%chk=000191960.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191960

0 1
O -2.300448 1.635152 0.577084
O -5.237966 -0.145205 0.285890
N -3.158756 -1.654032 -0.880361
C -0.930566 0.432042 -1.067664
C 0.176558 0.137922 -0.048294
C -2.312261 0.604469 -0.426514
C 1.569604 0.266040 -0.677047
C -2.855406 -0.702479 0.221951
C 2.675328 -0.052452 0.338271
C 4.068044 0.078271 -0.292615
C -4.089939 -0.403102 1.106440
C 5.176621 -0.240289 0.720578
C 6.564746 -0.111764 0.097332
H -0.685646 1.348067 -1.640900
H -0.985883 -0.390840 -1.813665
H 0.043862 -0.882237 0.364031
H 0.086042 0.833901 0.813045
H -3.044467 1.005246 -1.165892
H 1.650957 -0.413799 -1.547961
H 1.711140 1.287855 -1.079674
H -2.057497 -1.147171 0.870102
H 2.593532 0.624027 1.210637
H 2.538268 -1.076718 0.735810
H 4.152808 -0.597814 -1.165181
H 4.208250 1.101232 -0.691785
H -4.397196 -1.285702 1.695100
H -3.906554 0.455359 1.778759
H 5.039694 -1.264780 1.118738
H 5.095165 0.436797 1.593321
H -3.321157 -2.585127 -0.505464
H -4.026443 -1.378287 -1.345286
H -1.462218 1.615096 1.090583
H 6.693180 -0.797761 -0.747710
H 7.349350 -0.340497 0.827224
H 6.748426 0.902764 -0.274297
H -5.188469 0.765517 -0.076185


%chk=000191960-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191960

0 1
O -2.578959 1.642557 0.452022
O -5.042659 0.357281 0.656392
N -3.344391 -1.651504 -1.094946
C -0.972254 0.451429 -1.069525
C 0.146967 0.306667 -0.010497
C -2.408700 0.521973 -0.513472
C 1.551201 0.222460 -0.653100
C -2.922729 -0.836348 0.067040
C 2.692994 0.088211 0.379110
C 4.094108 0.015628 -0.269139
C -4.037430 -0.602252 1.126792
C 5.239074 -0.118544 0.760933
C 6.634954 -0.185989 0.104283
H -0.779589 1.364257 -1.666742
H -0.943539 -0.409851 -1.764379
H -0.020733 -0.597743 0.609521
H 0.139925 1.176326 0.684013
H -3.093624 0.802267 -1.333006
H 1.579449 -0.641447 -1.349010
H 1.721041 1.126658 -1.273766
H -2.090947 -1.375561 0.564958
H 2.658577 0.949250 1.079452
H 2.526930 -0.820522 0.995132
H 4.130927 -0.844187 -0.970480
H 4.261523 0.924750 -0.884007
H -4.583296 -1.546203 1.302326
H -3.594208 -0.265994 2.089123
H 5.072718 -1.028064 1.373778
H 5.199801 0.740088 1.462149
H -3.404732 -2.656161 -0.897102
H -4.219769 -1.300433 -1.504621
H -1.842221 1.623055 1.112807
H 6.711299 -1.055208 -0.576087
H 7.435869 -0.277930 0.860868
H 6.836241 0.724008 -0.492175
H -4.573115 1.236776 0.639755


