%chk=000183463.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183463

0 1
O -2.816207 2.047702 0.032239
O 0.926313 0.990434 1.708179
N -0.589684 1.934241 -0.517418
N 0.516044 1.073441 -0.557930
C -0.315402 3.418248 -0.232719
C -0.576207 3.700413 1.250344
C 1.136905 3.767218 -0.595142
C -1.276796 4.207805 -1.133664
C -1.844418 1.344834 -0.158834
C -1.903192 -0.158477 -0.154548
C -1.571273 -0.849964 1.012106
C -2.320087 -0.831979 -1.305311
C 1.190352 0.607880 0.584789
C -1.658678 -2.251567 1.030968
C -2.408383 -2.233303 -1.286630
C -2.073067 -2.937067 -0.120284
C 2.256539 -0.390512 0.245619
C -1.312992 -2.995637 2.278464
C -2.873669 -2.964783 -2.503491
C 3.603260 -0.042789 0.403995
C 1.893838 -1.673713 -0.183723
C 4.594892 -0.985902 0.117972
C 2.891091 -2.611610 -0.464348
C 4.239323 -2.267328 -0.316380
H 0.002077 3.020969 1.897834
H -0.308806 4.725092 1.520219
H -1.636178 3.560019 1.507386
H 1.389709 3.471911 -1.618449
H 1.855807 3.294262 0.083444
H 1.295867 4.849667 -0.520892
H -2.329390 3.996008 -0.881465
H -1.127567 5.285023 -1.013892
H -1.144381 3.961696 -2.191597
H 0.739207 0.743458 -1.500048
H -1.243810 -0.304284 1.900469
H -2.589370 -0.274739 -2.200108
H -2.147447 -4.022170 -0.104762
H -2.114142 -2.891870 3.026976
H -1.165782 -4.069563 2.110343
H -0.393170 -2.609946 2.743143
H -2.559790 -4.016527 -2.511611
H -3.973648 -2.956374 -2.560183
H -2.501154 -2.509009 -3.430691
H 3.874405 0.952845 0.756230
H 0.839257 -1.941475 -0.286827
H 5.644922 -0.722698 0.238741
H 2.616940 -3.612160 -0.796011
H 5.014642 -3.000719 -0.536600


%chk=000183463-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000183463

0 1
O -2.850895 1.993898 -0.486237
O 1.272120 1.037005 1.841855
N -0.533552 1.875822 -0.210191
N 0.589327 1.047951 -0.394627
C -0.343667 3.399224 -0.208291
C -1.130069 3.980680 0.994177
C 1.156584 3.729202 -0.033444
C -0.846767 3.983551 -1.556444
C -1.812332 1.286047 -0.307441
C -1.916936 -0.216808 -0.211751
C -1.344306 -0.951217 0.854328
C -2.722155 -0.877737 -1.172264
C 1.416946 0.632836 0.650312
C -1.550305 -2.349368 0.955191
C -2.931692 -2.275185 -1.101853
C -2.329323 -2.994787 -0.037647
C 2.502199 -0.324976 0.237408
C -0.956080 -3.129978 2.115329
C -3.810131 -2.981728 -2.120601
C 3.724474 -0.290434 0.955793
C 2.325175 -1.279820 -0.799096
C 4.769677 -1.175871 0.621769
C 3.371521 -2.170237 -1.126328
C 4.597886 -2.114197 -0.424297
H -0.762546 3.533390 1.934194
H -0.972686 5.073984 1.037621
H -2.208962 3.785515 0.898389
H 1.769002 3.353511 -0.872244
H 1.550085 3.324121 0.913022
H 1.259372 4.828357 -0.008536
H -1.913959 3.759199 -1.706080
H -0.711938 5.080629 -1.553766
H -0.267920 3.572007 -2.405005
H 0.814651 0.773551 -1.355120
H -0.760942 -0.433353 1.624300
H -3.196318 -0.285656 -1.963612
H -2.483818 -4.079954 0.027198
H -1.504275 -2.922848 3.054367
H -1.000541 -4.218356 1.936841
H 0.099305 -2.852529 2.289356
H -3.546062 -4.049904 -2.213373
H -4.876127 -2.930121 -1.825278
H -3.726705 -2.518944 -3.119873
H 3.830041 0.428935 1.774442
H 1.360950 -1.370056 -1.313568
H 5.714092 -1.139454 1.175428
H 3.225667 -2.914098 -1.917071
H 5.408635 -2.804797 -0.681382


