%chk=000196362.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000196362

0 1
O -1.656770 1.572554 1.681049
O 0.462633 0.443127 -2.224666
O 3.737469 -2.162504 -0.373562
O -1.779397 -1.884190 -0.347148
O -3.691598 -2.289472 0.743006
N 1.063046 0.885154 -0.040138
N -2.005651 0.723172 -0.415507
N 2.136834 -0.859196 -1.301438
C 0.070714 2.000978 0.003065
C -1.264780 1.416720 0.539902
C 0.526066 3.163882 0.870499
C -3.237220 0.009412 -0.030488
C 1.787313 0.497775 1.101936
C 1.175002 0.164458 -1.273119
C 2.693807 -0.513096 1.059871
C 2.952000 -1.262987 -0.177398
C -4.307000 0.157465 -1.108729
C 3.468133 -0.926967 2.264045
C -2.980194 -1.488259 0.191022
H -0.073222 2.366954 -1.058667
H 1.567942 3.445727 0.672419
H 0.420708 2.950847 1.946649
H -0.094074 4.053094 0.680539
H -3.610160 0.427035 0.956678
H 1.576251 1.056335 2.024996
H -1.602856 0.481566 -1.331253
H 2.252643 -1.367414 -2.191636
H -5.231525 -0.367691 -0.825995
H -4.567178 1.214945 -1.260924
H -3.987167 -0.239150 -2.081534
H 2.811869 -1.328428 3.049979
H 4.038144 -0.091274 2.692968
H 4.198000 -1.720485 2.023741
H -1.602784 -2.856085 -0.213660


%chk=000196362-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000196362

0 1
O -1.684878 1.559850 1.740260
O 0.281761 0.391586 -2.212314
O 3.627820 -2.313606 -0.388363
O -1.608696 -1.775420 0.216847
O -3.863748 -2.294812 0.397280
N 1.044715 0.877635 -0.037114
N -2.013328 0.784240 -0.441981
N 1.991280 -0.897818 -1.265733
C 0.061465 2.010760 0.039523
C -1.300341 1.440135 0.538318
C 0.540076 3.168016 0.922364
C -3.230321 0.035341 -0.130595
C 1.829081 0.500361 1.056223
C 1.057986 0.136311 -1.237227
C 2.718889 -0.549719 1.028737
C 2.852168 -1.330526 -0.209038
C -4.286450 0.156385 -1.252557
C 3.567647 -0.946734 2.210693
C -2.969123 -1.450305 0.183665
H -0.059221 2.347353 -1.004831
H 1.582288 3.444142 0.686065
H 0.440352 2.929019 1.994143
H -0.101243 4.045801 0.734363
H -3.635530 0.463101 0.807311
H 1.691569 1.101817 1.956813
H -1.549495 0.641184 -1.352660
H 2.032762 -1.436926 -2.136798
H -5.178481 -0.437006 -0.994786
H -4.577363 1.212479 -1.376914
H -3.890088 -0.214510 -2.215281
H 3.362322 -1.991432 2.506634
H 3.383661 -0.291168 3.078776
H 4.641287 -0.902905 1.952668
H -1.511824 -2.738628 0.452010


