%chk=000210819.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210819

0 1
S 1.391643 -1.099250 -1.824485
N -1.035200 -0.252057 0.364508
N -3.671238 0.885389 -0.131746
C 0.221094 -0.471513 1.168464
C -2.238039 -0.666344 1.166411
C -1.202203 1.178246 -0.057797
C 0.534100 -1.984230 1.298628
C -3.501992 -0.543762 0.292289
C -2.470692 1.312538 -0.924058
C 1.410762 0.289914 0.603786
C 0.321810 -2.821671 0.033410
C 1.995778 0.060406 -0.645530
C 1.458438 -2.699766 -0.965571
C -4.914146 1.042757 -0.945197
C 1.963848 1.297852 1.419188
C 3.093661 0.813793 -1.082313
C 3.055082 2.053523 0.990629
C 3.621627 1.815588 -0.266631
H 0.065506 -0.098335 2.225242
H -2.367015 -0.062219 2.091513
H -2.113582 -1.725527 1.474399
H -0.324242 1.473508 -0.673301
H -1.257541 1.877640 0.803965
H -0.101502 -2.401697 2.105355
H 1.577433 -2.094912 1.656413
H -3.430193 -1.245230 -0.567470
H -4.390856 -0.837512 0.889149
H -2.604793 2.376758 -1.210975
H -2.340266 0.728321 -1.861774
H 0.202384 -3.886252 0.322814
H -0.640034 -2.531561 -0.449704
H 2.446578 -2.836420 -0.490477
H 1.375889 -3.465395 -1.763172
H -5.036461 2.106084 -1.206850
H -5.783151 0.761888 -0.329288
H -4.941397 0.453226 -1.873305
H 1.530923 1.496624 2.399149
H 3.540985 0.618642 -2.059258
H 3.465614 2.829654 1.634511
H 4.471787 2.404603 -0.604523


%chk=000210819-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000210819

0 1
S 1.366692 -1.125156 -1.935386
N -1.030530 -0.212102 0.375813
N -3.689155 0.849880 -0.171634
C 0.222924 -0.448917 1.158374
C -2.232981 -0.714278 1.089964
C -1.237554 1.208359 -0.007416
C 0.483825 -1.976676 1.365536
C -3.490181 -0.563440 0.217700
C -2.490349 1.351199 -0.884804
C 1.437367 0.297733 0.586012
C 0.312487 -2.876797 0.121635
C 2.007047 0.087546 -0.704506
C 1.414716 -2.737520 -0.937677
C -4.930279 1.051909 -0.941491
C 2.040723 1.282126 1.414138
C 3.107803 0.868609 -1.137541
C 3.140792 2.057932 0.988679
C 3.671454 1.859018 -0.304423
H 0.087940 -0.029912 2.192095
H -2.391826 -0.161813 2.052427
H -2.102500 -1.783706 1.330947
H -0.360737 1.558868 -0.576112
H -1.352170 1.863151 0.893955
H -0.200055 -2.342993 2.155509
H 1.506876 -2.090921 1.775293
H -3.382979 -1.225694 -0.680966
H -4.374431 -0.904268 0.789556
H -2.644435 2.419130 -1.129644
H -2.319887 0.795531 -1.842224
H 0.302413 -3.935473 0.457621
H -0.664665 -2.670190 -0.351718
H 2.424022 -2.818294 -0.497268
H 1.309493 -3.513284 -1.717189
H -5.060485 2.127033 -1.161102
H -5.798153 0.717320 -0.344442
H -4.944350 0.496450 -1.914272
H 1.618368 1.451610 2.412222
H 3.527770 0.679022 -2.130947
H 3.572935 2.810514 1.657187
H 4.522455 2.451794 -0.657504


