%chk=000185769.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185769

0 1
O -0.172230 2.308967 0.805240
O -2.330034 2.597312 -1.648937
O 3.873607 -2.188440 -0.264190
O -3.899940 1.471833 1.343585
O 5.798935 -0.110453 0.497556
O -4.631329 -2.968192 0.473167
C 0.228980 0.933103 0.488673
C -0.376019 1.834520 -0.561059
C 1.688671 0.651993 0.479528
C -1.842215 1.727541 -0.967934
C 2.125399 -0.640860 0.156951
C -2.557670 0.509341 -0.524957
C 2.613091 1.656326 0.801144
C 3.496616 -0.913236 0.139272
C 3.982966 1.389868 0.774958
C -3.515285 0.466267 0.510098
C 4.430517 0.107926 0.432263
C -2.296463 -0.676524 -1.241355
C -4.193610 -0.729130 0.823117
C -2.946690 -1.867310 -0.957918
C -3.905702 -1.875701 0.080270
C 4.584836 -2.941904 0.758150
C -3.305320 2.789741 1.233065
C 6.396459 -0.535905 -0.759395
C -4.432273 -4.216615 -0.237628
H -0.402786 0.181265 0.983740
H 0.261262 2.331808 -1.303001
H 1.422669 -1.438765 -0.080631
H 2.248432 2.651948 1.068582
H 4.713207 2.162264 1.016577
H -1.558853 -0.650926 -2.048595
H -4.930861 -0.747422 1.624092
H -2.727153 -2.761215 -1.529013
H 3.895331 -3.181063 1.572270
H 5.451536 -2.378927 1.123114
H 4.886807 -3.842426 0.213048
H -3.783156 3.315364 2.070289
H -2.216898 2.734883 1.380545
H -3.579687 3.248304 0.276158
H 6.374883 0.299459 -1.464622
H 5.876707 -1.412022 -1.163570
H 7.421497 -0.775915 -0.457114
H -4.704789 -4.101528 -1.290679
H -3.402816 -4.563882 -0.113900
H -5.137431 -4.880575 0.280842


%chk=000185769-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000185769

0 1
O -0.001714 2.150131 1.251682
O -2.360814 2.895374 -0.850530
O 4.171724 -2.352863 0.318292
O -4.601227 1.627922 1.044061
O 6.023381 -0.125498 -0.163061
O -5.100993 -2.869345 -0.238408
C 0.413313 0.823027 0.650506
C -0.338033 1.817039 -0.200641
C 1.876080 0.583806 0.464315
C -1.841221 1.815660 -0.428447
C 2.370821 -0.742284 0.487223
C -2.631996 0.588651 -0.153275
C 2.782813 1.658244 0.275053
C 3.742242 -1.005358 0.293044
C 4.151073 1.399457 0.063341
C -3.964774 0.580170 0.389566
C 4.639622 0.073697 0.042393
C -2.127299 -0.642141 -0.670625
C -4.744858 -0.596175 0.332987
C -2.895692 -1.813820 -0.733067
C -4.228650 -1.777958 -0.234182
C 5.129626 -2.674300 1.404003
C -3.853661 2.769292 1.600812
C 6.364952 -0.931859 -1.359893
C -4.613343 -4.134532 -0.798740
H -0.160197 -0.017832 1.060504
H 0.229447 2.426779 -0.916882
H 1.705861 -1.594086 0.671139
H 2.413948 2.688479 0.317442
H 4.866882 2.211905 -0.097214
H -1.121547 -0.651984 -1.105776
H -5.750630 -0.589280 0.759633
H -2.472282 -2.719059 -1.175199
H 4.643034 -2.539865 2.388369
H 6.029284 -2.036232 1.341360
H 5.393670 -3.732410 1.256651
H -4.496038 3.151879 2.408406
H -2.876054 2.447389 2.007320
H -3.692787 3.535308 0.824909
H 6.051669 -0.397403 -2.276426
H 5.881325 -1.924371 -1.321262
H 7.460600 -1.032394 -1.340449
H -4.347416 -4.023265 -1.867308
H -3.741345 -4.514963 -0.233013
H -5.455603 -4.833838 -0.696819


