%chk=000006112.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006112

0 1
 S    2.587000      -1.358300     -0.3603000    
 S    4.624300      -1.150900     -0.4692000    
 O   -5.158000     -0.8719000      0.3044000    
 O   -4.351700      0.9806000     -0.7326000    
 C    2.237000      0.2515000      0.4116000    
 C   0.8858000      0.7830000     -4.1600000E-02
 C    3.386800       1.179600      1.2400000E-02
 C  -0.2865000     -0.1268000      0.3328000    
 C   -1.675800      0.3883000     -5.3800002E-02
 C    4.720100      0.4924000      0.2825000    
 C   -2.811400     -0.5299000      0.3968000    
 C   -4.157900     -3.7400000E-02 -8.2999997E-02
 H    2.235200      0.1111000       1.499200    
 H   0.7224000       1.767600      0.4153000    
 H   0.8798000      0.9477000      -1.127200    
 H    3.331300       2.114300      0.5832000    
 H    3.315700       1.462200      -1.047300    
 H  -0.1690000      -1.111700     -0.1321000    
 H  -0.2677000     -0.2916000       1.418000    
 H   -1.824100       1.385800      0.3786000    
 H   -1.715300      0.5158000      -1.143100    
 H    5.552600       1.057000     -0.1470000    
 H    4.896000      0.3854000       1.357800    
 H   -2.833100     -0.5840000       1.490500    
 H   -2.655400      -1.535900     -8.2000000E-03
 H   -6.035400     -0.5569000     -1.0000000E-03


%chk=000006112-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000006112

0 1
S 2.622455 -1.513259 -0.206910
S 4.788151 -1.004310 -0.858192
O -5.217519 -0.875167 0.277081
O -4.421930 1.057707 -0.732494
C 2.246038 0.254301 0.479565
C 0.875387 0.729145 -0.039358
C 3.396494 1.207509 0.079902
C -0.308366 -0.149687 0.420093
C -1.666179 0.381074 -0.087489
C 4.772436 0.540834 0.229960
C -2.839442 -0.509015 0.363245
C -4.188378 0.004265 -0.100846
H 2.225998 0.125350 1.577727
H 0.715500 1.769535 0.316884
H 0.908927 0.765738 -1.145694
H 3.345078 2.111674 0.719901
H 3.257556 1.524992 -0.970556
H -0.154310 -1.186090 0.052816
H -0.318813 -0.204848 1.528987
H -1.829273 1.414187 0.275353
H -1.655624 0.442911 -1.192487
H 5.586134 1.185825 -0.144348
H 4.978499 0.243680 1.271685
H -2.874010 -0.592842 1.467847
H -2.722679 -1.545560 -0.008461
H -6.089429 -0.510947 -0.037510


