%chk=000205653.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000205653

1 1
O 2.971820 0.974059 -1.187364
N 1.915356 -0.451242 0.091553
N 2.347200 -0.249474 -1.123423
N 3.456952 2.763224 0.269465
C -0.225140 -1.698869 -0.148642
C 1.156730 -1.714678 0.513586
C -1.152983 -0.619439 0.419775
C -2.532199 -0.672506 -0.254481
C -3.472312 0.398247 0.314851
C 1.989046 -2.924587 0.132689
C -4.849998 0.346949 -0.362327
C 2.218770 0.627424 0.926030
C -5.791661 1.407378 0.200502
C 2.900557 1.554480 0.115558
H -0.693165 -2.701199 -0.000214
H -0.145866 -1.601567 -1.252793
H 1.058988 -1.642612 1.634452
H -1.276724 -0.755042 1.513425
H -0.717371 0.387740 0.280276
H -2.985978 -1.674761 -0.118421
H -2.430017 -0.536163 -1.349212
H -3.593065 0.260276 1.407132
H -3.033076 1.405478 0.183509
H 3.001674 -2.913703 0.561589
H 2.098170 -3.058074 -0.956261
H 1.516888 -3.853350 0.502017
H -4.741920 0.487595 -1.456050
H -5.300338 -0.657214 -0.230506
H 1.958995 0.691212 1.974960
H -6.773820 1.361547 -0.287593
H -5.404810 2.421521 0.050278
H -5.961677 1.274985 1.275379
H 3.447712 3.237209 1.170535
H 3.907763 3.243556 -0.507972


%chk=000205653-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000205653

1 1
O 2.984566 1.024022 -1.097379
N 1.951249 -0.476760 0.127062
N 2.396720 -0.308358 -1.138034
N 3.334292 2.782559 0.432992
C -0.200706 -1.738626 -0.151832
C 1.222408 -1.772724 0.465381
C -1.096424 -0.572448 0.319512
C -2.549328 -0.709679 -0.195610
C -3.455193 0.466744 0.232884
C 2.068842 -2.975465 0.008404
C -4.911820 0.317212 -0.263928
C 2.180524 0.585363 0.972581
C -5.811626 1.497346 0.159985
C 2.846131 1.551883 0.193103
H -0.670751 -2.699116 0.135397
H -0.115893 -1.744824 -1.255445
H 1.148983 -1.749354 1.568777
H -1.110568 -0.534371 1.429650
H -0.688114 0.398468 -0.031342
H -2.981693 -1.660379 0.177761
H -2.542324 -0.782210 -1.302534
H -3.455956 0.550638 1.339896
H -3.035115 1.418891 -0.154455
H 3.081974 -2.956632 0.444920
H 2.153531 -3.014962 -1.089996
H 1.570332 -3.898849 0.347482
H -4.913881 0.227712 -1.369106
H -5.334723 -0.630430 0.126362
H 1.877819 0.592681 2.013680
H -6.845852 1.363329 -0.203665
H -5.433923 2.454005 -0.247376
H -5.852769 1.592517 1.261307
H 3.259444 3.208725 1.356394
H 3.794345 3.311490 -0.310525


