%chk=000082740.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000082740

0 1
 S  -5.1000002E-03  4.1000000E-03   1.652000    
 O   0.1287000       1.258200       2.372400    
 O  -0.1267000      -1.249000       2.377100    
 O  -0.4600000       3.229700      0.3275000    
 O   0.4592000      -3.228200      0.3372000    
 O   -1.937300      -2.903300       1.221400    
 O    1.934900       2.908700       1.207200    
 O   0.4988000       1.988700      -1.208500    
 O  -0.4968000      -1.993800      -1.206100    
 O   -2.898200      -1.663300       2.757100    
 O    2.892900       1.675200       2.750000    
 O   -4.830900       1.607700      -2.661600    
 O    4.835500      -1.619100      -2.651000    
 O   -5.724500     -0.1890000      -1.771300    
 O    5.727600      0.1813000      -1.766900    
 N  -0.4287000       2.205300     -0.3940000    
 N   0.4292000      -2.207000     -0.3888000    
 N   -2.432500      -1.817300       1.603700    
 N    2.429300       1.824200       1.595100    
 N   -4.790200      0.6440000      -1.859000    
 N    4.793400     -0.6520000      -1.852700    
 C   -1.415500      0.1924000      0.6167000    
 C    1.414200     -0.1897000      0.6150000    
 C   -1.482400       1.255300     -0.2841000    
 C    1.482800      -1.256400     -0.2812000    
 C   -2.466500     -0.7210000      0.6971000    
 C    2.465100      0.7241000      0.6932000    
 C   -2.600500       1.404600      -1.104700    
 C    2.602300      -1.409300      -1.099200    
 C   -3.584600     -0.5716000     -0.1235000    
 C    3.584600      0.5711000     -0.1247000    
 C   -3.651600      0.4911000      -1.024500    
 C    3.653200     -0.4955000      -1.020900    
 H   -2.632800       2.240400      -1.800900    
 H    2.635900      -2.248100      -1.791700    
 H   -4.393600      -1.295300     -4.5400001E-02
 H    4.393500       1.295200     -4.8300002E-02


%chk=000082740-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000082740

0 1
S -0.001363 0.008217 1.356356
O 0.077401 1.422694 2.137684
O -0.085153 -1.388123 2.168515
O -1.160240 3.195015 -1.674355
O 1.160513 -3.197441 -1.667772
O -2.425663 -2.968724 1.143528
O 2.460162 2.972921 1.142626
O 0.370541 1.705446 -0.884271
O -0.370338 -1.716076 -0.863035
O -2.976308 -1.564307 2.870146
O 2.951295 1.557385 2.878458
O -5.770869 1.828887 -2.083024
O 5.769030 -1.834892 -2.078536
O -6.556873 0.049235 -0.882215
O 6.555676 -0.050265 -0.885550
N -0.841084 2.114388 -1.070690
N 0.841481 -2.119973 -1.058240
N -2.668595 -1.820521 1.652616
N 2.672641 1.820280 1.655433
N -5.623817 0.847964 -1.264592
N 5.622734 -0.851470 -1.262989
C -1.686728 0.170811 0.329937
C 1.687472 -0.171926 0.336302
C -1.932412 1.231606 -0.570130
C 1.932653 -1.235413 -0.560718
C -2.759265 -0.662436 0.693092
C 2.760745 0.662045 0.696030
C -3.213862 1.474326 -1.097628
C 3.213713 -1.479406 -1.088863
C -4.052343 -0.453845 0.172676
C 4.052763 0.453799 0.172879
C -4.255678 0.616821 -0.711323
C 4.255538 -0.619861 -0.707558
H -3.383270 2.301831 -1.792371
H 3.382205 -2.309005 -1.781330
H -4.889427 -1.102804 0.448486
H 4.889425 1.105217 0.444127


