%chk=000121942.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121942

0 1
 O   0.2382000     -0.8005000     -0.7956000    
 O    1.651500      0.7315000      0.2552000    
 O   -3.154300     -0.7001000      0.5807000    
 O  -0.5008000       1.983400      -1.039300    
 O    2.339000      -2.712300     -0.7836000    
 O    4.972600      -1.516500     -0.7659000    
 O   -3.386600       2.241700      -1.573700    
 O    4.239400       1.163000     -0.8741000    
 O   -4.939900      0.7712000      0.2792000    
 O   -2.536600      -3.310500       1.180700    
 O    1.700300       2.865100       1.983300    
 C  -0.9046000     -0.2132000     -0.1789000    
 C   -1.440000      0.9076000      -1.070200    
 C    1.400400     -0.6532000      1.9700000E-02
 C   -1.970600      -1.289400      3.9700001E-02
 C    2.574300      -1.306000     -0.7137000    
 C    3.885500      -1.051600      2.9300001E-02
 C   -2.799300       1.404400     -0.5781000    
 C    4.060000      0.4348000      0.3423000    
 C    2.813600      0.9629000       1.061200    
 C   -3.752600      0.2401000     -0.3085000    
 C   -1.500200      -2.359300       1.020000    
 C    2.890400       2.461300       1.329900    
 C   -5.879500     -0.2543000      0.5604000    
 H  -0.6580000      0.2254000      0.7996000    
 H   -1.505800      0.5812000      -2.115400    
 H    1.220500      -1.165400      0.9745000    
 H   -2.227300      -1.784600     -0.9066000    
 H    2.642600     -0.9467000      -1.747600    
 H    3.902800      -1.628700      0.9623000    
 H   -2.669700       2.018200      0.3221000    
 H    4.962600      0.5916000      0.9424000    
 H    2.669000      0.4404000       2.016000    
 H   -4.028400     -0.2541000      -1.250100    
 H   -1.280300      -1.934000       2.004700    
 H  -0.6130000      -2.883300      0.6541000    
 H    2.966200       3.041000      0.4045000    
 H    3.742100       2.706600       1.971000    
 H   0.3472000       1.640400      -1.369600    
 H    1.485900      -2.842500      -1.232000    
 H    4.812800      -2.456600     -0.9570000    
 H   -4.252500       2.530200      -1.237700    
 H    3.395400       1.164700      -1.356400    
 H   -3.323400      -2.837100       1.501200    
 H   0.9537000       2.631200       1.405400    
 H   -6.801200      0.2168000      0.9135000    
 H   -5.514500     -0.9168000       1.350900    
 H   -6.111700     -0.8305000     -0.3407000    


%chk=000121942-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000121942

0 1
O 0.246545 -0.846196 -0.543172
O 1.822000 0.842176 -0.058296
O -3.321147 -0.939966 0.571491
O -0.518878 2.080108 -0.163206
O 2.453844 -2.850341 -0.206380
O 5.053341 -1.727732 -0.506705
O -3.281957 2.463879 -1.019089
O 4.406360 1.010527 -1.313765
O -5.053113 0.658247 0.366690
O -2.779913 -3.716731 0.604947
O 1.999335 3.305911 1.587334
C -0.989679 -0.336168 0.132673
C -1.424619 1.000309 -0.531630
C 1.474090 -0.589035 0.136204
C -2.052420 -1.441763 -0.003026
C 2.601601 -1.419534 -0.494179
C 3.959316 -1.017283 0.132205
C -2.843864 1.408539 -0.108331
C 4.221677 0.511356 0.048283
C 3.034646 1.230812 0.731429
C -3.822873 0.219990 -0.205065
C -1.731608 -2.715465 0.787093
C 3.064007 2.763128 0.743891
C -6.185455 -0.258635 0.153928
H -0.768838 -0.148627 1.205050
H -1.421274 0.843856 -1.633279
H 1.384712 -0.782570 1.230402
H -2.199933 -1.694698 -1.076079
H 2.609293 -1.233854 -1.588006
H 3.903242 -1.287059 1.214021
H -2.828981 1.751303 0.946866
H 5.174992 0.733536 0.557404
H 2.899937 0.877120 1.775666
H -3.955341 -0.099584 -1.268168
H -1.604042 -2.456015 1.860295
H -0.804221 -3.174968 0.411320
H 3.024560 3.154349 -0.291904
H 4.005668 3.102730 1.206974
H 0.418388 1.745775 -0.321000
H 1.701335 -3.213847 -0.737086
H 4.818953 -2.692864 -0.498418
H -4.151452 2.803701 -0.684793
H 3.528590 0.972265 -1.777423
H -3.639621 -3.280642 0.841238
H 1.110226 3.161271 1.167039
H -7.069665 0.263847 0.547741
H -6.029768 -1.203534 0.703635
H -6.322797 -0.470127 -0.925721


