%chk=000193005.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193005

0 1
O 0.747977 -1.346416 -1.057571
O 0.794283 0.947272 -0.821245
O -2.713399 -1.905207 -1.548406
O -1.223066 2.724876 -0.550181
O -1.580730 -1.445543 1.661524
O -2.968691 1.317747 1.220545
C -0.528043 -0.894567 -1.538110
C -0.431390 0.643379 -1.517144
C 1.482893 -0.271294 -0.413291
C -1.631309 -1.556020 -0.682581
C -1.564471 1.356012 -0.759467
C -2.184310 -0.785795 0.534655
C -1.819481 0.708234 0.615949
C 2.881017 -0.267812 -1.029615
C 1.419036 -0.449055 1.099374
C 3.828247 0.658216 -0.260101
C 2.396755 0.485215 1.815973
C 3.815139 0.355960 1.244039
H -0.589365 -1.306195 -2.575314
H -0.299480 1.083328 -2.531266
H -1.254553 -2.559372 -0.331491
H -2.500611 1.417093 -1.361170
H -3.295668 -0.908212 0.591098
H -0.936068 0.854441 1.290654
H 2.817536 0.040371 -2.091526
H 3.264694 -1.308751 -1.036527
H 1.642690 -1.510892 1.335795
H 0.380125 -0.292876 1.467085
H 3.531600 1.712586 -0.433344
H 4.854373 0.556544 -0.660705
H 2.401402 0.259368 2.899122
H 2.048397 1.532624 1.719074
H 4.205033 -0.663583 1.428473
H 4.499661 1.045143 1.772934
H -3.196864 -1.114045 -1.861606
H -0.273302 2.796805 -0.261832
H -2.090760 -1.242447 2.477962
H -2.893398 2.302170 1.156437


%chk=000193005-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000193005

0 1
O 0.468159 -1.178755 0.035086
O 0.897968 1.093989 -0.362034
O -2.136041 -2.057320 -2.217280
O -1.039337 2.465428 0.718107
O -3.788053 -1.613912 0.386638
O -3.423495 0.957206 1.380827
C -0.417254 -0.789619 -1.096112
C -0.401029 0.771839 -1.017709
C 1.549857 -0.194492 0.084638
C -1.747817 -1.543626 -0.895971
C -1.545897 1.405810 -0.156070
C -2.867128 -0.690688 -0.278606
C -2.286542 0.350539 0.681177
C 2.696411 -0.532321 -0.886578
C 2.020838 -0.045170 1.534273
C 3.852492 0.490087 -0.767248
C 3.185495 0.968734 1.647311
C 4.348406 0.600784 0.694355
H 0.016326 -1.126509 -2.056083
H -0.379962 1.225517 -2.021649
H -1.548084 -2.377615 -0.193036
H -2.284117 1.886163 -0.826209
H -3.403247 -0.151013 -1.091622
H -1.591331 -0.119232 1.407940
H 2.312457 -0.567735 -1.922702
H 3.059691 -1.546751 -0.630137
H 2.352584 -1.042476 1.882012
H 1.160463 0.253807 2.160543
H 3.493222 1.479814 -1.110031
H 4.680906 0.191137 -1.436683
H 3.539112 1.005733 2.694721
H 2.814437 1.981403 1.393642
H 4.789828 -0.367656 1.009039
H 5.150835 1.359119 0.767252
H -2.973097 -2.575444 -2.105617
H -0.054792 2.299918 0.792754
H -4.379757 -1.065366 0.965802
H -3.086610 1.767974 1.843461


