%chk=000200338.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200338

0 1
O -3.389124 -0.430671 -0.447284
O -4.425631 1.007092 0.955641
N 2.226649 0.038623 0.129976
C 0.796195 -0.073776 -0.343651
C 0.153773 -1.338625 0.277794
C -0.007761 1.165470 0.118918
C -1.310068 -1.480806 -0.145350
C -1.474437 1.061100 -0.305687
C -2.097136 -0.226033 0.239239
C 3.037998 -1.152943 -0.298763
C 2.882535 1.292633 -0.377539
C 4.447534 -1.071802 0.310828
C 4.289579 1.428106 0.228782
C 5.160654 0.215452 -0.119677
C -4.488613 0.250779 0.014520
C -5.672906 -0.109686 -0.814985
H 0.738884 -0.147274 -1.460045
H 0.236131 -1.285581 1.382412
H 0.715502 -2.246161 -0.018380
H 0.431899 2.093848 -0.294464
H 0.069855 1.264543 1.220904
H -1.389847 -1.648261 -1.238522
H -1.765087 -2.373547 0.323951
H -2.044905 1.937211 0.064021
H -1.565359 1.083758 -1.408992
H -2.298151 -0.161497 1.329712
H 3.107482 -1.244847 -1.404066
H 2.533713 -2.073151 0.071960
H 2.267189 2.164354 -0.062168
H 2.942714 1.322485 -1.486738
H 5.033616 -1.959391 0.013136
H 4.369257 -1.100854 1.416534
H 4.204484 1.519762 1.330600
H 4.760474 2.360929 -0.129170
H 6.143290 0.294022 0.380437
H 5.368406 0.192951 -1.205820
H -5.869630 -1.192687 -0.786683
H -5.518356 0.153426 -1.872805
H -6.574501 0.412151 -0.459675


%chk=000200338-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000200338

0 1
O -3.501446 -0.444355 -0.496937
O -4.372191 0.981789 1.136543
N 2.244851 0.032669 0.115797
C 0.849057 -0.096699 -0.426928
C 0.152434 -1.366730 0.138037
C -0.011261 1.149143 -0.076781
C -1.318325 -1.502191 -0.324263
C -1.482250 1.008914 -0.537477
C -2.117930 -0.254961 0.057489
C 3.099485 -1.143601 -0.220456
C 2.924293 1.287414 -0.320837
C 4.493671 -1.052443 0.434013
C 4.312725 1.450204 0.330830
C 5.220286 0.243003 0.018673
C -4.540262 0.240732 0.140326
C -5.859676 -0.053334 -0.542806
H 0.876558 -0.188945 -1.548965
H 0.206684 -1.319342 1.244373
H 0.686795 -2.281168 -0.173068
H 0.400074 2.058727 -0.548422
H 0.034476 1.302301 1.020435
H -1.362748 -1.631238 -1.423768
H -1.775807 -2.401140 0.128442
H -2.056194 1.901926 -0.231135
H -1.528295 0.940811 -1.642844
H -2.206762 -0.150647 1.156380
H 3.222320 -1.238817 -1.333784
H 2.607281 -2.062802 0.135533
H 2.304188 2.151899 -0.035424
H 3.039029 1.310159 -1.438842
H 5.083830 -1.945467 0.150203
H 4.369870 -1.068888 1.534347
H 4.180728 1.538683 1.426796
H 4.770045 2.392481 -0.028469
H 6.190782 0.334331 0.542185
H 5.438687 0.214232 -1.069157
H -6.052653 -1.139980 -0.546516
H -5.822644 0.276149 -1.595755
H -6.673404 0.468287 -0.018863


