%chk=000217876.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217876

0 1
O 0.672612 -0.287678 -0.528754
N -2.177967 -0.187368 0.508306
N 2.659441 -1.063279 0.517630
N 3.936251 -0.944823 0.725126
N 6.100053 -0.044875 0.256686
N 6.701661 1.230170 0.581078
C -1.471255 -1.206281 -0.315275
C -0.037540 -1.367312 0.186410
C -3.552352 0.060006 0.242218
C -4.392477 -0.916661 -0.330551
C -4.099202 1.295480 0.663994
C 2.009603 -0.180397 -0.310804
C -5.757793 -0.658308 -0.463409
C -5.464802 1.528232 0.523020
C -6.301222 0.558222 -0.042661
C 2.685776 0.874280 -0.978531
C 4.047558 0.982242 -0.763421
C 4.670646 0.039947 0.103168
H -1.463487 -0.942143 -1.400248
H -2.005419 -2.181819 -0.218588
H 0.413051 -2.332330 -0.103865
H 0.084181 -1.207231 1.273415
H -1.612789 0.658687 0.632534
H -3.992958 -1.872441 -0.654444
H -3.462490 2.054579 1.109202
H -6.405403 -1.417475 -0.901950
H -5.885613 2.477440 0.854650
H -7.364386 0.750390 -0.151399
H 2.135655 1.554136 -1.626648
H 4.630974 1.763870 -1.247282
H 6.337268 -0.718122 1.019787
H 6.606388 1.846514 -0.235789
H 7.713338 1.064950 0.676297


%chk=000217876-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000217876

0 1
O 0.599535 -0.256625 -0.456013
N -2.134243 -0.198403 0.175627
N 2.617888 -1.117339 0.431431
N 3.970637 -1.006401 0.657861
N 5.995171 0.121060 0.483726
N 6.815444 1.185186 0.100505
C -1.513013 -1.410310 -0.355593
C -0.048382 -1.491067 0.068106
C -3.507940 0.059374 0.114906
C -4.444546 -0.915307 -0.342559
C -4.004363 1.329892 0.540204
C 1.967856 -0.126473 -0.230164
C -5.825823 -0.623359 -0.356498
C -5.383636 1.607349 0.514351
C -6.311989 0.633515 0.069069
C 2.606142 1.049002 -0.720167
C 3.976632 1.174258 -0.497604
C 4.630766 0.111888 0.204206
H -1.584304 -1.464106 -1.465590
H -2.023893 -2.306623 0.049788
H 0.452233 -2.378340 -0.357583
H 0.066153 -1.513719 1.166868
H -1.505814 0.600701 0.275977
H -4.099477 -1.892883 -0.694241
H -3.297672 2.090358 0.897078
H -6.527378 -1.388129 -0.710929
H -5.738442 2.590062 0.847170
H -7.384638 0.852328 0.052354
H 2.026103 1.808990 -1.249882
H 4.558574 2.035482 -0.832764
H 6.355496 -0.691714 0.995233
H 7.488670 0.974458 -0.640586
H 7.165558 1.767498 0.865616


