%chk=000183732.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183732

0 1
O -0.599835 1.885469 -0.536095
O -5.450064 -0.575039 0.349256
C 5.021900 -1.140279 0.197852
C 4.576411 0.127099 0.966393
C 6.267089 -1.747719 0.877905
C 5.248011 -0.846447 -1.299820
C 3.190415 0.560981 0.579320
C 6.604499 -3.139209 0.348112
C 6.396639 0.114742 -1.594492
C 2.071392 -0.074394 1.138028
C 3.003413 1.605511 -0.344589
C 0.775686 0.316961 0.790836
C 1.723183 2.012612 -0.710315
C 0.623227 1.356843 -0.131129
C -1.764813 1.148275 -0.275752
C -2.766337 1.830320 0.438209
C -1.953873 -0.129618 -0.804882
C -4.192781 -0.086354 0.086561
C -5.797756 -1.900224 -0.163437
C -7.240551 -2.072615 0.310430
C -3.994381 1.210029 0.617001
C -3.187859 -0.761678 -0.618873
C -7.801052 -3.419524 -0.127740
H 4.192382 -1.889712 0.265124
H 5.306219 0.943187 0.791900
H 4.615207 -0.064267 2.058208
H 6.099247 -1.805441 1.971501
H 7.135849 -1.074589 0.743002
H 4.308610 -0.438808 -1.726553
H 5.426494 -1.803739 -1.828593
H 5.768470 -3.835617 0.477029
H 7.468786 -3.562046 0.872235
H 6.849297 -3.114498 -0.720493
H 6.259138 1.076086 -1.086498
H 7.358696 -0.295667 -1.265962
H 6.474389 0.317074 -2.668384
H 2.208867 -0.883240 1.855099
H 3.869348 2.100403 -0.784318
H -0.087904 -0.169463 1.236717
H 1.559072 2.818172 -1.422015
H -2.567789 2.828444 0.827570
H -1.153424 -0.621001 -1.356377
H -5.110798 -2.640442 0.278336
H -5.706600 -1.889119 -1.261977
H -7.861948 -1.241795 -0.083298
H -7.283268 -1.969701 1.414453
H -4.806803 1.694767 1.155531
H -3.346627 -1.754947 -1.025588
H -7.805909 -3.525503 -1.219150
H -8.837219 -3.540816 0.213044
H -7.225447 -4.256567 0.284977


%chk=000183732-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000183732

0 1
O -0.631157 2.164927 -0.024028
O -5.583456 -0.508461 0.297735
C 5.037565 -1.208293 0.260874
C 4.710883 0.167758 0.927667
C 6.399169 -1.732804 0.792120
C 4.956856 -1.151703 -1.291984
C 3.297450 0.670970 0.674418
C 6.787360 -3.137897 0.282573
C 6.039152 -0.289929 -1.983068
C 2.185266 0.061001 1.312831
C 3.040757 1.756983 -0.201626
C 0.864792 0.505121 1.089360
C 1.728317 2.215544 -0.443191
C 0.642825 1.585270 0.202356
C -1.817039 1.390452 0.088771
C -2.938136 2.038859 0.656165
C -1.934376 0.084483 -0.432442
C -4.303138 0.060080 0.193709
C -5.779486 -1.866838 -0.238797
C -7.248927 -2.231144 -0.013650
C -4.177633 1.376651 0.705519
C -3.177267 -0.586567 -0.376284
C -7.571746 -3.649654 -0.532213
H 4.254244 -1.924586 0.594682
H 5.445309 0.920649 0.581429
H 4.871992 0.055503 2.019341
H 6.354154 -1.751728 1.900701
H 7.199961 -1.010665 0.532816
H 3.956211 -0.769917 -1.574336
H 5.014428 -2.184166 -1.689541
H 5.992319 -3.874998 0.505409
H 7.718076 -3.490681 0.764110
H 6.954466 -3.145240 -0.809828
H 6.009438 0.760913 -1.640633
H 7.056910 -0.676787 -1.791325
H 5.886719 -0.283640 -3.078018
H 2.354867 -0.767531 2.012147
H 3.880898 2.253492 -0.702270
H 0.024478 0.034291 1.609098
H 1.529014 3.056436 -1.114276
H -2.823666 3.055307 1.043843
H -1.068669 -0.405711 -0.888953
H -5.109023 -2.578067 0.289309
H -5.528910 -1.882070 -1.320915
H -7.883332 -1.482586 -0.523635
H -7.471925 -2.157889 1.067077
H -5.059952 1.858180 1.137316
H -3.252082 -1.597857 -0.786088
H -7.377360 -3.737088 -1.617823
H -8.634686 -3.895429 -0.361763
H -6.963010 -4.416047 -0.016389


