%chk=000075196.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000075196

0 1
 S  -0.5467000     -0.8932000       2.631000    
 S   0.5440000      0.8502000       2.640800    
 O   -1.265700      -3.055400      -1.098500    
 O    1.260400       3.066300      -1.057400    
 O  -0.2009000      -2.714900      0.7908000    
 O   0.1946000       2.696400      0.8258000    
 O   -5.506000       1.432800      -1.203900    
 O    5.513600      -1.408000      -1.221100    
 O   -4.866500     -0.2476000      -2.463300    
 O    4.870500      0.2880000      -2.457700    
 N   -1.089100      -2.411100     -3.8800001E-02
 N    1.084600       2.406800     -6.8999999E-03
 N   -4.757500      0.4508000      -1.426600    
 N    4.762500     -0.4250000      -1.431000    
 C   -1.788500     -0.5299000       1.392200    
 C    1.782600      0.5093000       1.403500    
 C   -1.928100      -1.292700      0.2326000    
 C    1.926500       1.287100      0.2496000    
 C   -3.755800      0.1197000     -0.4762000    
 C    3.758800     -0.1101000     -0.4769000    
 C   -2.911800     -0.9678000     -0.7016000    
 C    2.912000      0.9781000     -0.6880000    
 C   -2.632400      0.5576000       1.617400    
 C    2.634800     -0.5803000       1.609100    
 C   -3.616100      0.8823000      0.6833000    
 C    3.620300     -0.8892000      0.6716000    
 H   -3.026900      -1.557500      -1.608000    
 H    3.026300       1.580700      -1.586000    
 H   -2.556000       1.162700       2.517500    
 H    2.559900      -1.199300       2.500300    
 H   -4.257200       1.734600      0.8932000    
 H    4.263500      -1.742700      0.8703000    


%chk=000075196-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000075196

0 1
S -0.506888 -1.105636 2.363020
S 0.503777 1.068723 2.380697
O -3.413678 -4.207367 1.279981
O 3.406923 4.190107 1.344461
O -1.629132 -3.345643 2.412135
O 1.623089 3.309604 2.463185
O -5.112995 0.630151 -2.396095
O 5.119954 -0.593393 -2.395049
O -5.781199 -1.514977 -1.978375
O 5.783964 1.546858 -1.946711
N -2.600824 -3.249001 1.540431
N 2.595779 3.226674 1.591178
N -5.010476 -0.500554 -1.783219
N 5.014117 0.528865 -1.767381
C -1.831480 -0.892475 1.120124
C 1.831058 0.874733 1.137496
C -2.735350 -1.965293 0.841989
C 2.733318 1.952937 0.875244
C -3.922502 -0.639544 -0.782968
C 3.924973 0.651930 -0.766294
C -3.777372 -1.853713 -0.101430
C 3.776618 1.856377 -0.068428
C -2.029467 0.319768 0.404936
C 2.032725 -0.327466 0.406527
C -3.057822 0.453701 -0.538350
C 3.062488 -0.446407 -0.537246
H -4.446743 -2.698305 -0.287192
H 4.444443 2.704824 -0.241749
H -1.370983 1.169764 0.604820
H 1.376006 -1.181628 0.594122
H -3.207636 1.388145 -1.085753
H 3.215013 -1.373059 -1.097009


