%chk=000082595.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000082595

0 1
 O    5.812100     -0.5445000      0.7214000    
 C  -0.1591000      -2.237700     -0.2574000    
 C   -1.196600      -2.103900      -1.375400    
 C    1.142800      -1.519300     -0.6212000    
 C   -2.532300      -2.781300      -1.047000    
 C    2.243200      -1.681700      0.4316000    
 C   -3.242500      -2.260500      0.2068000    
 C   -1.239800       2.221700     -0.1172000    
 C   -2.164700       2.433100       1.085500    
 C    3.566800      -1.027000      4.1000001E-02
 C   2.1700000E-02   3.090400     -7.2300002E-02
 C   -3.420600       1.556100       1.038100    
 C   -3.522100     -0.7868000      0.1533000    
 C   -3.118300      8.6199999E-02   1.088000    
 C   0.9974000       2.905400      -1.236800    
 C    4.613100      -1.184500       1.136200    
 C    2.199000       3.834000      -1.174700    
 H   4.2900000E-02  -3.299400     -7.1999997E-02
 H  -0.5390000      -1.811500      0.6767000    
 H  -0.7972000      -2.556000      -2.291900    
 H   -1.363000      -1.044200      -1.602700    
 H    1.510600      -1.906400      -1.579600    
 H   0.9403000     -0.4527000     -0.7682000    
 H   -3.198600      -2.664100      -1.911500    
 H   -2.367100      -3.859700     -0.9307000    
 H    1.891900      -1.254600       1.379200    
 H    2.412200      -2.750800      0.6108000    
 H   -4.201900      -2.783800      0.3026000    
 H   -2.665500      -2.521500       1.101300    
 H   -1.790500       2.436400      -1.041200    
 H  -0.9301000       1.172000     -0.1690000    
 H   -2.472300       3.485300       1.123300    
 H   -1.611100       2.232300       2.011500    
 H    3.413400      3.9600000E-02 -0.1656000    
 H    3.944400      -1.462200     -0.8925000    
 H   0.5552000       2.888400      0.8653000    
 H  -0.2830000       4.144000     -3.3100002E-02
 H   -4.051600       1.802500       1.900500    
 H   -4.003000       1.806300      0.1429000    
 H   -4.101900     -0.4303000     -0.6946000    
 H   -2.552100     -0.2704000       1.944800    
 H   0.4675000       3.075300      -2.181400    
 H    1.350500       1.868500      -1.253300    
 H    4.828300      -2.241500       1.321800    
 H    4.276000     -0.7200000       2.068400    
 H    1.884400       4.882200      -1.197000    
 H    2.773700       3.667100     -0.2582000    
 H    2.860500       3.658000      -2.028700    
 H    6.459700     -0.6606000       1.437300    


%chk=000082595-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000082595

0 1
O 5.877739 -0.433195 0.621239
C -0.126592 -2.317198 -0.268150
C -1.224202 -2.128567 -1.340179
C 1.200883 -1.624193 -0.648455
C -2.565299 -2.829647 -1.018224
C 2.305113 -1.773498 0.422254
C -3.293559 -2.283193 0.245596
C -1.257695 2.281857 -0.123767
C -2.239245 2.501729 1.048655
C 3.606934 -1.031017 0.045191
C 0.007311 3.164530 -0.033333
C -3.519659 1.623097 0.966262
C -3.601887 -0.802196 0.153728
C -3.230295 0.138340 1.061713
C 0.999877 2.931530 -1.195820
C 4.702136 -1.181538 1.103555
C 2.262874 3.814240 -1.100114
H 0.052373 -3.401671 -0.108704
H -0.477956 -1.910807 0.701910
H -0.845000 -2.508079 -2.311618
H -1.408530 -1.043357 -1.476858
H 1.567533 -2.032687 -1.613423
H 1.007939 -0.544490 -0.823470
H -3.244524 -2.721859 -1.889077
H -2.393719 -3.917987 -0.887436
H 1.924408 -1.389152 1.392193
H 2.520119 -2.852016 0.576659
H -4.238503 -2.853787 0.367274
H -2.689478 -2.481458 1.151929
H -1.781644 2.485420 -1.081660
H -0.960831 1.213674 -0.156035
H -2.538400 3.569530 1.082007
H -1.716996 2.294389 2.006380
H 3.398884 0.048006 -0.096321
H 3.995282 -1.411813 -0.919493
H 0.523733 2.970233 0.930559
H -0.288956 4.234703 -0.014993
H -4.198048 1.920479 1.793899
H -4.057434 1.837619 0.021083
H -4.164644 -0.481769 -0.739277
H -2.661510 -0.181865 1.951450
H 0.483510 3.123030 -2.158807
H 1.296375 1.861953 -1.211842
H 4.949907 -2.257156 1.243817
H 4.349247 -0.775465 2.077515
H 1.996626 4.888294 -1.110118
H 2.816364 3.614859 -0.162970
H 2.952989 3.627935 -1.943341
H 6.610148 -0.507887 1.283716


