%chk=000274811.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000274811

0 1
O -4.333873 0.994412 -0.976018
N -1.028213 1.137627 0.123396
N -1.986125 0.945250 -0.930967
C 0.370345 1.441229 -0.335567
C -1.765886 -0.262233 -1.794979
C -1.699361 1.853736 1.155875
C 1.339794 0.748199 0.649497
C -2.263858 -1.570946 -1.136999
C -3.315916 1.243028 -0.370048
C 0.636153 2.939119 -0.476015
C -3.050412 1.866258 0.918989
C -2.493489 -0.002939 -3.115705
C 2.691366 0.559738 0.018489
C -1.354847 -2.026621 -0.032500
C -0.980885 2.381783 2.335240
C 2.930423 -0.549606 -0.808041
C 3.719152 1.486787 0.248098
C -0.165567 -2.708470 -0.336290
C -1.681482 -1.771196 1.308911
C 4.183858 -0.726006 -1.398450
C 4.971851 1.304490 -0.344614
C 0.686491 -3.124884 0.690145
C -0.826591 -2.190812 2.330608
C 5.206934 0.200141 -1.169206
C 0.359759 -2.866170 2.024743
H 0.494730 0.958828 -1.349904
H -0.660006 -0.345509 -1.986397
H 0.918060 -0.241189 0.951368
H 1.423185 1.320925 1.592036
H -2.349908 -2.360961 -1.911379
H -3.305553 -1.432440 -0.772304
H -0.083528 3.406760 -1.162226
H 1.640661 3.117820 -0.882022
H 0.570213 3.473484 0.480407
H -3.834665 2.237069 1.547787
H -2.325882 -0.810896 -3.832766
H -2.166223 0.936839 -3.577827
H -3.582930 0.095992 -2.960390
H -0.184145 3.091518 2.050259
H -0.513959 1.571639 2.919086
H -1.664671 2.914989 3.015253
H 2.138250 -1.277088 -0.982264
H 3.544594 2.347898 0.889153
H 0.089371 -2.921822 -1.371806
H -2.599114 -1.235861 1.551430
H 4.365430 -1.588224 -2.038300
H 5.767205 2.025586 -0.162378
H 1.605973 -3.656261 0.449851
H -1.087674 -1.995041 3.369190
H 6.182538 0.060455 -1.629713
H 1.022427 -3.194319 2.822067


%chk=000274811-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000274811

0 1
O -4.344164 0.793392 -0.708083
N -0.919270 1.126584 0.207556
N -1.953510 0.805203 -0.743673
C 0.449726 1.414682 -0.319336
C -1.776690 -0.264245 -1.763698
C -1.547034 1.774697 1.279793
C 1.548212 0.942006 0.684356
C -2.341170 -1.638038 -1.273279
C -3.233413 1.115978 -0.168154
C 0.606426 2.879280 -0.786869
C -2.922304 1.767700 1.094422
C -2.419466 0.181184 -3.095456
C 2.897695 0.769034 -0.000141
C -1.602580 -2.184849 -0.063017
C -0.794756 2.343613 2.452290
C 3.174845 -0.405409 -0.748743
C 3.894370 1.775130 0.072429
C -0.342001 -2.822675 -0.213611
C -2.134318 -2.042982 1.244338
C 4.410909 -0.566026 -1.413135
C 5.133364 1.619011 -0.590281
C 0.373973 -3.295998 0.908938
C -1.422128 -2.514310 2.370978
C 5.394730 0.448055 -1.338075
C -0.163673 -3.139189 2.208706
H 0.562677 0.766423 -1.205976
H -0.689219 -0.387708 -1.921603
H 1.210737 -0.020972 1.111261
H 1.643004 1.666339 1.511939
H -2.253258 -2.339446 -2.125567
H -3.416487 -1.501664 -1.062122
H -0.196030 3.139855 -1.499301
H 1.579577 3.012145 -1.290861
H 0.559200 3.586988 0.059958
H -3.670066 2.137227 1.791257
H -2.252666 -0.588313 -3.871419
H -1.977025 1.132066 -3.441287
H -3.502657 0.330374 -2.958850
H -0.104967 3.158613 2.165750
H -0.205115 1.568736 2.973829
H -1.519784 2.759296 3.170111
H 2.420907 -1.202093 -0.793657
H 3.700204 2.683502 0.656597
H 0.071221 -2.965819 -1.221486
H -3.108987 -1.558298 1.375615
H 4.611226 -1.481190 -1.981988
H 5.893115 2.405711 -0.520608
H 1.340365 -3.795875 0.773220
H -1.851049 -2.399054 3.373100
H 6.355176 0.323643 -1.850521
H 0.386124 -3.510213 3.081158


