%chk=000191846.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191846

0 1
O -3.489170 4.356924 -0.627809
O 7.644341 -0.111102 -1.860932
O 6.891348 1.132324 -0.162203
N -3.918605 -0.649169 -0.172322
C -0.448313 -1.346235 1.015467
C -1.858118 -1.351670 0.546623
C 0.525659 -1.147492 -0.159744
C 1.924817 -0.756594 0.327975
C -2.636520 -0.227560 0.262481
C -2.665565 -2.515633 0.282388
C 2.933202 -0.720643 -0.827681
C -3.952315 -2.050012 -0.157727
C 4.309235 -0.247876 -0.344726
C -1.145054 3.948840 -1.120632
C -2.330510 3.596391 -0.204310
C 0.147434 3.211005 -0.760141
C -2.260640 1.171673 0.371854
C 0.723144 3.633510 0.597535
C -2.437144 -3.902572 0.372136
C -2.785777 2.169778 -0.347879
C -4.993800 -2.939857 -0.496128
C 5.326119 -0.234025 -1.491383
C 2.028095 2.886966 0.906702
C -3.460455 -4.771399 0.037530
C -4.727466 -4.292435 -0.391848
C 2.600790 3.281861 2.264618
C 6.629550 0.356537 -1.049626
H -0.304755 -0.545966 1.771903
H -0.214701 -2.293680 1.543247
H 0.566947 -2.075884 -0.761521
H 0.132643 -0.369364 -0.843942
H 1.881291 0.246668 0.818876
H 2.268742 -1.461447 1.108570
H 2.561887 -0.053351 -1.629866
H 3.014387 -1.725863 -1.285753
H -4.678592 -0.040337 -0.405304
H 4.233847 0.766919 0.100829
H 4.673380 -0.902481 0.472515
H -0.976397 5.042540 -1.095336
H -1.422877 3.718051 -2.169884
H -2.120355 3.867418 0.855549
H 0.897901 3.397359 -1.554869
H -0.027967 2.115726 -0.773079
H -1.459923 1.354952 1.100182
H 0.905555 4.725367 0.608428
H -0.013885 3.445688 1.401394
H -3.576502 2.034032 -1.087889
H -1.467172 -4.269203 0.699772
H -5.958755 -2.569327 -0.823589
H 5.485908 -1.258919 -1.894543
H 4.941215 0.356162 -2.353348
H 1.851380 1.783941 0.881133
H 2.774996 3.088641 0.113870
H -3.306615 -5.846393 0.099811
H -5.499662 -5.018836 -0.642224
H 2.815067 4.355751 2.316532
H 1.910785 3.045851 3.082169
H 3.541509 2.755111 2.465656
H -3.311573 5.313116 -0.579351
H 8.533209 0.261323 -1.620552


%chk=000191846-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191846

0 1
O -3.906843 4.337233 1.293595
O 8.008071 -0.214992 -1.361136
O 7.422207 -0.479940 0.869126
N -3.840730 -0.602589 -0.253998
C -0.440856 -1.388705 1.136830
C -1.835561 -1.357649 0.561386
C 0.663559 -1.141898 0.068756
C 2.087778 -1.107304 0.664964
C -2.649072 -0.216927 0.397578
C -2.555030 -2.475710 -0.012362
C 3.180059 -0.874182 -0.403031
C -3.813811 -1.975008 -0.508498
C 4.598664 -0.763899 0.197256
C -2.027451 4.474634 -0.329101
C -2.659303 3.670476 0.843756
C -0.714887 3.878456 -0.890830
C -2.361073 1.152549 0.785809
C 0.469815 3.853401 0.104155
C -2.261577 -3.859200 -0.153882
C -3.061601 2.274800 0.443467
C -4.770642 -2.813185 -1.120782
C 5.669072 -0.540968 -0.887744
C 1.767359 3.305716 -0.533616
C -3.210691 -4.699147 -0.767354
C -4.452282 -4.181653 -1.244866
C 2.950985 3.239604 0.455166
C 7.073058 -0.418609 -0.329719
H -0.332707 -0.629086 1.936545
H -0.258212 -2.369296 1.619268
H 0.597654 -1.929247 -0.708590
H 0.454530 -0.180966 -0.444422
H 2.146146 -0.303089 1.428721
H 2.290971 -2.058650 1.199494
H 2.944374 0.053992 -0.965650
H 3.149903 -1.702109 -1.141919
H -4.627724 0.017048 -0.432057
H 4.634265 0.069473 0.925047
H 4.839876 -1.680167 0.769476
H -1.834634 5.511221 0.026560
H -2.783493 4.545847 -1.136036
H -1.937631 3.627301 1.686837
H -0.416051 4.468052 -1.781322
H -0.911029 2.848144 -1.248524
H -1.467613 1.269337 1.414237
H 0.652713 4.878408 0.490360
H 0.216208 3.229964 0.986093
H -3.955894 2.230364 -0.195671
H -1.312303 -4.267766 0.211431
H -5.725433 -2.422407 -1.489983
H 5.668400 -1.368702 -1.624111
H 5.457015 0.375249 -1.473971
H 1.567263 2.292876 -0.941386
H 2.041386 3.939843 -1.401623
H -2.999175 -5.768133 -0.881923
H -5.170938 -4.861042 -1.716932
H 3.183760 4.240480 0.864861
H 2.719602 2.574244 1.308933
H 3.866209 2.855013 -0.032600
H -3.719676 5.303607 1.417231
H 8.918222 -0.140007 -0.963696


