1.919721 0.925636
H 6.056183 -0.596623 1.713155


