%chk=000181722.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181722

0 1
O -5.323198 1.042677 -0.001342
C -1.820422 0.397196 0.000272
C -2.347698 -0.899189 0.000113
C -0.428307 0.607491 0.000425
C -2.920299 1.420142 -0.000055
C 0.469374 -0.505782 0.000313
C -3.846835 -0.889235 -0.000387
C -0.106266 -1.815426 0.000641
C -4.207418 0.595760 0.000144
C -1.494203 -1.999433 0.000337
C 1.909486 -0.207094 -0.000152
C 0.062697 1.970852 0.000849
C 2.345316 1.146291 0.000477
C 1.387681 2.231087 0.001060
C 0.683751 -3.085914 0.001662
C 2.933816 -1.190405 -0.001477
C 3.725251 1.475235 0.000344
C 4.278983 -0.862170 -0.001661
C 4.688164 0.485195 -0.000640
H -2.883336 2.085228 0.884502
H -2.883124 2.084992 -0.884777
H -4.277172 -1.401869 -0.882328
H -4.277703 -1.402313 0.881041
H -1.914378 -3.003941 0.000369
H -0.670124 2.777128 0.001108
H 1.769727 3.252060 0.001511
H 1.326053 -3.159744 -0.890755
H 0.048224 -3.982432 0.002137
H 1.325583 -3.158514 0.894513
H 2.685499 -2.250402 -0.002616
H 4.018581 2.524908 0.000965
H 5.031619 -1.649717 -0.002649
H 5.747278 0.733137 -0.000746


%chk=000181722-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000181722

0 1
O -5.399384 1.085814 0.000268
C -1.841030 0.396360 0.000227
C -2.373841 -0.899884 0.000494
C -0.431828 0.607478 -0.000217
C -2.938529 1.442851 0.000296
C 0.488078 -0.521923 -0.000331
C -3.887413 -0.889329 0.000717
C -0.095109 -1.854699 -0.000259
C -4.240846 0.612763 0.001985
C -1.499155 -2.006692 0.000180
C 1.936934 -0.214362 -0.000121
C 0.056472 1.966354 -0.000381
C 2.369399 1.171524 -0.000256
C 1.404017 2.241247 -0.000476
C 0.681709 -3.165001 -0.000638
C 2.987695 -1.191494 0.000494
C 3.758209 1.506962 -0.000065
C 4.345863 -0.841743 0.000696
C 4.746531 0.519831 0.000364
H -2.926959 2.109187 0.885584
H -2.928201 2.108169 -0.885814
H -4.337914 -1.378225 -0.885084
H -4.337550 -1.379297 0.886068
H -1.915297 -3.020769 0.000157
H -0.673228 2.782429 -0.000383
H 1.767882 3.275138 -0.000545
H 1.319824 -3.277659 -0.896392
H -0.023598 -4.012625 0.000192
H 1.321494 -3.277200 0.894000
H 2.756542 -2.251097 0.000927
H 4.035542 2.567757 -0.000208
H 5.102311 -1.634309 0.001165
H 5.807979 0.788245 0.000552


