%chk=000096633.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096633

0 1
 S  -5.0000002E-04   2.533900     -0.4981000    
 O   1.3400000E-02   3.362400      0.7578000    
 O   -4.843400      -1.719700       1.334600    
 O    4.839800      -2.088500     -0.8304000    
 O   -4.843300      -2.085800     -0.8300000    
 O    4.839600      -1.722700       1.334200    
 N   -4.397700      -1.494800      0.1833000    
 N    4.394300      -1.497400      0.1829000    
 C   -1.314000       1.330600     -0.2948000    
 C    1.324200       1.318900     -0.2927000    
 C   -1.824800       1.064000      0.9754000    
 C    1.822700      0.6604000      -1.406500    
 C   -1.824800      0.6609000      -1.406500    
 C    1.822700       1.062600      0.9756000    
 C   -3.357300     -0.5420000      2.2200000E-02
 C    3.354500     -0.5440000      2.1700000E-02
 C   -2.846500      0.1277000       1.134000    
 C    2.843900     -0.2767000      -1.248400    
 C   -2.846600     -0.2753000      -1.248100    
 C    2.843900      0.1257000       1.133800    
 H   -1.443200       1.568800       1.858800    
 H    1.435100      0.8609000      -2.401500    
 H   -1.438700      0.8588000      -2.403200    
 H    1.439700       1.567500       1.857500    
 H   -3.219500     -5.5100001E-02   2.138600    
 H    3.217300     -0.7787000      -2.137300    
 H   -3.220400     -0.7774000      -2.136800    
 H    3.216600     -5.7900000E-02   2.138300    


%chk=000096633-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000096633

0 1
S 0.000301 2.517756 -0.299612
O 0.001113 3.156638 1.240869
O -5.292486 -1.547330 1.233630
O 5.072578 -2.077599 -0.974882
O -5.075721 -2.072115 -0.976111
O 5.291403 -1.550099 1.234008
N -4.719139 -1.429775 0.084741
N 4.717246 -1.433655 0.085412
C -1.432305 1.236410 -0.233109
C 1.432244 1.234546 -0.233504
C -2.069910 1.109867 1.011198
C 1.842915 0.537956 -1.385158
C -1.844575 0.541745 -1.385422
C 2.070580 1.109188 1.010521
C -3.567932 -0.491865 -0.025403
C 3.566600 -0.495073 -0.025068
C -3.159213 0.221414 1.122953
C 2.932617 -0.351469 -1.279292
C -2.934888 -0.346974 -1.279946
C 3.159285 0.220012 1.122639
H -1.706134 1.710540 1.854740
H 1.344351 0.679704 -2.349951
H -1.346868 0.684746 -2.350489
H 1.707713 1.711125 1.853570
H -3.691971 0.076005 2.066210
H 3.297588 -0.923052 -2.136333
H -3.301053 -0.917028 -2.137495
H 3.692662 0.075482 2.065685


