%chk=000264210.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000264210

0 1
O -2.736688 -2.023138 -0.666476
O -0.197572 0.498253 -0.798862
O 0.819666 -2.757349 0.078222
O -6.297344 -0.983383 -0.735214
O 0.067030 1.554099 -2.860773
O 1.696123 -2.106014 -1.988042
O -5.904692 1.623933 3.153435
N -4.172642 -0.154450 -0.088478
N -3.365405 0.557896 0.775780
N -6.091752 0.322665 1.207756
C -1.035873 -0.520463 -1.480727
C -1.323453 -1.621850 -0.431406
C -2.427532 0.017724 -1.918789
C -3.467116 -0.866600 -1.190755
C -0.515381 -2.921324 -0.547860
C -5.580451 -0.327917 0.067155
C 0.345651 1.486828 -1.637035
C 1.246070 2.412730 -0.900870
C -3.916592 1.139177 1.828052
C 1.865971 -2.339704 -0.765026
C -5.355662 1.079788 2.158423
C 3.156197 -2.229953 -0.036433
C 1.530877 2.258127 0.479730
C 1.837642 3.485282 -1.619366
C 2.393683 3.167006 1.126086
C 2.696223 4.386347 -0.964848
C 2.988913 4.244769 0.419786
C 4.299657 -1.797092 -0.759027
C 3.279820 -2.544501 1.340872
C 5.543210 -1.685122 -0.112310
C 4.531813 -2.429960 1.979001
C 5.682739 -2.000997 1.267395
C 3.910731 5.227292 1.117991
C 7.031316 -1.884177 1.953006
H -0.458475 -0.898543 -2.339842
H -1.212137 -1.193383 0.582953
H -2.533362 1.080734 -1.655519
H -2.548059 -0.077564 -3.008446
H -4.266311 -1.263437 -1.832990
H -1.005987 -3.711886 0.040766
H -0.402506 -3.235002 -1.599722
H -7.102866 0.231061 1.357215
H -3.252639 1.699360 2.489929
H 1.078514 1.428598 1.030314
H 1.611015 3.589011 -2.685735
H 2.611520 3.039492 2.192911
H 3.148459 5.211181 -1.528676
H 4.188156 -1.554651 -1.821009
H 2.398217 -2.877966 1.895065
H 6.420261 -1.349536 -0.678677
H 4.620715 -2.678260 3.043083
H 4.096444 4.936696 2.165795
H 3.477600 6.245607 1.121900
H 4.887856 5.294675 0.604472
H 7.771484 -2.567072 1.494831
H 6.965005 -2.129857 3.026317
H 7.438921 -0.859879 1.862871


%chk=000264210-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000264210

0 1
O -2.817399 -1.896219 -0.656528
O -0.101655 0.522553 -0.717936
O 0.750146 -2.523708 0.183966
O -6.400451 -1.021271 -1.290236
O 0.001913 1.679608 -2.740089
O 1.594025 -1.987650 -1.928854
O -6.956182 0.700619 3.039604
N -4.511895 -0.266193 -0.083253
N -3.940786 0.272166 1.051821
N -6.671147 -0.154543 0.871686
C -1.139053 -0.346385 -1.316124
C -1.434526 -1.478073 -0.309477
C -2.504322 0.368442 -1.488123
C -3.554926 -0.711207 -1.130971
C -0.585746 -2.750280 -0.418472
C -5.904442 -0.526230 -0.249616
C 0.443716 1.494083 -1.579378
C 1.555590 2.244142 -0.940175
C -4.723162 0.589969 2.069151
C 1.775779 -2.125782 -0.693813
C -6.189397 0.405402 2.085145
C 3.061039 -1.907226 0.019858
C 2.039152 1.925774 0.354502
C 2.153165 3.308857 -1.665736
C 3.101312 2.666820 0.910727
C 3.211249 4.042717 -1.100605
C 3.703053 3.736970 0.198493
C 4.192260 -1.512087 -0.741943
C 3.188820 -2.072888 1.422413
C 5.427440 -1.288175 -0.108371
C 4.431861 -1.844672 2.047868
C 5.570509 -1.450923 1.297091
C 4.836866 4.543234 0.804291
C 6.910915 -1.215081 1.968195
H -0.757229 -0.736896 -2.274614
H -1.398911 -1.075108 0.721791
H -2.558448 1.208188 -0.775771
H -2.637789 0.754648 -2.508310
H -4.179839 -1.040355 -1.973942
H -1.037800 -3.552449 0.185339
H -0.478534 -3.069201 -1.469212
H -7.681600 -0.315979 0.793870
H -4.242705 1.017776 2.951682
H 1.586087 1.099301 0.908820
H 1.774395 3.538226 -2.667315
H 3.473241 2.408798 1.909149
H 3.666271 4.863105 -1.668594
H 4.077968 -1.384795 -1.823512
H 2.316986 -2.380095 2.006577
H 6.294806 -0.981968 -0.705486
H 4.523685 -1.977093 3.132353
H 5.190895 4.099287 1.750064
H 4.515712 5.580360 1.019628
H 5.697495 4.609275 0.113358
H 7.664214 -1.946886 1.619641
H 6.838557 -1.304214 3.065352
H 7.305825 -0.209391 1.732218


