%chk=000202824.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202824

0 1
O -2.295956 -0.526549 -0.671838
N -5.852476 -0.426144 0.188592
C 0.506131 -0.274113 0.353410
C 0.005464 -0.487097 -1.116362
C 2.395008 0.383213 -1.343332
C 1.112915 -0.054901 -2.114178
C 0.953788 1.170224 0.481887
C 1.756930 -1.123519 0.490583
C 1.979399 1.527499 -0.435093
C 2.779361 -0.770059 -0.432120
C -1.304531 0.271628 -1.364467
C 0.452495 2.107063 1.374372
C 1.950588 -2.160933 1.390740
C 2.494430 2.815519 -0.448301
C 3.984060 -1.457488 -0.443737
C 0.978218 3.411412 1.358585
C 3.174414 -2.854384 1.376379
C 1.985120 3.760721 0.460330
C 4.176567 -2.507834 0.472106
C -3.621508 0.060148 -0.685916
C -4.440904 -0.926101 0.161840
C -6.517496 -0.780619 1.477496
C -6.632865 -0.968521 -0.963475
H -0.292468 -0.546299 1.072361
H -0.204494 -1.578415 -1.243340
H 3.204399 0.663139 -2.044051
H 0.776122 0.777195 -2.756023
H 1.357286 -0.891952 -2.790653
H -1.568826 0.308620 -2.435150
H -1.292969 1.293205 -0.946759
H -0.332328 1.842716 2.079056
H 1.174130 -2.438300 2.099423
H 3.281048 3.097191 -1.143323
H 4.772898 -1.193994 -1.143330
H 0.592776 4.150636 2.058174
H 3.334959 -3.667831 2.081266
H 2.386078 4.772346 0.458972
H 5.119809 -3.050503 0.470912
H -3.590125 1.066663 -0.236151
H -3.977532 0.126063 -1.726733
H -4.328329 -1.954121 -0.243229
H -4.013323 -0.957414 1.187322
H -5.973650 -0.296915 2.305139
H -6.583753 -1.858196 1.685635
H -7.538363 -0.365361 1.478993
H -6.133336 -0.688196 -1.904296
H -7.628032 -0.495391 -0.971511
H -6.769030 -2.059853 -0.958906


%chk=000202824-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202824

0 1
O -2.248059 -0.606975 -0.513832
N -5.902218 -0.260709 0.241499
C 0.585454 -0.434760 0.340294
C 0.096056 -0.657418 -1.149887
C 2.434541 0.409564 -1.318274
C 1.188776 -0.113114 -2.133717
C 0.897743 1.050259 0.493236
C 1.898133 -1.203649 0.460579
C 1.905974 1.508804 -0.399960
C 2.901165 -0.749178 -0.440115
C -1.262839 0.002961 -1.414065
C 0.283833 1.947301 1.388274
C 2.162937 -2.276261 1.332833
C 2.300522 2.860151 -0.394207
C 4.166563 -1.364865 -0.465243
C 0.684698 3.307096 1.399940
C 3.438186 -2.895677 1.311202
C 1.688979 3.761512 0.513375
C 4.435413 -2.442010 0.416733
C -3.590501 -0.040223 -0.688034
C -4.512064 -0.772189 0.298186
C -6.655504 -0.534606 1.482102
C -6.641454 -0.714088 -0.954796
H -0.187306 -0.784014 1.043179
H -0.027185 -1.747431 -1.289095
H 3.225450 0.770662 -1.998324
H 0.788513 0.723216 -2.738361
H 1.512126 -0.906246 -2.830846
H -1.567908 -0.160567 -2.473026
H -1.206581 1.099760 -1.233282
H -0.497271 1.593770 2.071477
H 1.388743 -2.627627 2.025109
H 3.077999 3.212658 -1.082597
H 4.940063 -1.012687 -1.158357
H 0.216697 4.009021 2.099567
H 3.653572 -3.727173 1.991933
H 1.996495 4.813366 0.530034
H 5.420089 -2.923224 0.407839
H -3.590785 1.048041 -0.466299
H -3.921584 -0.181200 -1.740800
H -4.450739 -1.872302 0.103901
H -4.117176 -0.601242 1.316191
H -6.119573 -0.105642 2.347184
H -6.813494 -1.626177 1.678363
H -7.649317 -0.054493 1.424900
H -6.112418 -0.411054 -1.874388
H -7.639986 -0.241858 -0.971618
H -6.782658 -1.825286 -0.987504


