%chk=000287674.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287674

0 1
O -2.918252 -1.664418 -1.050646
O -3.735799 2.501776 0.466033
O -2.525213 0.943659 1.563797
O 0.984931 -3.783141 0.901299
O 0.474177 -1.946226 2.070767
O 5.522291 0.328761 0.398203
C 0.070359 0.140248 -1.145860
C -0.828211 -0.763958 -0.264741
C -2.874713 0.735102 -0.871572
C -0.489243 1.577789 -1.179722
C -1.921744 1.609935 -1.713794
C -2.269981 -0.690160 -0.756738
C -0.336621 -2.216382 -0.242886
C 1.504893 0.171034 -0.669553
C -4.261080 0.655172 -1.510945
C -2.996017 1.345172 0.525428
C 2.542653 0.033086 -1.611313
C 1.825119 0.366765 0.679997
C 0.376756 -2.551298 1.029444
C 3.874189 0.090677 -1.218625
C 3.155833 0.427889 1.102921
C 4.168323 0.290298 0.146494
C -3.936135 3.205908 1.723412
C 5.949200 0.514299 1.769340
H 0.043549 -0.270784 -2.188820
H -0.832765 -0.360637 0.796384
H 0.163175 2.211769 -1.812844
H -0.438241 2.028782 -0.168370
H -2.301268 2.652817 -1.731430
H -1.947594 1.267352 -2.767762
H -1.196728 -2.925748 -0.372031
H 0.323919 -2.438783 -1.111245
H -4.920454 -0.025706 -0.952628
H -4.746493 1.639322 -1.547559
H -4.209256 0.259328 -2.533373
H 2.304959 -0.120657 -2.664154
H 1.028602 0.452977 1.426029
H 4.687678 -0.015278 -1.932096
H 3.378989 0.571368 2.155075
H -2.969112 3.533445 2.117196
H -4.441571 2.547779 2.437773
H -4.566952 4.049073 1.423460
H 1.469451 -4.058368 1.723563
H 7.042159 0.495373 1.668237
H 5.598719 -0.313598 2.392434
H 5.606719 1.482185 2.146117


%chk=000287674-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000287674

0 1
O -2.920183 -1.723939 -1.256442
O -3.405763 2.608340 0.508350
O -3.060994 0.576749 1.580065
O 0.959552 -3.851652 0.940753
O 0.226992 -2.004408 2.134595
O 5.614091 0.371351 0.409212
C 0.056686 0.160528 -1.162189
C -0.861059 -0.790149 -0.303620
C -2.941039 0.698848 -0.907993
C -0.538070 1.595528 -1.202237
C -1.980677 1.606631 -1.745132
C -2.300996 -0.714037 -0.833472
C -0.349173 -2.243639 -0.268989
C 1.510132 0.174489 -0.691743
C -4.347800 0.639497 -1.559545
C -3.112037 1.243750 0.521469
C 2.564797 -0.025683 -1.622636
C 1.858547 0.444015 0.653890
C 0.283090 -2.627374 1.050751
C 3.914670 0.045906 -1.232179
C 3.206951 0.519286 1.067493
C 4.240864 0.321678 0.118656
C -3.682609 3.216289 1.834485
C 6.001541 0.649068 1.793861
H 0.043061 -0.231242 -2.202403
H -0.888990 -0.399333 0.734686
H 0.105426 2.233993 -1.836192
H -0.509206 2.035848 -0.185134
H -2.388330 2.632428 -1.753695
H -1.990143 1.234405 -2.789451
H -1.198197 -2.934201 -0.451598
H 0.380253 -2.447118 -1.073086
H -5.033906 0.007738 -0.970892
H -4.767383 1.656347 -1.641221
H -4.272829 0.192728 -2.565342
H 2.324115 -0.239082 -2.671771
H 1.074672 0.575070 1.408251
H 4.727666 -0.109699 -1.947842
H 3.433522 0.719014 2.118994
H -2.814015 3.088484 2.501657
H -4.564011 2.738370 2.293622
H -3.870158 4.277705 1.621340
H 1.341811 -4.089385 1.828788
H 7.101413 0.639775 1.791753
H 5.623323 -0.130834 2.483346
H 5.637597 1.641914 2.123484


