%chk=000197619.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000197619

0 1
O 5.478293 0.330483 1.108285
N -5.751433 1.350588 -0.474621
C -0.149696 -0.873325 -0.219841
C -1.545182 -0.871035 0.418158
C 0.598545 0.394221 0.292257
C -2.362687 0.373523 -0.056476
C 2.018132 0.455063 -0.327552
C -0.204579 1.677632 -0.019007
C 2.806262 -0.839952 0.001955
C -1.658987 1.629796 0.483047
C 0.639616 -2.143911 0.134469
C -2.496896 -2.052771 0.170318
C -3.753340 0.059069 0.600050
C 2.044393 -2.090449 -0.474883
C -3.905986 -1.484817 0.462620
C 2.808455 1.671348 0.195653
C -2.518198 0.462426 -1.580059
C 4.204566 -0.800847 -0.640780
C 4.207660 1.746241 -0.422134
C 5.006650 0.446515 -0.243249
C -4.864592 0.777426 -0.004332
H -0.244763 -0.814818 -1.330931
H -1.402190 -0.793621 1.527496
H 0.701706 0.311852 1.401057
H 1.920998 0.541567 -1.435321
H -0.198454 1.864882 -1.110513
H 0.302624 2.549806 0.437568
H 2.928648 -0.906433 1.110664
H -1.676850 1.641889 1.588354
H -2.194799 2.543254 0.164333
H 0.103381 -3.037218 -0.236737
H 0.704426 -2.265076 1.232135
H -2.262644 -2.910467 0.819586
H -2.423809 -2.417969 -0.867953
H -3.715067 0.330139 1.687604
H 2.608087 -3.001891 -0.200666
H 1.976635 -2.098569 -1.579397
H -4.607951 -1.746853 -0.347436
H -4.326988 -1.911750 1.387000
H 2.884304 1.630218 1.298846
H 2.260568 2.607187 -0.029688
H -1.544033 0.456997 -2.084463
H -3.093346 -0.378336 -1.983136
H -3.033328 1.382971 -1.878397
H 4.776644 -1.702173 -0.343972
H 4.119384 -0.842190 -1.742735
H 4.132461 1.981746 -1.500854
H 4.774119 2.581781 0.035571
H 5.970185 0.492668 -0.804775
H 4.731158 0.280284 1.734783


%chk=000197619-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000197619

0 1
O 5.471278 0.392293 1.253360
N -5.824636 1.532736 -0.074611
C -0.143623 -0.887124 -0.225106
C -1.570423 -0.884392 0.357970
C 0.606338 0.398749 0.256777
C -2.396019 0.371776 -0.066344
C 2.046125 0.451386 -0.342043
C -0.208981 1.692058 -0.030665
C 2.842445 -0.838061 0.020028
C -1.678135 1.630988 0.469174
C 0.651856 -2.156406 0.161233
C -2.518781 -2.076365 0.071963
C -3.754148 0.022525 0.645890
C 2.085023 -2.115018 -0.410345
C -3.953975 -1.517891 0.367350
C 2.845337 1.704927 0.100693
C -2.621600 0.476655 -1.597287
C 4.269874 -0.809218 -0.583061
C 4.276457 1.731226 -0.490724
C 5.070984 0.445632 -0.174047
C -4.900098 0.851013 0.251459
H -0.206478 -0.859395 -1.335583
H -1.455830 -0.817557 1.465925
H 0.710692 0.309483 1.364480
H 1.948763 0.484036 -1.452611
H -0.189815 1.899552 -1.120113
H 0.283263 2.555674 0.454047
H 2.929569 -0.868451 1.132711
H -1.680849 1.606072 1.579678
H -2.215119 2.551289 0.166597
H 0.124841 -3.058615 -0.205236
H 0.694420 -2.237408 1.268452
H -2.285921 -2.954601 0.698477
H -2.434173 -2.397148 -0.983463
H -3.603970 0.166948 1.736341
H 2.653981 -3.010640 -0.090812
H 2.038084 -2.148009 -1.519638
H -4.630502 -1.670901 -0.490610
H -4.421071 -2.006395 1.239660
H 2.889849 1.734658 1.212007
H 2.320528 2.627755 -0.206067
H -1.673336 0.608084 -2.143665
H -3.121250 -0.418757 -2.006966
H -3.262199 1.347911 -1.825151
H 4.830251 -1.711767 -0.272284
H 4.191517 -0.837034 -1.690200
H 4.209686 1.840421 -1.592755
H 4.835650 2.605049 -0.108092
H 6.044216 0.461620 -0.695240
H 4.652007 0.367738 1.810349


