%chk=000173233.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000173233

0 1
 O   -5.186300      -1.448400      0.5956000    
 O    5.681300      0.1212000      0.3693000    
 C   -2.205000      0.5778000     -0.1888000    
 C   -3.324600       1.574000     -0.1935000    
 C   -2.809900     -0.7681000      0.2420000    
 C   -2.642100       1.258300      -1.488700    
 C  -0.7525000      0.7424000      0.2000000    
 C   -4.620500      0.8647000      0.1040000    
 C   -4.312400     -0.6295000     -0.1583000    
 C   -2.048200      -1.867600     -0.5102000    
 C   6.6200003E-02 -0.3483000     -0.5592000    
 C  -0.5217000      -1.766900     -0.2910000    
 C   -2.710500     -0.9959000       1.772000    
 C  -0.1343000       2.117100     -5.4400001E-02
 C    1.562900     -0.2234000     -0.2818000    
 C    1.255800       2.170000      0.5726000    
 C    2.111900      0.9777000      0.2196000    
 C    2.442700      -1.273800     -0.5993000    
 C    3.496000       1.074200      0.4465000    
 C    3.817300      -1.160500     -0.3800000    
 C    4.343600      1.0900000E-02  0.1488000    
 C    6.490400      -1.005900      3.4899998E-02
 H   -3.206600       2.542300      0.2636000    
 H   -3.152200      0.6691000      -2.241200    
 H   -2.052900       2.052700      -1.928500    
 H  -0.6657000      0.5696000       1.279600    
 H   -4.923900       1.033300       1.143400    
 H   -5.433200       1.216600     -0.5396000    
 H   -4.455500     -0.8665000      -1.219200    
 H   -2.241300      -1.784100      -1.587600    
 H   -2.400000      -2.860000     -0.2046000    
 H  -4.8799999E-02 -0.1615000      -1.637900    
 H  -0.2711000      -2.082500      0.7290000    
 H  -5.5100001E-02  -2.501400     -0.9575000    
 H   -3.203900      -1.930100       2.062800    
 H   -1.680800      -1.070300       2.130800    
 H   -3.177300     -0.1775000       2.330900    
 H  -0.7545000       2.914100      0.3707000    
 H  -4.6599999E-02   2.314100      -1.129700    
 H    1.163000       2.212900       1.665100    
 H    1.750500       3.093100      0.2469000    
 H   -6.095500      -1.224500      0.3336000    
 H    2.075500      -2.199700      -1.032300    
 H    3.914500       1.991700      0.8554000    
 H    4.416000      -2.024300     -0.6488000    
 H    6.457100      -1.220200      -1.038700    
 H    6.231500      -1.880900      0.6408000    
 H    7.525600     -0.7440000      0.2771000    


%chk=000173233-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000173233

0 1
O -5.201099 -1.522889 0.547795
O 5.756135 0.160840 0.315840
C -2.223846 0.604908 -0.177437
C -3.354136 1.651216 -0.217326
C -2.851860 -0.752850 0.236360
C -2.665512 1.217377 -1.525361
C -0.762428 0.745224 0.242076
C -4.670832 0.916995 0.069830
C -4.343261 -0.587850 -0.195708
C -2.074044 -1.883404 -0.481714
C 0.039229 -0.363647 -0.515512
C -0.544389 -1.781034 -0.220163
C -2.804725 -0.941015 1.779294
C -0.111018 2.122403 0.006589
C 1.551714 -0.253636 -0.258056
C 1.283348 2.144890 0.664238
C 2.136595 0.941106 0.268882
C 2.422515 -1.318363 -0.595704
C 3.535213 1.023451 0.439621
C 3.822541 -1.243097 -0.426213
C 4.382141 -0.054971 0.100152
C 6.669665 -0.923686 -0.044161
H -3.228948 2.679551 0.135873
H -3.231707 0.640377 -2.264265
H -1.973283 1.934346 -1.976977
H -0.688463 0.540708 1.330986
H -4.963689 1.037710 1.130288
H -5.506209 1.279230 -0.560696
H -4.438994 -0.809445 -1.279666
H -2.257164 -1.807639 -1.573841
H -2.442526 -2.876371 -0.158494
H -0.131010 -0.168838 -1.599655
H -0.312047 -2.053178 0.828236
H -0.038294 -2.535277 -0.851905
H -3.438054 -1.797522 2.062785
H -1.781117 -1.128765 2.143418
H -3.189590 -0.048012 2.304402
H -0.740015 2.927994 0.433116
H -0.009786 2.319140 -1.079265
H 1.158318 2.151883 1.767569
H 1.820329 3.078177 0.408364
H -6.128960 -1.436721 0.214428
H 2.006670 -2.242385 -1.011732
H 3.993162 1.936617 0.836603
H 4.448815 -2.095456 -0.706148
H 6.609077 -1.161994 -1.124509
H 6.465731 -1.838526 0.546620
H 7.674711 -0.545572 0.195342


