%chk=000193101.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193101

0 1
O 0.595762 2.145968 -1.155171
O -2.343987 -0.155657 0.750926
O 1.484596 -0.762559 -0.266290
O 2.559718 2.997177 -0.519849
O -3.140563 -3.522724 0.041535
O 3.058155 -1.635535 1.092088
C 0.027607 0.820277 0.789712
C -0.453133 1.264544 -0.624313
C 0.506024 -0.642123 0.822726
C 1.095246 1.879143 1.159295
C -0.522526 -1.730075 0.466805
C -1.750420 2.085159 -0.629981
C -1.952826 -1.574232 0.984969
C -2.997566 1.285350 -1.068129
C 1.566052 2.409008 -0.192769
C -3.006863 -0.087058 -0.462386
C 2.243675 1.450422 2.051175
C -2.934598 -2.340741 0.009774
C -2.177882 -1.851286 2.445407
C -3.428051 -1.298738 -0.899525
C -4.286323 2.027207 -0.709630
C 2.752616 -1.246644 -0.009025
C 3.559997 -1.140040 -1.294798
C 4.461386 0.088973 -1.180026
C 4.348488 -2.432019 -1.492971
H -0.814538 0.897988 1.528311
H -0.466964 0.426585 -1.352885
H 1.007250 -0.871935 1.792023
H 0.567388 2.733704 1.665953
H -0.536348 -1.818220 -0.646398
H -0.127809 -2.712211 0.813020
H -1.614889 2.947843 -1.320090
H -1.925858 2.535561 0.366797
H -2.956583 1.154471 -2.185615
H 2.855570 0.647614 1.617449
H 2.929748 2.291500 2.234638
H 1.888922 1.096274 3.026644
H -2.189531 -2.935426 2.642412
H -1.401748 -1.405089 3.079752
H -3.143992 -1.449540 2.785957
H -4.021457 -1.534464 -1.763251
H -4.397202 2.155666 0.374999
H -4.309226 3.026516 -1.162226
H -5.173374 1.486994 -1.065780
H 2.852843 -0.994450 -2.155156
H 5.074691 0.209799 -2.081914
H 5.149155 0.021223 -0.327951
H 3.880032 1.018599 -1.068629
H 4.996781 -2.364498 -2.375316
H 3.689179 -3.296492 -1.634174
H 4.994376 -2.649608 -0.630120


%chk=000193101-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000193101

0 1
O 0.404533 2.304899 -1.323937
O -2.434075 -0.177829 0.791373
O 1.624871 -0.532378 -0.301478
O 2.527318 3.106350 -0.829947
O -2.911210 -3.592076 -0.269209
O 2.721671 -2.136248 0.986710
C 0.006942 0.990197 0.704051
C -0.627195 1.433361 -0.664267
C 0.514310 -0.468098 0.712904
C 1.104894 2.065993 0.955647
C -0.483068 -1.574803 0.265850
C -1.969746 2.205577 -0.562242
C -1.920653 -1.596452 0.876871
C -3.254178 1.367161 -0.903868
C 1.487837 2.542896 -0.451554
C -3.114542 -0.057010 -0.425411
C 2.306079 1.725124 1.852543
C -2.829745 -2.338369 -0.164630
C -2.028020 -2.104127 2.307942
C -3.417961 -1.276154 -0.993518
C -4.521824 2.053894 -0.324861
C 2.680450 -1.429051 -0.046007
C 3.722447 -1.364401 -1.156920
C 4.684723 -0.168994 -0.888258
C 4.486604 -2.701411 -1.260648
H -0.760264 1.051998 1.488658
H -0.730113 0.580905 -1.357807
H 0.945937 -0.715988 1.700674
H 0.591751 2.944251 1.406229
H -0.575438 -1.498734 -0.833471
H -0.019819 -2.556810 0.472465
H -1.930647 3.054963 -1.268748
H -2.078997 2.631231 0.453196
H -3.360422 1.318573 -2.004871
H 2.849566 0.836079 1.498256
H 3.015255 2.571139 1.849048
H 1.985031 1.545298 2.894061
H -1.834469 -3.191187 2.311283
H -1.299040 -1.612613 2.975117
H -3.042844 -1.935502 2.705585
H -3.968735 -1.440128 -1.917801
H -4.485834 2.069896 0.778943
H -4.585047 3.096655 -0.684459
H -5.440068 1.524913 -0.633925
H 3.182917 -1.156463 -2.099720
H 5.436034 -0.118504 -1.696184
H 5.220967 -0.306970 0.068653
H 4.145601 0.793626 -0.863115
H 5.250599 -2.636217 -2.055551
H 3.808969 -3.540423 -1.499026
H 4.989651 -2.935839 -0.306628


