%chk=000087980.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000087980

0 1
 O   -2.188300       2.241600      0.1727000    
 C    2.152700      -1.364500      1.4400000E-02
 C   -2.759300     -0.5461000     -7.6399997E-02
 C   0.9791000     -0.3719000      5.8200002E-02
 C   -1.370300     -5.7999999E-03  1.2300000E-02
 C  -0.2911000     -0.8888000     -2.6100000E-02
 C    1.237500      0.9709000      0.1785000    
 C    1.610800      -2.803800     -0.1225000    
 C    2.975900      -1.253500       1.316000    
 C    3.126500      -1.129600      -1.162500    
 C   -1.145500       1.365500      0.1339000    
 C   -2.846800      -1.979300      0.5327000    
 C   -3.237300     -0.6335000      -1.558400    
 C   -3.852200      0.2908000      0.6662000    
 C   0.1583000       1.853800      0.2171000    
 C    2.624600       1.517200      0.2690000    
 C    2.825500       2.737000     -0.6251000    
 H  -0.4957000      -1.935600     -0.1617000    
 H    2.447100      -3.516500     -0.1330000    
 H   0.9905000      -3.107300      0.7300000    
 H    1.071700      -2.971300      -1.063200    
 H    2.317200      -1.320500       2.191500    
 H    3.670300      -2.101500       1.387400    
 H    3.596700     -0.3711000       1.456800    
 H    4.151800     -0.9124000     -0.8416000    
 H    3.212800      -2.024100      -1.793000    
 H    2.792500     -0.3344000      -1.838600    
 H   -2.352100      -2.736000     -8.5900001E-02
 H   -3.889600      -2.312300      0.6079000    
 H   -2.422900      -2.013900       1.543300    
 H   -2.572400      -1.276200      -2.147300    
 H   -4.249700      -1.047600      -1.626500    
 H   -3.241900      0.3536000      -2.034400    
 H   -4.764500     -0.3032000      0.8082000    
 H   -4.189600       1.168100      0.1066000    
 H   -3.518500      0.5943000       1.665100    
 H   0.3024000       2.923700      0.3356000    
 H    2.820200       1.806200       1.309400    
 H    3.429300      0.8643000     -3.2800000E-02
 H    2.539400       2.526500      -1.661500    
 H    3.882100       3.028100     -0.6229000    
 H    2.262200       3.609300     -0.2802000    
 H   -2.594900       2.224600     -0.7119000    


%chk=000087980-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000087980

0 1
O -2.158681 2.452869 0.010571
C 2.212281 -1.399232 0.197101
C -2.856521 -0.539058 -0.153099
C 1.068722 -0.343088 0.110733
C -1.422857 0.043965 -0.038773
C -0.277067 -0.788921 0.009577
C 1.281669 1.076187 0.158343
C 1.685069 -2.858895 0.073390
C 2.919974 -1.312301 1.586687
C 3.242903 -1.217103 -0.960181
C -1.167083 1.444414 0.028620
C -2.857598 -2.090683 -0.216298
C -3.541984 -0.041769 -1.466961
C -3.705623 -0.146294 1.099509
C 0.150931 1.925104 0.122891
C 2.629089 1.804633 0.210785
C 2.989969 2.482089 -1.139454
H -0.449527 -1.863501 -0.033403
H 2.541654 -3.555068 0.136349
H 0.986656 -3.120420 0.889495
H 1.180104 -3.037951 -0.894050
H 2.197803 -1.529707 2.395113
H 3.737605 -2.056395 1.645308
H 3.352388 -0.318938 1.787954
H 3.764274 -0.248332 -0.925526
H 4.010724 -2.012469 -0.907232
H 2.736479 -1.293799 -1.940118
H -2.299559 -2.465316 -1.093486
H -3.899262 -2.451413 -0.302276
H -2.421973 -2.539883 0.694629
H -2.973500 -0.393353 -2.346786
H -4.570840 -0.442054 -1.535713
H -3.606078 1.059059 -1.552174
H -4.730203 -0.552727 1.008294
H -3.794858 0.944505 1.260769
H -3.246481 -0.562722 2.014042
H 0.283331 3.012328 0.171460
H 2.573995 2.589838 0.990438
H 3.452026 1.137125 0.505879
H 3.076422 1.734810 -1.948770
H 3.951284 3.023600 -1.063600
H 2.210793 3.205846 -1.438016
H -3.061947 2.059817 -0.044719


