%chk=000186824.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186824

0 1
O 0.778469 -0.945655 1.363928
O 0.892430 2.151000 -0.474747
C 0.538906 -0.200478 0.140121
C 1.211180 1.168015 0.513108
C 1.235830 -0.862320 -1.062068
C 2.728789 1.026742 0.681711
C 2.746043 -0.994798 -0.833001
C 3.390538 0.364630 -0.531859
C -0.959396 -0.013452 -0.055373
C -1.530289 0.131309 -1.326056
C -1.785187 0.054557 1.079028
C 0.356302 -2.321869 1.376725
C -2.909587 0.322413 -1.461959
C -3.161331 0.243350 0.942174
C -3.727699 0.375326 -0.330582
H 0.732473 1.585342 1.429511
H 1.043125 -0.264639 -1.974886
H 0.791539 -1.856029 -1.257991
H 2.921919 0.419597 1.591625
H 3.171559 2.023810 0.865074
H 3.222467 -1.456786 -1.716767
H 2.927995 -1.682649 0.018552
H 4.472947 0.234192 -0.341165
H 3.319036 1.027718 -1.414770
H 1.341722 1.953433 -1.321048
H -0.905496 0.109609 -2.217449
H -1.337827 -0.042348 2.070469
H 0.456310 -2.586953 2.436370
H 1.029078 -2.925157 0.761051
H -0.681472 -2.424537 1.046313
H -3.344050 0.435744 -2.453331
H -3.793230 0.294038 1.826832
H -4.799893 0.524942 -0.437739


%chk=000186824-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000186824

0 1
O 0.815282 -1.006281 1.344296
O 0.925176 2.192138 -0.539004
C 0.546768 -0.194425 0.117786
C 1.208763 1.181122 0.496199
C 1.277029 -0.798707 -1.109210
C 2.724126 1.027071 0.743456
C 2.792931 -0.964715 -0.850653
C 3.448429 0.382970 -0.465120
C -0.968955 -0.024550 -0.064584
C -1.606725 -0.056283 -1.328383
C -1.767152 0.204983 1.087813
C 0.314481 -2.382618 1.313051
C -3.002933 0.138019 -1.440844
C -3.159866 0.398329 0.980606
C -3.785754 0.367661 -0.288036
H 0.704892 1.566861 1.397971
H 1.127446 -0.125660 -1.977483
H 0.821159 -1.767263 -1.388659
H 2.862648 0.386084 1.632107
H 3.148940 2.023370 0.970361
H 3.280212 -1.389300 -1.749358
H 2.944019 -1.683293 -0.022334
H 4.517448 0.236801 -0.221607
H 3.432551 1.067527 -1.342810
H 1.593172 2.099477 -1.264531
H -1.022525 -0.224689 -2.238477
H -1.283494 0.212617 2.071557
H 0.511082 -2.787072 2.319272
H 0.848494 -3.001815 0.563807
H -0.773013 -2.419585 1.106259
H -3.476975 0.114303 -2.428906
H -3.757006 0.574487 1.882724
H -4.867451 0.520535 -0.375464


