%chk=000007796.chk
%nprocshared=24
%mem=100GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000007796

0 1
 O    1.032000       1.707700       1.075300    
 O    1.296300       1.216700      -1.163500    
 C   -3.396900      0.3094000      3.7000000E-02
 C   -3.083500      -1.154100     -0.3008000    
 C   -2.211700       1.239000     -0.1198000    
 C   -1.992800      -1.725900      0.5621000    
 C   -1.318700       1.518100      0.8496000    
 C   -2.089200       1.898300      -1.469900    
 C  -0.1471000       2.445300      0.7821000    
 C  -0.8519000      -2.324600      0.1717000    
 C    2.889600      0.3948000      0.4800000    
 C    3.629500     -0.2878000     -0.6679000    
 C    1.663900       1.138200      6.9999998E-04
 C  -0.4190000      -2.525800      -1.252600    
 C   0.1222000      -2.844900       1.195000    
 C    4.877300      -1.004600     -0.1789000    
 H   -4.229600      0.6603000     -0.5852000    
 H   -3.760600      0.3680000       1.072000    
 H   -3.990400      -1.749100     -0.1365000    
 H   -2.857700      -1.231200      -1.367300    
 H   -2.188500      -1.655100       1.631900    
 H   -1.458100       1.032800       1.814900    
 H   -2.877300       2.649500      -1.588300    
 H   -2.219900       1.147300      -2.257600    
 H   -1.132700       2.378200      -1.673900    
 H  -0.2595000       3.189600       1.578900    
 H  -3.7400000E-02   3.021900     -0.1384000    
 H    2.573000     -0.3535000       1.214500    
 H    3.552900       1.116200      0.9702000    
 H    2.967600      -1.008200      -1.162900    
 H    3.912600      0.4535000      -1.424800    
 H  -0.2732000      -3.592700      -1.452300    
 H   -1.131700      -2.153700      -1.990300    
 H   0.5308000      -2.010700      -1.430900    
 H    1.099600      -2.369800       1.064600    
 H  -0.2057000      -2.651000       2.221700    
 H   0.2453000      -3.927100       1.083700    
 H    4.623500      -1.777000      0.5543000    
 H    5.575400     -0.3027000      0.2884000    
 H    5.390300      -1.486900      -1.016700    


%chk=000007796-Freq.chk
%nprocshared=24
%mem=100GB
#p freq=noraman PBEPBE/SDD

000007796

0 1
O 1.135726 2.018626 0.903703
O 1.196621 0.908919 -1.149425
C -3.344839 0.332521 0.406878
C -3.197390 -1.157435 -0.057314
C -2.213190 1.235923 -0.063393
C -2.014045 -1.862690 0.572395
C -1.338014 1.767064 0.841034
C -2.126323 1.502985 -1.560522
C -0.180955 2.668627 0.514891
C -0.876581 -2.301109 -0.041017
C 2.901723 0.433737 0.583446
C 3.743550 -0.327609 -0.460333
C 1.677538 1.116776 -0.008677
C -0.577719 -2.156719 -1.523290
C 0.228136 -2.972467 0.761478
C 4.928032 -1.072982 0.188863
H -4.310500 0.715027 0.013586
H -3.410793 0.355143 1.511629
H -4.133171 -1.682384 0.225823
H -3.141194 -1.194993 -1.160275
H -2.092144 -2.007346 1.662407
H -1.464072 1.529531 1.906503
H -2.514600 2.509260 -1.811761
H -2.730251 0.774172 -2.128392
H -1.083215 1.436124 -1.917814
H -0.172123 3.580465 1.134808
H -0.134360 2.932026 -0.554244
H 2.539593 -0.262619 1.367948
H 3.505660 1.193106 1.114437
H 3.092655 -1.039368 -1.001729
H 4.114659 0.385017 -1.221242
H -0.203247 -3.111721 -1.941350
H -1.455979 -1.848872 -2.114517
H 0.211790 -1.395067 -1.681572
H 1.191982 -2.439978 0.627094
H -0.003766 -3.000457 1.840737
H 0.395178 -4.012936 0.417343
H 4.575556 -1.820590 0.924986
H 5.601933 -0.373115 0.718428
H 5.526839 -1.606195 -0.571451


