%chk=000179603.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179603

0 1
O 2.249255 0.668744 -0.083147
O 1.064621 1.597166 1.646449
O 3.202393 -1.298604 -0.312687
C -0.219803 0.882902 -0.339566
C -1.391764 1.661160 0.292014
C -0.308438 -0.606581 -0.016917
C 1.105215 1.468630 0.242947
C -2.748889 1.047140 -0.061178
C -0.187066 1.046858 -1.864359
C -1.652732 -1.199912 0.123233
C -2.762794 -0.438364 0.103732
C 0.830947 -1.314602 0.100004
C 2.161623 -0.730524 -0.108304
C -1.744307 -2.685639 0.282408
H -1.358339 2.720881 -0.025391
H -1.263634 1.679327 1.396853
H 1.370576 2.483040 -0.125554
H -3.021316 1.294832 -1.111342
H -3.539499 1.510752 0.565764
H 0.727515 0.616074 -2.296121
H -1.039679 0.545183 -2.338901
H -0.223466 2.101210 -2.161307
H -3.755077 -0.882350 0.198976
H 0.850220 -2.384782 0.317214
H -1.261113 -3.019406 1.212332
H -1.255481 -3.209808 -0.552263
H -2.781784 -3.043800 0.317668
H 1.067017 0.730371 2.103542


%chk=000179603-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179603

0 1
O 2.285711 0.690336 -0.232362
O 1.130279 1.528189 1.712642
O 3.233726 -1.402815 -0.341314
C -0.213796 0.914815 -0.323813
C -1.410920 1.689326 0.292688
C -0.307242 -0.582185 0.013802
C 1.113855 1.465615 0.271635
C -2.764896 1.067992 -0.108667
C -0.188444 1.088673 -1.871427
C -1.635609 -1.206433 0.149769
C -2.768399 -0.433270 0.064364
C 0.862304 -1.306829 0.096403
C 2.197076 -0.727652 -0.158813
C -1.726873 -2.708610 0.355220
H -1.363926 2.748881 -0.024503
H -1.318190 1.680823 1.394113
H 1.313836 2.496417 -0.057204
H -3.012702 1.315174 -1.163621
H -3.578883 1.513579 0.495346
H 0.699198 0.605567 -2.312684
H -1.086123 0.641538 -2.331979
H -0.163528 2.162470 -2.135907
H -3.747845 -0.928141 0.122544
H 0.866256 -2.384872 0.278384
H -1.219225 -3.022119 1.287105
H -1.250567 -3.261330 -0.476434
H -2.778843 -3.032663 0.420678
H 0.947970 0.627421 2.090132


