%chk=000090979.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090979

0 1
 O    1.378100      -1.684700     -0.8023000    
 O   -2.695400       1.486400      0.6030000    
 C  -3.4000000E-03  0.2160000      0.7839000    
 C    1.324500     -0.3571000       1.220600    
 C   3.5100002E-02   1.572900      0.1902000    
 C    2.008000      -1.102000      7.7699997E-02
 C   -1.211700     -0.3587000      0.9428000    
 C    3.498800      -1.110000      2.4000000E-02
 C  -3.3100002E-02   2.671900       1.024800    
 C   0.1380000       1.702000      -1.181400    
 C   -2.506900      0.2768000      0.5629000    
 C   -3.619800     -0.6252000      0.1763000    
 C    4.201900      -1.038600       1.205200    
 C    4.114500      -1.188800      -1.204500    
 C   2.7999999E-03   3.949300      0.4661000    
 C   0.1741000       2.979600      -1.740100    
 C   0.1065000       4.103200     -0.9162000    
 C   -3.323000      -1.836800     -0.4145000    
 C   -4.918600     -0.2257000      0.4195000    
 C    5.595800      -1.046200       1.155200    
 C    5.508400      -1.196500      -1.254500    
 C    6.249100      -1.125300     -7.4600004E-02
 C   -4.369100      -2.685000     -0.7778000    
 C   -5.964700      -1.074100      5.6200001E-02
 C   -5.689800      -2.303600     -0.5424000    
 H    1.175500      -1.072200       2.038600    
 H    1.963700      0.4495000       1.596300    
 H   -1.263700      -1.353700       1.377200    
 H  -0.1126000       2.564300       2.103200    
 H   0.1895000      0.8351000      -1.834100    
 H    3.718500     -0.9966000       2.175600    
 H    3.550700      -1.239000      -2.131000    
 H  -4.9699999E-02   4.824200       1.107400    
 H   0.2543000       3.099600      -2.816600    
 H   0.1343000       5.097900      -1.351300    
 H   -2.307800      -2.153100     -0.6327000    
 H   -5.148700      0.7260000      0.8890000    
 H    6.172800     -0.9954000       2.074000    
 H    6.017400      -1.256800      -2.212100    
 H    7.334400      -1.132100     -0.1135000    
 H   -4.155700      -3.640100      -1.248800    
 H   -6.993300     -0.7778000      0.2403000    
 H   -6.504400      -2.963600     -0.8261000    


%chk=000090979-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000090979

0 1
O 1.554721 -0.617997 -1.355031
O -2.971826 1.386859 0.854602
C -0.066783 0.503206 0.667119
C 1.276451 -0.113148 1.025601
C -0.027000 1.898806 0.138920
C 2.089609 -0.561772 -0.212431
C -1.199212 -0.264432 0.765274
C 3.526000 -0.957779 -0.010415
C 0.661659 2.924912 0.839549
C -0.629589 2.212190 -1.108729
C -2.611660 0.190350 0.612451
C -3.638090 -0.841599 0.216849
C 4.136800 -1.008422 1.272115
C 4.293883 -1.302786 -1.156786
C 0.719996 4.237517 0.322765
C -0.561213 3.518906 -1.630649
C 0.110191 4.539301 -0.916006
C -3.282172 -2.082750 -0.376867
C -5.011991 -0.535986 0.411051
C 5.487297 -1.396002 1.403823
C 5.643022 -1.684309 -1.024933
C 6.243674 -1.731974 0.256876
C -4.282565 -3.001643 -0.762256
C -6.009542 -1.456820 0.035306
C -5.647023 -2.694310 -0.551356
H 1.142114 -1.001582 1.674635
H 1.887115 0.610020 1.599075
H -1.074195 -1.317330 1.052234
H 1.118927 2.711092 1.813351
H -1.131855 1.419691 -1.672402
H 3.566226 -0.753472 2.171265
H 3.805020 -1.260244 -2.135754
H 1.236985 5.022055 0.886546
H -1.026519 3.741877 -2.597164
H 0.159439 5.556088 -1.321600
H -2.229441 -2.319525 -0.566833
H -5.265543 0.433106 0.853876
H 5.950512 -1.435388 2.395633
H 6.228232 -1.943788 -1.913754
H 7.293262 -2.028927 0.360700
H -4.001064 -3.951735 -1.229630
H -7.066284 -1.215707 0.194944
H -6.422269 -3.410546 -0.846465


