%chk=000234958.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234958

0 1
O -0.866556 2.285581 0.848137
O 0.443031 2.428334 -1.031091
N 0.081740 0.385693 0.017859
C -0.526001 -0.348385 1.153814
C 0.847651 -0.386533 -0.995654
C -1.843929 -0.972227 0.755495
C 2.280008 -0.572733 -0.552171
C -0.062561 1.753089 -0.152006
C -2.956075 -0.149783 0.519946
C 3.156581 0.522933 -0.570194
C -1.962327 -2.361922 0.625031
C 2.736575 -1.827562 -0.128921
C -4.179388 -0.717336 0.158513
C 4.484013 0.359392 -0.169550
C -3.190914 -2.925720 0.265561
C 4.068139 -1.986020 0.269019
C -4.299000 -2.106158 0.031993
C 4.942026 -0.895133 0.249486
C -1.095317 3.730903 0.787116
C -2.103806 4.052557 -0.295197
H -0.681012 0.359776 2.006922
H 0.200383 -1.114526 1.511723
H 0.819568 0.161953 -1.971774
H 0.335629 -1.360753 -1.166530
H -2.852395 0.933848 0.616984
H 2.791141 1.501475 -0.894981
H -1.104500 -3.006309 0.804607
H 2.062490 -2.680869 -0.111414
H -5.041698 -0.078630 -0.025074
H 5.163639 1.210068 -0.184150
H -3.282858 -4.005968 0.167018
H 4.423525 -2.961897 0.594697
H -5.253662 -2.546891 -0.248259
H 5.977511 -1.020528 0.559418
H -1.473744 3.913989 1.809536
H -0.125222 4.234870 0.626785
H -2.386896 5.111218 -0.279470
H -1.688862 3.837411 -1.293565
H -3.018429 3.456694 -0.190656


%chk=000234958-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000234958

0 1
O -0.854165 2.679966 0.867623
O 0.416378 2.785326 -1.111042
N -0.023694 0.733318 -0.055877
C -0.548803 -0.019930 1.104853
C 0.703638 -0.030387 -1.101013
C -1.681444 -0.976016 0.734248
C 2.068486 -0.526550 -0.631195
C -0.104546 2.105382 -0.181158
C -2.833689 -0.496494 0.059748
C 3.115958 0.399076 -0.384214
C -1.609233 -2.348006 1.076844
C 2.310356 -1.907913 -0.431162
C -3.893402 -1.371935 -0.261187
C 4.379416 -0.051360 0.055459
C -2.671452 -3.227414 0.760752
C 3.576459 -2.362117 0.007597
C -3.816293 -2.741410 0.089926
C 4.613496 -1.433990 0.253103
C -1.016329 4.159633 0.792177
C -2.194282 4.539061 -0.109621
H -0.897344 0.718173 1.844122
H 0.284790 -0.588950 1.560511
H 0.814218 0.647130 -1.964473
H 0.068949 -0.883729 -1.403896
H -2.892412 0.564486 -0.211405
H 2.933045 1.468215 -0.546336
H -0.720145 -2.728645 1.595886
H 1.506488 -2.629634 -0.626427
H -4.779367 -0.990154 -0.781288
H 5.183372 0.670651 0.238447
H -2.603825 -4.286813 1.033128
H 3.752861 -3.433652 0.155471
H -4.639402 -3.420801 -0.158457
H 5.595699 -1.782809 0.591694
H -1.186196 4.453080 1.841059
H -0.073877 4.598718 0.420874
H -2.348147 5.634207 -0.084465
H -1.992015 4.243482 -1.152734
H -3.125050 4.052709 0.231430


