%chk=000172828.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000172828

0 1
 O   -2.149900      0.1731000      3.2900002E-02
 O   0.8563000       1.523800      0.5404000    
 O  -0.4104000     -0.6251000      -1.261500    
 O    2.145300      0.6014000       2.221500    
 O  -0.5627000      -5.496700     -0.1306000    
 O   -2.277100      -4.715300       1.144800    
 O    6.337900     -0.4881000     -0.2822000    
 O    5.078800      0.4191000      -1.945700    
 C   -1.428800       2.399000      0.7477000    
 C   -1.911500       1.500500     -0.4439000    
 C   -3.147400       2.000000      -1.246400    
 C  -0.2123000       1.738400       1.453900    
 C  -0.9920000       3.783300      0.2210000    
 C   -2.517100       2.602400       1.815300    
 C   -3.181200       1.319300      -2.624500    
 C   -4.495200       1.743800     -0.5601000    
 C   -1.320600     -0.7851000     -0.4638000    
 C    1.976800      0.9459000       1.062400    
 C   -1.718700      -2.078400      0.1368000    
 C    2.969000      0.8070000     -2.7500000E-02
 C   -1.050000      -3.189300     -0.1964000    
 C    4.163000      0.2631000      0.2383000    
 C   -1.371100      -4.525000      0.3463000    
 C    5.218800      8.2699999E-02 -0.7787000    
 H   -1.080500       1.511700      -1.162200    
 H   -3.056200       3.074400      -1.435400    
 H  -0.5033000      0.7821000       1.906200    
 H   0.1464000       2.390300       2.261500    
 H  -0.2573000       3.693200     -0.5865000    
 H   -1.838700       4.362600     -0.1601000    
 H  -0.5340000       4.378700       1.019600    
 H   -3.007200       1.660700       2.082400    
 H   -2.087900       3.015600       2.736400    
 H   -3.272800       3.323700       1.493500    
 H   -3.314200      0.2361000      -2.534800    
 H   -2.252700       1.504700      -3.174900    
 H   -4.005300       1.710300      -3.231100    
 H   -4.620500      0.6902000     -0.2902000    
 H   -4.641400       2.345400      0.3349000    
 H   -5.319100       2.003900      -1.235300    
 H   -2.547900      -2.092900      0.8356000    
 H    2.700500       1.151800      -1.020100    
 H  -0.2217000      -3.153400     -0.8987000    
 H    4.411900     -7.6399997E-02   1.239900    
 H  -0.7876000      -6.377200      0.2390000    
 H    7.029100     -0.6018000     -0.9690000    


%chk=000172828-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000172828

0 1
O -2.109831 0.139757 0.085951
O 0.926486 1.919997 0.771211
O -0.180806 -0.792933 -0.880744
O 1.877566 0.040765 1.799232
O -0.897701 -5.716644 0.300465
O -2.851118 -4.795127 1.174873
O 6.094501 -0.473571 -1.072138
O 5.152210 1.417956 -2.053034
C -1.505403 2.382930 0.943774
C -1.716659 1.528992 -0.351430
C -2.732371 1.991250 -1.430627
C -0.251539 1.838169 1.677085
C -1.268950 3.865690 0.553170
C -2.664999 2.274721 1.971841
C -2.624894 1.067561 -2.671942
C -4.206294 2.087712 -0.968811
C -1.261523 -0.918367 -0.254172
C 1.911128 0.935385 0.921548
C -1.838434 -2.194435 0.244748
C 2.972828 1.137999 -0.096132
C -1.178404 -3.373389 0.082114
C 4.047522 0.306613 -0.166227
C -1.755961 -4.644943 0.581805
C 5.102727 0.511330 -1.187332
H -0.731083 1.436996 -0.847080
H -2.392125 3.000483 -1.741168
H -0.377889 0.790142 2.001578
H -0.026927 2.460481 2.562936
H -0.438491 3.967853 -0.167505
H -2.177049 4.314098 0.114019
H -1.008033 4.453345 1.452971
H -2.938378 1.222327 2.158076
H -2.361920 2.731729 2.933133
H -3.564612 2.806925 1.625806
H -3.034697 0.064422 -2.453133
H -1.577485 0.943423 -3.001874
H -3.204475 1.488711 -3.513121
H -4.524600 1.153108 -0.473378
H -4.379903 2.925956 -0.272378
H -4.860816 2.247021 -1.845308
H -2.809366 -2.155547 0.750016
H 2.861252 1.975658 -0.792573
H -0.205022 -3.412504 -0.417324
H 4.157905 -0.535802 0.524039
H -1.298186 -6.560666 0.644625
H 6.791318 -0.322080 -1.766886


