%chk=000227779.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227779

0 1
N 1.247252 -2.276015 -1.160068
N -1.188805 1.455481 0.001896
C 2.086886 -1.042814 0.901155
C 0.870493 -1.737748 0.187936
C 2.313188 0.368472 0.368354
C -0.338331 -0.824189 0.172998
C 1.747856 -0.904785 2.401988
C 3.328561 -1.933974 0.749396
C 1.212119 1.160739 -0.028762
C -0.158143 0.606428 0.044978
C -1.614160 -1.322733 0.268503
C 3.598937 0.922324 0.308985
C 1.419150 2.470828 -0.490686
C 1.474967 -1.229288 -2.196376
C 0.232864 -3.261319 -1.645285
C -2.736974 -0.439718 0.225502
C -2.481431 0.953189 0.086072
C 3.797710 2.226503 -0.152524
C 2.708353 3.002324 -0.556048
C -4.089052 -0.890761 0.315853
C -3.577698 1.876579 0.035908
C -5.122743 0.011403 0.265671
C -4.863300 1.407671 0.124077
H 0.625174 -2.642834 0.814145
H 2.550036 -0.384916 2.938377
H 0.829405 -0.327275 2.560456
H 1.615732 -1.880400 2.878988
H 3.656540 -1.985937 -0.298130
H 4.166944 -1.578309 1.355243
H 3.114255 -2.965522 1.051805
H -1.795889 -2.391835 0.380673
H 4.460892 0.336431 0.627157
H 0.561009 3.077555 -0.793173
H 1.738745 -1.714213 -3.149238
H 2.339617 -0.611127 -1.901339
H 0.620683 -0.559032 -2.374776
H -0.751589 -2.831526 -1.883750
H 0.099738 -4.055013 -0.894767
H 0.624704 -3.743967 -2.556052
H 4.805215 2.637702 -0.195007
H 2.860851 4.017866 -0.915201
H -4.279371 -1.957253 0.424742
H -3.353460 2.938730 -0.070715
H -6.157381 -0.321304 0.333363
H -5.709251 2.093679 0.088276


%chk=000227779-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000227779

0 1
N 1.162432 -2.280470 -1.165493
N -1.202936 1.486610 -0.032265
C 2.134798 -1.055593 0.871726
C 0.887804 -1.727407 0.199267
C 2.342401 0.382884 0.354940
C -0.331043 -0.801675 0.226472
C 1.838893 -0.952116 2.404433
C 3.374250 -1.961289 0.674285
C 1.213259 1.195115 0.022942
C -0.158579 0.627945 0.066251
C -1.631265 -1.300928 0.324615
C 3.632471 0.962946 0.281960
C 1.400162 2.550943 -0.354355
C 1.433334 -1.312291 -2.249955
C 0.211566 -3.328037 -1.585561
C -2.760854 -0.425971 0.234116
C -2.490281 0.984992 0.038109
C 3.812810 2.310083 -0.102120
C 2.689613 3.110882 -0.417943
C -4.117803 -0.872144 0.325780
C -3.589237 1.897604 -0.068852
C -5.171420 0.040045 0.219115
C -4.904235 1.433178 0.019097
H 0.651260 -2.618670 0.816473
H 2.672709 -0.441307 2.917790
H 0.915704 -0.380398 2.605414
H 1.726714 -1.961550 2.844156
H 3.704551 -1.983730 -0.377028
H 4.215865 -1.632600 1.311260
H 3.123938 -2.998548 0.961153
H -1.796779 -2.374538 0.480729
H 4.511993 0.359082 0.525795
H 0.508888 3.139317 -0.591902
H 1.745918 -1.873130 -3.149927
H 2.254397 -0.635933 -1.965938
H 0.553230 -0.685344 -2.527014
H -0.806615 -2.945415 -1.842843
H 0.103028 -4.080548 -0.782989
H 0.611368 -3.838522 -2.481307
H 4.823234 2.731754 -0.153629
H 2.822226 4.157553 -0.713027
H -4.320060 -1.939665 0.477043
H -3.358209 2.957282 -0.215490
H -6.208489 -0.306415 0.287742
H -5.740713 2.136117 -0.062423


