%chk=000190079.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190079

0 1
O 0.629664 -2.594760 1.379376
O 1.592987 2.890878 -0.518257
O -3.615445 -2.354888 0.064531
N -0.912972 0.823338 -0.269364
N -1.105836 -1.480484 0.445203
N -3.018678 -0.183722 -0.385427
C 0.548559 0.764112 -0.047582
C 0.905424 -0.173697 1.141077
C 1.232533 0.299890 -1.354255
C 2.422726 -0.346343 1.311397
C 2.660970 -0.129579 -1.171338
C 0.214267 -1.526491 0.999814
C 3.181433 -0.429999 0.025661
C 0.943306 2.245252 0.265953
C -1.624135 -0.261769 -0.071568
C 3.461794 -0.203349 -2.432551
C 0.451757 2.815956 1.562380
C -3.955817 -1.247149 -0.298829
C -5.347164 -0.862877 -0.692100
H 0.495174 0.269045 2.090011
H 1.179494 1.134258 -2.093140
H 0.662079 -0.535675 -1.810598
H 2.618474 -1.265113 1.913337
H 2.823988 0.500526 1.908688
H 4.216289 -0.749823 0.135348
H -1.677790 -2.348908 0.429722
H 2.936438 -0.760372 -3.219250
H 4.434835 -0.690428 -2.288028
H 3.661922 0.806680 -2.822470
H -0.639442 2.706046 1.654963
H 0.915332 2.339014 2.433444
H 0.676592 3.892232 1.624229
H -3.319957 0.739536 -0.731465
H -6.022814 -1.731154 -0.583170
H -5.417535 -0.538842 -1.741282
H -5.761352 -0.059540 -0.065061


%chk=000190079-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000190079

0 1
O 0.644738 -2.644755 1.346916
O 1.800972 2.864099 -0.428357
O -3.584853 -2.430342 0.021768
N -0.942265 0.883757 -0.233956
N -1.093300 -1.450604 0.381522
N -3.005116 -0.194385 -0.350182
C 0.537903 0.787037 -0.033484
C 0.892709 -0.182425 1.144862
C 1.202469 0.304431 -1.350749
C 2.414350 -0.348609 1.342414
C 2.649617 -0.137984 -1.183103
C 0.188413 -1.540960 0.956141
C 3.175023 -0.436447 0.034066
C 1.004620 2.239828 0.313426
C -1.614706 -0.224057 -0.057542
C 3.453294 -0.228833 -2.463405
C 0.430002 2.869348 1.575967
C -3.920270 -1.250259 -0.308266
C -5.340854 -0.873972 -0.698750
H 0.448668 0.230910 2.076776
H 1.154413 1.131053 -2.083097
H 0.607552 -0.530649 -1.775647
H 2.584968 -1.265954 1.937515
H 2.807857 0.496032 1.946368
H 4.225966 -0.747855 0.104068
H -1.724620 -2.273544 0.366846
H 2.960786 -0.893998 -3.200808
H 4.470939 -0.615544 -2.281546
H 3.541876 0.767497 -2.939456
H -0.640166 2.624595 1.682550
H 0.959856 2.487179 2.470478
H 0.570806 3.960624 1.537413
H -3.314997 0.728817 -0.667142
H -5.981311 -1.761241 -0.597793
H -5.383365 -0.521005 -1.745561
H -5.734872 -0.069982 -0.050857


