%chk=000294274.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294274

0 1
O 7.603042 0.942462 -0.906064
O 4.136342 -1.879610 -0.045401
N 5.462602 -0.164349 0.627802
C -2.070778 0.384987 0.230931
C -3.358038 -0.415756 -0.008186
C -0.826437 -0.502617 0.094810
C -4.603569 0.470483 0.127476
C 0.462074 0.296571 0.333545
C -5.890415 -0.330868 -0.111650
C 1.699357 -0.597086 0.195564
C -7.136502 0.554651 0.024067
C 2.993134 0.193879 0.433096
C -8.422838 -0.247061 -0.215151
C 5.751533 1.290581 0.653690
C 6.675548 -0.972800 0.318204
C 4.202640 -0.703797 0.276266
C 6.420792 1.728176 -0.662639
C 7.341557 -0.477176 -0.974346
C -9.670448 0.637263 -0.079514
C -10.953744 -0.155849 -0.316773
H -2.013592 1.226908 -0.485566
H -2.096687 0.845976 1.237106
H -3.332728 -0.877786 -1.014037
H -3.415877 -1.258179 0.707967
H -0.884752 -1.345641 0.810708
H -0.801781 -0.965511 -0.910972
H -4.629529 0.931925 1.133436
H -4.546422 1.312470 -0.588983
H 0.518717 1.138193 -0.383275
H 0.436023 0.756580 1.340237
H -5.947892 -1.173228 0.604483
H -5.864944 -0.792617 -1.117551
H 1.730450 -1.068570 -0.808188
H 1.647735 -1.446493 0.907365
H -7.162352 1.015990 1.030073
H -7.079371 1.396769 -0.692246
H 3.053154 1.040302 -0.280183
H 2.978866 0.639484 1.449493
H -8.481416 -1.089760 0.500201
H -8.398647 -0.709068 -1.220761
H 4.838808 1.884783 0.853571
H 6.446644 1.480351 1.506914
H 7.374674 -0.884241 1.178826
H 6.392657 -2.049400 0.227776
H 6.828529 2.753416 -0.605895
H 5.741021 1.637722 -1.526915
H 8.356516 -0.891590 -1.110154
H 6.725254 -0.685991 -1.865927
H -9.697116 1.098304 0.927202
H -9.614170 1.479720 -0.796335
H -10.976643 -0.595661 -1.320311
H -11.838258 0.483198 -0.218378
H -11.059925 -0.976140 0.402189


%chk=000294274-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000294274

0 1
O 8.031303 1.084946 -0.348249
O 4.197050 -1.997371 -0.229048
N 5.522707 -0.169309 0.307432
C -2.103334 0.342458 0.066899
C -3.428749 -0.448631 -0.008572
C -0.849089 -0.559378 0.033347
C -4.682961 0.453885 0.012477
C 0.475364 0.229629 0.141054
C -6.009159 -0.337545 -0.043968
C 1.723633 -0.677639 0.078157
C -7.262910 0.565964 -0.028489
C 3.033794 0.120155 0.231831
C -8.590023 -0.224561 -0.076078
C 5.763856 1.242935 0.665495
C 6.758965 -0.978181 0.207766
C 4.280738 -0.767572 0.085076
C 6.785849 1.864658 -0.313359
C 7.747155 -0.305287 -0.760844
C -9.842969 0.680904 -0.061919
C -11.164617 -0.116327 -0.107908
H -2.058935 1.063824 -0.776074
H -2.093434 0.950416 0.996137
H -3.435952 -1.064798 -0.932060
H -3.476926 -1.162542 0.840338
H -0.903726 -1.295088 0.862712
H -0.847207 -1.151329 -0.905518
H -4.669088 1.079002 0.930108
H -4.640954 1.159518 -0.843772
H 0.520357 0.979244 -0.677590
H 0.477675 0.806068 1.090785
H -6.052996 -1.039566 0.815089
H -6.022038 -0.966555 -0.958772
H 1.745750 -1.231018 -0.878779
H 1.672063 -1.448807 0.870099
H -7.246811 1.199025 0.883661
H -7.221789 1.264206 -0.890872
H 3.067172 0.926366 -0.530963
H 3.047488 0.627409 1.218260
H -8.633487 -0.921660 0.787072
H -8.607852 -0.858654 -0.987371
H 4.825192 1.817713 0.637247
H 6.174065 1.296232 1.695301
H 7.223218 -1.061508 1.211263
H 6.472355 -1.985013 -0.139634
H 7.079719 2.876096 0.013224
H 6.342862 1.916160 -1.332448
H 8.723677 -0.816002 -0.753366
H 7.330807 -0.311054 -1.791098
H -9.823124 1.314755 0.848302
H -9.798829 1.376327 -0.925067
H -11.222133 -0.734786 -1.023677
H -12.044192 0.553614 -0.096650
H -11.246735 -0.797030 0.760612


