%chk=000217821.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217821

0 1
O -1.278513 -1.974036 -0.129266
O -1.895891 2.080262 0.072277
N 1.532644 -1.484479 -0.426610
N -0.231039 0.027250 0.313770
N -2.587625 -0.097090 -0.314948
N -4.088369 1.801923 -0.466742
C 1.115816 -0.592513 0.687942
C 2.056439 0.555436 0.881891
C 0.925660 -1.443822 1.949970
C 3.035375 0.853883 -0.008595
C 2.486044 -1.095103 -1.352939
C 3.243899 0.026217 -1.176376
C -1.315548 -0.749198 -0.027949
C 3.946922 2.023032 0.183030
C -3.721237 -1.007855 -0.626957
C -2.798020 1.304552 -0.230764
H 1.893299 1.141889 1.779190
H 0.922236 -2.283178 -0.619557
H 0.546998 -0.840133 2.782898
H 0.211547 -2.265725 1.793663
H 1.879713 -1.882816 2.266432
H -0.292846 1.064156 0.324305
H 2.628357 -1.765016 -2.209110
H 4.012328 0.301955 -1.887061
H 3.861438 2.728473 -0.656376
H 4.997275 1.702564 0.233088
H 3.733293 2.585162 1.101311
H -3.377956 -2.066137 -0.584844
H -4.098776 -0.830613 -1.645483
H -4.531953 -0.899558 0.111069
H -4.180903 2.809409 -0.518658
H -4.798704 1.274710 -0.942000


%chk=000217821-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000217821

0 1
O -1.267432 -2.066984 -0.092230
O -1.776552 2.105100 0.112324
N 1.539055 -1.514984 -0.331042
N -0.258591 -0.027201 0.431956
N -2.544678 -0.099937 -0.317709
N -3.953143 1.787938 -0.591227
C 1.102591 -0.639343 0.770468
C 2.090586 0.502414 0.943639
C 0.941529 -1.470557 2.068289
C 2.975395 0.878650 -0.041390
C 2.350834 -1.076441 -1.360415
C 3.059949 0.103226 -1.275135
C -1.307373 -0.794255 0.023635
C 3.906415 2.063667 0.136913
C -3.661937 -0.958186 -0.764234
C -2.702560 1.300690 -0.243037
H 2.039206 1.042925 1.895875
H 0.944564 -2.338660 -0.462656
H 0.601735 -0.817338 2.890883
H 0.199422 -2.275348 1.927165
H 1.913010 -1.913825 2.343856
H -0.380046 1.002387 0.429149
H 2.427649 -1.745885 -2.223192
H 3.722010 0.410180 -2.088663
H 3.737393 2.814449 -0.659102
H 4.965755 1.750557 0.065845
H 3.757414 2.559579 1.111339
H -3.291551 -1.994370 -0.747772
H -3.971409 -0.708224 -1.796443
H -4.526370 -0.882479 -0.077714
H -4.065047 2.798348 -0.545358
H -4.735921 1.207509 -0.877416


