%chk=000130408.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130408

0 1
 O    3.075900     -0.9162000       1.905000    
 O    2.159500       2.759500     -0.4593000    
 O    5.251500     -0.2477000     -0.6426000    
 O   -5.788200     -0.8625000       1.537400    
 C    1.971600     -0.3356000     -0.2353000    
 C    1.103000      0.7401000      0.4713000    
 C  -0.2517000      0.9709000     -0.2174000    
 C   -1.044900     -0.3868000     -0.2678000    
 C    3.244500     -0.2640000      0.6497000    
 C    1.186500      -1.658300     -0.2032000    
 C   -2.460200     -0.2084000     -0.9297000    
 C    2.067300       1.914100      0.6782000    
 C  -0.1903000      -1.524800     -0.8760000    
 C    3.439200       1.246700      0.9223000    
 C   -1.076800       2.058300      0.5029000    
 C    2.326400      4.1999999E-03  -1.709200    
 C   -3.164600      0.8832000     -0.1143000    
 C   -2.475300       2.224300     -9.5799997E-02
 C   -3.314300      -1.508700     -0.9300000    
 C   -2.350100      0.2086000      -2.418400    
 C    4.473900     -0.8902000      6.1299998E-02
 C   -3.905300      -1.847500      0.4261000    
 C   -4.237400      0.6766000      0.6677000    
 C   -4.750900     -0.6937000      0.9008000    
 C    4.710600      -2.342400      0.3763000    
 H   0.8705000      0.3677000       1.483100    
 H  -6.8899997E-02   1.325500      -1.236400    
 H   -1.217000     -0.6797000      0.7803000    
 H    1.035100      -1.992500      0.8307000    
 H    1.749900      -2.452200     -0.7064000    
 H    1.764600       2.530300       1.531400    
 H  -6.4499997E-02  -1.378800      -1.953200    
 H  -0.7019000      -2.484800     -0.7517000    
 H    4.202000       1.705000      0.2837000    
 H    3.741000       1.419200       1.962500    
 H  -0.5553000       3.021100      0.4492000    
 H   -1.164800       1.808100       1.568600    
 H    2.835900     -0.8426000      -2.184600    
 H    1.446200      0.2225000      -2.319000    
 H    2.996300      0.8636000      -1.801200    
 H   -2.417700       2.641900      -1.106500    
 H   -3.032100       2.954900      0.5036000    
 H   -2.747300      -2.363000      -1.312300    
 H   -4.154700      -1.385200      -1.629900    
 H   -1.952100     -0.6085000      -3.030200    
 H   -3.335400      0.4675000      -2.825700    
 H   -1.706200       1.076100      -2.582400    
 H    3.820800     -0.6773000       2.482900    
 H   -3.132900      -2.058200       1.172100    
 H   -4.544100      -2.732600      0.3328000    
 H    2.797300       3.463200     -0.2503000    
 H   -4.695600       1.474800       1.241600    
 H    5.092800      -2.448500       1.394400    
 H    3.796300      -2.924900      0.2515000    
 H    5.456600      -2.740800     -0.3182000    


%chk=000130408-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000130408

0 1
O 2.882169 -1.008578 1.937598
O 2.025520 2.844216 -0.411980
O 5.378060 -0.210197 -0.514594
O -5.717388 -0.850314 1.804944
C 1.991250 -0.340345 -0.251081
C 1.092099 0.732771 0.449646
C -0.249090 0.979998 -0.266903
C -1.031723 -0.379257 -0.296404
C 3.255946 -0.273205 0.703422
C 1.213310 -1.679852 -0.259284
C -2.470562 -0.213368 -0.949650
C 2.027466 1.921799 0.746366
C -0.177917 -1.511036 -0.932893
C 3.419803 1.253458 0.984876
C -1.064180 2.101874 0.421108
C 2.414674 0.045866 -1.693810
C -3.159661 0.900720 -0.147509
C -2.486708 2.254857 -0.197746
C -3.326305 -1.516209 -0.891229
C -2.367642 0.185207 -2.453869
C 4.531648 -0.910916 0.104398
C -3.889905 -1.846834 0.504954
C -4.213294 0.668872 0.702680
C -4.713341 -0.677282 1.046814
C 4.727444 -2.407783 0.296903
H 0.855194 0.302922 1.447458
H -0.036589 1.311403 -1.301608
H -1.201821 -0.658864 0.768809
H 1.084725 -2.030674 0.781422
H 1.778322 -2.460302 -0.806650
H 1.691754 2.481027 1.643532
H -0.046805 -1.318811 -2.014980
H -0.712994 -2.475367 -0.849571
H 4.171274 1.661431 0.285439
H 3.790849 1.424321 2.013669
H -0.515258 3.056692 0.330233
H -1.172252 1.873758 1.502003
H 3.026454 -0.756985 -2.145553
H 1.531831 0.190680 -2.337622
H 2.990348 0.983505 -1.723680
H -2.388638 2.623742 -1.236870
H -3.068956 3.003865 0.368924
H -2.743866 -2.370117 -1.282417
H -4.181423 -1.383587 -1.584283
H -2.031904 -0.680922 -3.052668
H -3.358212 0.490884 -2.837888
H -1.663374 1.013150 -2.636727
H 3.512369 -0.755888 2.659324
H -3.068727 -2.045581 1.224493
H -4.524409 -2.750368 0.485418
H 2.617176 3.612218 -0.208473
H -4.686487 1.502851 1.237787
H 5.234859 -2.595699 1.263214
H 3.766384 -2.943743 0.337005
H 5.373207 -2.798503 -0.506096


