%chk=000208434.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208434

0 1
O 0.166032 -1.624676 0.387136
O -1.949328 2.388177 -0.464446
N 2.564911 -0.304891 1.118973
N 0.324482 2.402339 -0.154327
N -0.933855 0.340765 -0.010087
C 3.113035 -1.490901 0.378752
C 1.480789 0.392907 0.492702
C 3.748994 -1.094514 -0.975238
C 1.515451 1.733290 0.199163
C 0.258633 -0.420584 0.320200
C 4.126193 -2.167677 1.307897
C -0.942839 1.746880 -0.224885
C 4.014249 -2.312225 -1.854521
C 2.764879 2.548984 0.261315
C -2.215997 -0.357279 -0.111241
C 0.331263 3.860531 -0.440004
C -2.308883 -1.508750 -0.908594
C -3.329012 0.129270 0.592784
C -3.532954 -2.176819 -0.992562
C -4.545043 -0.549827 0.489921
C -4.649740 -1.700699 -0.298346
H 2.253719 -2.196369 0.196196
H 3.314388 0.337153 1.397416
H 3.071870 -0.399090 -1.510393
H 4.689994 -0.538263 -0.810837
H 3.674470 -2.378731 2.287695
H 5.019049 -1.559629 1.478688
H 4.453341 -3.125670 0.887795
H 4.730712 -2.999976 -1.390391
H 3.094294 -2.879070 -2.045712
H 4.424709 -2.017285 -2.826833
H 3.668400 1.925924 0.356010
H 2.756442 3.235035 1.123454
H 2.909255 3.156241 -0.646062
H 0.952378 4.084348 -1.322344
H 0.697736 4.430444 0.429011
H -0.701557 4.209663 -0.658732
H -1.433532 -1.891447 -1.433540
H -3.252959 1.036109 1.192713
H -3.613249 -3.075296 -1.603149
H -5.415546 -0.177254 1.028405
H -5.600071 -2.225639 -0.370882


%chk=000208434-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000208434

0 1
O 0.178712 -1.539525 0.586307
O -2.054529 2.464165 -0.447971
N 2.673167 -0.156039 0.890292
N 0.258991 2.528469 -0.063134
N -0.910426 0.448322 -0.020174
C 3.144456 -1.484188 0.408550
C 1.505161 0.492826 0.452451
C 3.617131 -1.415626 -1.072576
C 1.481026 1.862510 0.182101
C 0.261420 -0.294864 0.363068
C 4.250599 -1.967991 1.365363
C -0.974374 1.854972 -0.194097
C 3.902791 -2.798292 -1.698609
C 2.748555 2.686200 0.189765
C -2.157993 -0.296483 -0.170831
C 0.210548 3.998605 -0.224186
C -2.257687 -1.278672 -1.179165
C -3.244270 -0.036495 0.691239
C -3.457550 -2.007937 -1.324809
C -4.443712 -0.764823 0.537405
C -4.553463 -1.752271 -0.468681
H 2.282214 -2.170223 0.468648
H 3.411025 0.445408 1.261291
H 2.824091 -0.909598 -1.658997
H 4.522142 -0.774617 -1.138887
H 3.867112 -2.030104 2.398651
H 5.120054 -1.278604 1.353713
H 4.614230 -2.967357 1.072699
H 4.761396 -3.300124 -1.216393
H 3.023501 -3.462252 -1.599354
H 4.135108 -2.705914 -2.775382
H 3.599803 2.055201 -0.122931
H 2.986251 3.094987 1.192786
H 2.693934 3.538147 -0.506377
H 0.663045 4.313798 -1.181756
H 0.730834 4.496177 0.610871
H -0.849961 4.290121 -0.229477
H -1.402060 -1.477099 -1.831609
H -3.156070 0.735957 1.460640
H -3.535069 -2.773434 -2.104551
H -5.290215 -0.560147 1.201796
H -5.484815 -2.317687 -0.584589


