%chk=000211300.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211300

0 1
O 1.093648 1.937012 -2.407494
O 2.361024 -0.162729 0.158168
N -3.993054 0.255687 -0.445090
N -0.951707 2.483367 -0.373458
C -5.393297 0.534881 -0.908524
C -3.535108 -1.096268 -0.909824
C -6.350651 -0.530062 -0.346909
C -4.463131 -2.185116 -0.346320
C -5.917472 -1.939967 -0.767075
C -3.054941 1.327215 -0.916060
C -1.881038 1.399414 0.086242
C 0.473509 2.167519 -0.041016
C 1.021954 1.244842 -1.148375
C -1.347194 3.806608 0.192890
C 2.483845 0.837054 -0.893575
C 3.511161 -0.809581 0.569365
C 3.272754 -1.796059 1.564296
C 4.793220 -0.544355 0.084126
C 4.370949 -2.502590 2.054180
C 1.892908 -2.053065 2.069266
C 5.872203 -1.275450 0.600245
C 5.665990 -2.246423 1.577405
H -5.479479 0.574002 -2.015558
H -5.685757 1.534534 -0.520329
H -2.502485 -1.254396 -0.529824
H -3.488256 -1.175554 -2.017477
H -6.365687 -0.460868 0.759521
H -7.380174 -0.322063 -0.688973
H -4.122115 -3.178648 -0.688251
H -4.392372 -2.190790 0.759921
H -6.580351 -2.695598 -0.307072
H -6.023833 -2.061936 -1.861397
H -2.668576 1.163427 -1.944336
H -3.581543 2.305009 -0.937913
H -2.272320 1.557765 1.114089
H -1.352449 0.422238 0.112171
H 0.614729 1.682948 0.949581
H 1.070164 3.105460 -0.018184
H 0.380086 0.344799 -1.289659
H -0.731697 4.595364 -0.268826
H -1.253831 3.886443 1.286239
H -2.396094 4.014463 -0.075264
H 3.111220 1.668292 -0.535565
H 2.928889 0.382742 -1.797147
H 0.266352 2.461816 -2.536617
H 4.970286 0.207588 -0.677431
H 4.222302 -3.265355 2.817952
H 1.704037 -3.122877 2.224398
H 1.128627 -1.683523 1.367500
H 1.724111 -1.541075 3.027397
H 6.876659 -1.076956 0.228887
H 6.505884 -2.810888 1.974700


%chk=000211300-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000211300

0 1
O 0.577890 1.234888 -2.086350
O 2.684720 -0.454396 0.413032
N -4.420004 0.402091 -0.688811
N -0.973690 1.937810 -0.038873
C -5.627398 0.958970 -1.354914
C -4.217356 -1.024622 -1.056588
C -6.893065 0.167463 -0.967787
C -5.438758 -1.880737 -0.663706
C -6.727811 -1.329790 -1.313651
C -3.217879 1.235196 -0.930260
C -2.106016 0.978002 0.111653
C 0.348323 1.361096 0.343105
C 0.873832 0.513475 -0.849915
C -1.242106 3.249763 0.594241
C 2.388806 0.303478 -0.813872
C 4.028887 -0.782913 0.673197
C 4.249088 -1.512445 1.879091
C 5.102770 -0.427957 -0.177590
C 5.577874 -1.871208 2.197276
C 3.080611 -1.876844 2.772151
C 6.421188 -0.803163 0.170686
C 6.664755 -1.525190 1.357376
H -5.516637 0.944951 -2.472518
H -5.734148 2.016857 -1.048582
H -3.318027 -1.405659 -0.540201
H -4.034373 -1.127294 -2.160136
H -7.062427 0.278743 0.120773
H -7.769214 0.596673 -1.491100
H -5.263890 -2.930197 -0.969945
H -5.544151 -1.864997 0.438371
H -7.610043 -1.906531 -0.977115
H -6.664234 -1.447984 -2.415476
H -2.790963 1.085638 -1.954573
H -3.530112 2.294783 -0.865134
H -2.552668 1.029269 1.130602
H -1.703628 -0.042329 -0.017552
H 0.312184 0.754682 1.272370
H 1.045842 2.203025 0.509684
H 0.377159 -0.481499 -0.853946
H -0.435082 3.958605 0.340307
H -1.319070 3.183626 1.704873
H -2.190365 3.666180 0.213467
H 2.908834 1.282746 -0.802361
H 2.710199 -0.265283 -1.708275
H -0.227845 1.790883 -1.820365
H 4.928039 0.131674 -1.101143
H 5.761718 -2.432316 3.121599
H 3.422042 -2.435043 3.660574
H 2.341578 -2.495670 2.230419
H 2.540661 -0.973078 3.111158
H 7.251213 -0.528139 -0.489692
H 7.684646 -1.816986 1.629422


