%chk=000180702.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180702

0 1
O 2.106060 0.728001 -0.095159
O 0.165451 -0.193968 -1.564278
O -0.498599 -0.233654 1.996385
O 3.712354 2.149849 -0.522601
C 0.199611 -0.625794 -0.210519
C 1.658720 -0.600814 0.310344
C -0.699054 0.291493 0.665002
C 2.515412 -1.707578 -0.308820
C -2.153059 0.211110 0.267711
C 3.971324 -1.397731 -0.177528
C 3.465724 0.999063 -0.264964
C 4.402334 -0.131857 -0.142437
C -2.674949 1.132842 -0.650022
C -2.979324 -0.785593 0.805249
C -4.021348 1.061007 -1.019422
C -4.325222 -0.850628 0.436681
C -4.847900 0.072975 -0.474832
H -0.211149 -1.660715 -0.248229
H 1.699128 -0.608230 1.425429
H -0.318068 1.340306 0.650868
H 2.262901 -1.823195 -1.392640
H 2.260952 -2.682932 0.154472
H 4.650940 -2.250195 -0.128499
H 0.668523 0.658117 -1.663900
H -2.032166 1.896396 -1.086326
H -2.563753 -1.508177 1.508575
H 5.452584 0.149729 -0.050327
H -1.067944 0.244367 2.634660
H -4.425329 1.775295 -1.735231
H -4.966455 -1.623729 0.856488
H -5.896302 0.020441 -0.762933


%chk=000180702-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000180702

0 1
O 2.124226 0.730718 -0.264910
O 0.080087 -0.473482 -1.608693
O -0.470545 -0.078921 2.044419
O 3.865055 2.209598 -0.473343
C 0.194359 -0.688935 -0.167357
C 1.671382 -0.606319 0.265718
C -0.689780 0.308232 0.630974
C 2.539865 -1.739672 -0.294994
C -2.160030 0.235513 0.249072
C 4.006605 -1.404461 -0.148081
C 3.507899 1.031468 -0.263536
C 4.436674 -0.112487 -0.085211
C -2.750009 1.255943 -0.534212
C -2.958165 -0.856796 0.676545
C -4.113730 1.184335 -0.897862
C -4.321713 -0.927899 0.318501
C -4.903388 0.091827 -0.471983
H -0.181607 -1.711719 0.011115
H 1.738582 -0.559723 1.367263
H -0.304118 1.334803 0.455287
H 2.288994 -1.919867 -1.361434
H 2.301565 -2.674203 0.247228
H 4.731327 -2.227413 -0.110288
H 0.584856 0.358114 -1.817140
H -2.140688 2.106007 -0.864915
H -2.507134 -1.642222 1.294298
H 5.493421 0.152757 0.010558
H -1.100468 0.431928 2.611856
H -4.559078 1.977958 -1.508044
H -4.931332 -1.775035 0.653008
H -5.961711 0.036156 -0.750640


