%chk=000217832.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217832

0 1
O -3.773074 -0.733865 -1.752578
O -3.001971 -2.035328 -0.106363
N 2.908068 1.018218 0.631170
C -2.772528 0.436330 0.042501
C -1.270546 0.540852 0.159295
C -0.607794 1.657598 -0.371168
C -0.525610 -0.454133 0.811799
C -3.459214 0.598575 1.400403
C 1.519486 0.787842 0.414411
C 0.773826 1.785923 -0.253676
C 0.855754 -0.340769 0.938989
C -3.150131 -0.917132 -0.536777
C 3.801655 -0.145083 0.877153
C 4.110764 -0.905292 -0.316493
C 4.365245 -1.535288 -1.311129
H -3.154346 1.232480 -0.655267
H -1.173424 2.435896 -0.884272
H -1.036252 -1.335341 1.212539
H -3.203052 -0.220567 2.086915
H -3.143304 1.532715 1.883449
H -4.550693 0.624937 1.304252
H 1.270636 2.659192 -0.668209
H 1.416705 -1.124006 1.444647
H 3.325096 1.681828 -0.028538
H 4.743345 0.255956 1.336427
H 3.342587 -0.811778 1.653660
H -4.038305 -1.587361 -2.185629
H 4.581875 -2.079399 -2.162910


%chk=000217832-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000217832

0 1
O -3.561405 -0.429598 -1.979231
O -3.286509 -1.958785 -0.255832
N 2.916723 1.052980 0.310658
C -2.858564 0.454729 0.164564
C -1.327230 0.582348 0.174234
C -0.695545 1.747092 -0.328696
C -0.505181 -0.447291 0.696339
C -3.451428 0.352764 1.592572
C 1.527021 0.862813 0.249446
C 0.703481 1.893162 -0.290734
C 0.897540 -0.321069 0.731463
C -3.250119 -0.772713 -0.654124
C 3.858364 0.047737 0.808181
C 4.123271 -1.087866 -0.115306
C 4.348494 -2.024924 -0.884529
H -3.276025 1.336256 -0.352149
H -1.305759 2.553162 -0.754225
H -0.964674 -1.374656 1.058760
H -3.091905 -0.559460 2.097875
H -3.142997 1.229233 2.187967
H -4.555612 0.314234 1.564923
H 1.166435 2.811684 -0.673636
H 1.498064 -1.154604 1.108016
H 3.306528 1.814057 -0.244668
H 4.815273 0.554943 1.032216
H 3.489017 -0.351346 1.772993
H -3.755343 -1.261154 -2.492680
H 4.532885 -2.840730 -1.559794


