%chk=000180395.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180395

0 1
O -0.916679 1.825880 -0.553279
O -4.088661 -0.191592 0.867389
C 5.258806 0.098905 -0.197751
C 4.737974 1.536511 -0.433612
C 6.748582 0.118227 0.208074
C 5.000522 -0.783289 -1.435985
C 3.236612 1.607676 -0.427026
C 7.681492 0.735001 -0.830782
C 5.212899 -2.268820 -1.154677
C 2.530883 1.542605 0.781114
C 2.524621 1.742894 -1.634631
C 1.133506 1.609996 0.806295
C 1.136483 1.812305 -1.638561
C 0.451497 1.743686 -0.407914
C -1.742962 1.765121 0.651116
C -3.163656 1.814147 0.097057
C -3.654615 0.448452 -0.373554
C -4.562857 -1.485469 0.799783
C -4.994185 -1.994797 2.055158
C -4.629094 -2.250492 -0.367035
C -5.490228 -3.297425 2.093366
C -4.905477 -1.160242 3.288543
C -5.133592 -3.556097 -0.289349
C -5.561558 -4.078029 0.928844
H 4.687973 -0.337571 0.661061
H 5.145389 1.928582 -1.386469
H 5.144997 2.209613 0.348793
H 7.071267 -0.922265 0.415940
H 6.855849 0.660663 1.167789
H 5.652847 -0.461906 -2.270533
H 3.960028 -0.623254 -1.785176
H 7.474149 1.799520 -0.983692
H 8.728899 0.645625 -0.522060
H 7.581244 0.237573 -1.803308
H 4.556306 -2.625513 -0.352964
H 6.245635 -2.479902 -0.854131
H 5.000037 -2.872123 -2.044206
H 3.073294 1.437203 1.720419
H 3.066564 1.794043 -2.578828
H 0.609228 1.555890 1.753404
H 0.571248 1.917453 -2.560815
H -1.504290 2.640290 1.278328
H -1.528194 0.826313 1.191444
H -3.203177 2.532985 -0.750765
H -3.852475 2.206047 0.876482
H -4.523956 0.522271 -1.048211
H -2.853330 -0.156987 -0.832851
H -4.297899 -1.860913 -1.323180
H -5.827778 -3.716745 3.040665
H -5.796955 -1.264209 3.919802
H -4.796332 -0.090993 3.047705
H -4.032003 -1.444704 3.892299
H -5.187841 -4.160973 -1.193384
H -5.952235 -5.090864 0.984361


%chk=000180395-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180395

0 1
O -1.193812 1.971484 -0.638683
O -3.887270 -0.048103 0.879057
C 5.060203 0.075236 -0.007573
C 4.564618 1.449073 -0.568844
C 6.577435 0.124384 0.334103
C 4.675919 -1.087889 -0.960782
C 3.050190 1.604257 -0.569955
C 7.525196 0.324563 -0.870857
C 5.012291 -2.494038 -0.417987
C 2.345426 1.844554 0.635497
C 2.289765 1.499354 -1.765536
C 0.938391 1.972719 0.665475
C 0.886751 1.623078 -1.760108
C 0.204959 1.858148 -0.541618
C -1.952880 2.202720 0.604754
C -3.432788 2.224211 0.215599
C -3.940184 0.866908 -0.277085
C -4.282542 -1.385303 0.683116
C -4.192772 -2.215982 1.839705
C -4.743023 -1.896627 -0.553640
C -4.580393 -3.568122 1.710323
C -3.692516 -1.643848 3.150396
C -5.122923 -3.255592 -0.648898
C -5.044174 -4.096301 0.480584
H 4.522990 -0.095789 0.951665
H 4.951861 1.578975 -1.598199
H 5.019111 2.252930 0.045718
H 6.858928 -0.808041 0.862017
H 6.742075 0.947427 1.060129
H 5.175277 -0.939622 -1.940462
H 3.587857 -1.028545 -1.158705
H 7.310920 1.266775 -1.407598
H 8.577733 0.366703 -0.534788
H 7.442731 -0.504062 -1.598032
H 4.549136 -2.656752 0.574055
H 6.102190 -2.644105 -0.308928
H 4.634424 -3.280420 -1.097248
H 2.905808 1.941616 1.574208
H 2.806643 1.320405 -2.716329
H 0.434871 2.163312 1.617786
H 0.303306 1.543241 -2.682756
H -1.648527 3.171196 1.051149
H -1.753638 1.386531 1.326667
H -3.585396 2.973935 -0.583382
H -4.029589 2.537072 1.092912
H -4.984788 0.945326 -0.640661
H -3.295197 0.483415 -1.091532
H -4.806873 -1.256693 -1.438312
H -4.515978 -4.217952 2.591553
H -3.698225 -2.410728 3.943677
H -4.316462 -0.792271 3.478971
H -2.662521 -1.254092 3.047849
H -5.478015 -3.649397 -1.607847
H -5.337715 -5.148971 0.409880


