%chk=000018949.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018949

0 1
 S   -6.339600      0.1508000     -1.1000000E-02
 S    6.339500      0.1509000     -2.7000001E-03
 O   -4.842100     -0.5004000      6.2000002E-03
 O    4.842100     -0.5005000     -7.8999996E-03
 O   -6.564400      0.8073000      -1.282800    
 O   -6.590200      0.8156000       1.251600    
 O    6.574100      0.8081000       1.266900    
 O    6.580200      0.8152000      -1.267600    
 N   6.9999998E-04 -0.4143000      1.7999999E-02
 C   -1.200100      0.4123000      2.4200000E-02
 C    1.199900      0.4116000      1.9000000E-03
 C   -2.447300     -0.4657000      3.0099999E-02
 C    2.447100     -0.4663000     -1.3300000E-02
 C   -3.719600      0.3708000      1.4700000E-02
 C    3.719400      0.3704000     -8.1000002E-03
 C   -7.232200      -1.383000     -1.5100000E-02
 C    7.232500      -1.382800     -4.9000001E-03
 H   -1.217200       1.053300     -0.8655000    
 H   -1.209300       1.062500      0.9076000    
 H    1.223900       1.061600      0.8852000    
 H    1.203000       1.053200     -0.8875000    
 H   -2.455300      -1.118000      0.9130000    
 H   -2.447300      -1.137300     -0.8383000    
 H    2.456100      -1.137200      0.8557000    
 H    2.446700      -1.119500     -0.8956000    
 H   7.7999998E-03  -1.019300      0.8387000    
 H   -3.748800       1.004400     -0.8785000    
 H   -3.765900       1.011000      0.9026000    
 H    3.755500       1.004500      0.8846000    
 H    3.758700       1.010200     -0.8967000    
 H   -6.979900      -1.941800      0.8882000    
 H   -8.300000      -1.154500     -2.6699999E-02
 H   -6.961600      -1.947600     -0.9094000    
 H    6.973200      -1.941900     -0.9060000    
 H    8.300200      -1.154000     -1.8000000E-03
 H    6.969000      -1.946900      0.8917000    


%chk=000018949-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000018949

0 1
S -6.569150 0.075136 -0.132958
S 6.569554 0.075152 -0.135430
O -4.851515 -0.627999 0.118611
O 4.852043 -0.627804 0.117501
O -6.628526 0.839063 -1.561118
O -7.061501 0.839204 1.206548
O 7.062098 0.841132 1.202914
O 6.628547 0.837089 -1.564666
N 0.000294 -0.209764 0.318322
C -1.247217 0.567477 0.172636
C 1.247689 0.567505 0.171856
C -2.469560 -0.377352 0.207964
C 2.470080 -0.377277 0.206827
C -3.784410 0.400177 0.057397
C 3.784850 0.400228 0.055469
C -7.378266 -1.635405 -0.250724
C 7.378815 -1.635472 -0.250962
H -1.209678 1.088168 -0.804800
H -1.364889 1.360858 0.954270
H 1.365726 1.361065 0.953259
H 1.209625 1.087974 -0.805676
H -2.489691 -0.932981 1.165874
H -2.375052 -1.118870 -0.604415
H 2.490662 -0.932637 1.164892
H 2.375225 -1.119050 -0.605277
H 0.000583 -0.765219 1.185876
H -3.829324 0.927528 -0.915503
H -3.917358 1.127718 0.882009
H 3.917792 1.128500 0.879440
H 3.829635 0.926739 -0.917890
H -7.137601 -2.147277 0.689728
H -8.454724 -1.452821 -0.371610
H -6.927598 -2.123875 -1.123677
H 6.928020 -2.125223 -1.123130
H 8.455231 -1.452954 -0.372321
H 7.138390 -2.146031 0.690265


