%chk=000209638.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209638

0 1
O -1.025684 -1.695774 0.926957
N 3.531223 0.343853 -0.585723
N -0.048725 -0.096512 -0.395416
N -2.420063 -0.068819 0.030663
C 4.670097 -0.441161 0.020976
C 2.306604 0.361431 0.278693
C 1.300160 -0.698448 -0.260156
C 5.883141 -0.381871 -0.936399
C 5.057823 0.193068 1.376729
C 3.066576 -0.220181 -1.898478
C 1.862416 -1.142566 -1.630578
C 7.090742 -1.106584 -0.330301
C 6.262834 -0.529310 1.990702
C 7.465524 -0.518950 1.037220
C -1.144976 -0.692625 0.240161
C -3.638553 -0.669192 0.524733
C -2.521405 1.235845 -0.596394
C -4.721642 0.162702 0.869576
C -3.219271 1.358411 -1.809607
C -3.754615 -2.066930 0.635394
C -1.924075 2.355306 0.007625
C -5.915058 -0.413223 1.308348
C -3.309185 2.611621 -2.419034
C -4.954591 -2.620323 1.082903
C -2.019682 3.599093 -0.619946
C -6.039058 -1.801517 1.415062
C -2.708776 3.729795 -1.830368
H 4.386389 -1.511503 0.186323
H 2.537414 0.185000 1.347842
H 1.889411 1.389798 0.217457
H 1.232140 -1.572073 0.440303
H 6.135702 0.676576 -1.144548
H 5.624322 -0.830919 -1.914794
H 4.200630 0.159450 2.077300
H 5.288348 1.266438 1.228705
H 3.879704 -0.744072 -2.437830
H 2.769508 0.645801 -2.527843
H 1.112413 -1.079772 -2.435498
H 2.169567 -2.201697 -1.591852
H 6.870169 -2.186338 -0.226547
H 7.952935 -1.035552 -1.019581
H 6.537370 -0.048651 2.948446
H 5.990450 -1.572942 2.239925
H 7.831762 0.518081 0.909980
H 8.303546 -1.089351 1.478095
H -0.142059 0.693619 -1.027405
H -4.636898 1.245756 0.805154
H -3.689602 0.484967 -2.261458
H -2.907269 -2.715627 0.400191
H -1.400596 2.253530 0.958102
H -6.753899 0.229320 1.573884
H -3.850305 2.716354 -3.359537
H -5.043056 -3.702840 1.173760
H -1.558646 4.472754 -0.158872
H -6.970837 -2.242436 1.759682
H -2.780992 4.703189 -2.312824


%chk=000209638-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000209638

0 1
O -0.616910 -1.472691 0.997265
N 3.678595 0.548452 -0.833184
N -0.008259 0.012737 -0.693375
N -2.254060 -0.018931 0.082892
C 4.601069 -0.407702 -0.124127
C 2.354458 0.812666 -0.220365
C 1.410892 -0.356233 -0.677640
C 6.032814 -0.227975 -0.695324
C 4.627039 -0.184749 1.407427
C 3.307591 0.094839 -2.212945
C 1.985783 -0.742850 -2.082018
C 7.058930 -1.163687 -0.015418
C 5.659664 -1.106766 2.102806
C 7.078621 -0.939998 1.513824
C -0.926646 -0.549441 0.185571
C -3.373769 -0.658789 0.731108
C -2.501770 1.202724 -0.655352
C -4.470288 0.136936 1.159219
C -3.336037 1.181284 -1.801719
C -3.420515 -2.065290 0.925149
C -1.929105 2.427222 -0.224805
C -5.594717 -0.464277 1.763226
C -3.590235 2.374472 -2.512753
C -4.546463 -2.652467 1.539505
C -2.175716 3.615739 -0.948056
C -5.642080 -1.863017 1.959765
C -3.007693 3.594116 -2.092210
H 4.289331 -1.470819 -0.299630
H 2.405528 0.924400 0.871587
H 1.961261 1.764919 -0.636208
H 1.493187 -1.201832 0.025431
H 6.321088 0.830514 -0.539101
H 6.034579 -0.398859 -1.788949
H 3.632197 -0.379397 1.850107
H 4.876429 0.878369 1.603847
H 4.128100 -0.478053 -2.673527
H 3.127502 0.986798 -2.843629
H 1.266845 -0.494828 -2.884218
H 2.178260 -1.827774 -2.139464
H 6.796195 -2.221641 -0.225927
H 8.064715 -0.992798 -0.445565
H 5.664978 -0.896279 3.189798
H 5.340541 -2.163267 1.986021
H 7.446669 0.084648 1.727799
H 7.780642 -1.644418 2.000781
H -0.315102 0.731217 -1.351899
H -4.442449 1.222632 1.023339
H -3.782602 0.232944 -2.118248
H -2.574667 -2.683954 0.621357
H -1.303972 2.438317 0.674538
H -6.430349 0.166351 2.087444
H -4.237027 2.351226 -3.396670
H -4.565991 -3.738332 1.686516
H -1.730561 4.558076 -0.610337
H -6.513184 -2.328286 2.433520
H -3.203938 4.517795 -2.647278


