%chk=000188571.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188571

0 1
O -0.905677 -0.295242 -2.260063
O -0.562972 -1.819278 2.202253
N -1.590799 0.867621 -0.424080
N 0.038641 -2.087339 0.007266
C 1.430753 -0.061398 0.182133
C -1.741672 0.966751 1.055903
C -2.814517 1.381207 -1.109835
C -3.249472 1.137068 1.318973
C -3.912412 1.464368 -0.033634
C 2.497318 -0.735963 1.000661
C 1.669446 1.397096 -0.104904
C 3.901022 -0.474224 0.434819
C 3.076635 1.635293 -0.672945
C 4.155630 1.023881 0.228762
C 0.315854 -0.694054 -0.236920
C -0.772559 -0.060104 -1.066526
C -0.414793 -2.555883 1.240094
H -1.166695 1.848733 1.407975
H -1.327420 0.070664 1.577752
H -3.094612 0.718216 -1.957433
H -2.582263 2.378854 -1.538177
H -3.433280 1.934541 2.057819
H -3.674922 0.212256 1.747981
H -4.729471 0.754470 -0.249242
H -4.369048 2.468395 -0.017130
H 2.426267 -0.357506 2.044439
H 2.329597 -1.828486 1.077642
H 0.917728 1.813311 -0.807620
H 1.538808 1.968408 0.839258
H 4.016211 -1.009352 -0.528546
H 4.661242 -0.899954 1.116249
H 3.249425 2.721003 -0.794613
H 3.142307 1.198297 -1.689535
H 4.171631 1.543127 1.206071
H 5.155603 1.180407 -0.217361
H 0.084011 -2.683754 -0.818242
H -0.607945 -3.640930 1.265857


%chk=000188571-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000188571

0 1
O -1.159267 -0.840084 -2.125832
O 0.243018 -2.483475 2.308679
N -1.708613 0.644985 -0.427408
N 0.132978 -2.296402 -0.039898
C 1.345456 -0.160828 0.273746
C -1.726961 1.088765 0.995675
C -2.914155 1.116113 -1.170691
C -3.209563 1.463183 1.223009
C -3.640513 2.030877 -0.155291
C 2.529475 -0.833626 0.947705
C 1.458431 1.350029 0.119324
C 3.891194 -0.361892 0.367449
C 2.825495 1.775436 -0.482566
C 4.000880 1.177568 0.320419
C 0.259449 -0.862484 -0.172880
C -0.903152 -0.324311 -0.979526
C 0.070673 -2.984505 1.162482
H -1.078137 1.975390 1.136089
H -1.360731 0.286453 1.657876
H -3.523050 0.240553 -1.466154
H -2.618132 1.633548 -2.099632
H -3.335391 2.185916 2.046716
H -3.796351 0.558034 1.464793
H -4.733489 2.021504 -0.301344
H -3.292264 3.075097 -0.260575
H 2.490753 -0.602180 2.032588
H 2.450633 -1.930053 0.869109
H 0.636260 1.750493 -0.499287
H 1.369833 1.815189 1.125741
H 4.006353 -0.763293 -0.659707
H 4.710475 -0.791852 0.974962
H 2.886912 2.880718 -0.500593
H 2.885384 1.428945 -1.533771
H 3.985738 1.582935 1.353654
H 4.966110 1.479770 -0.129569
H -0.175836 -2.779101 -0.892376
H -0.142298 -4.066917 1.002184


