%chk=000083414.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083414

0 1
 S   -2.597600     -2.2299999E-02 -0.6883000    
 S    2.586000     -0.3861000      0.5587000    
 S  -0.7571000      -1.091800       2.112800    
 S   0.7945000      0.2352000      -2.392400    
 P   -1.280700      0.3677000      0.9218000    
 P    1.277200      0.8190000     -0.5903000    
 O  -1.3000000E-03   1.190900      0.3441000    
 C   -4.175000     -0.4826000      5.4400001E-02
 C    4.172500     -0.3790000     -0.2985000    
 C   -5.205900     -0.7874000      -1.026800    
 C    5.191300      -1.225900      0.4561000    
 C   -2.067300       1.724800       1.833800    
 C    2.070400       2.451300     -0.6130000    
 C   -6.541900      -1.181500     -0.4142000    
 C    6.534800      -1.232400     -0.2583000    
 H   -4.523000      0.3405000      0.6859000    
 H   -4.022200      -1.357700      0.6939000    
 H    4.526300      0.6533000     -0.3803000    
 H    4.028200     -0.7678000      -1.311400    
 H   -5.358000      8.9299999E-02  -1.668200    
 H   -4.857700      -1.607000      -1.667100    
 H    5.334900     -0.8370000       1.471600    
 H    4.836900      -2.259900      0.5469000    
 H   -2.986900       1.384000       2.317400    
 H   -1.390400       2.105600       2.604500    
 H   -2.312100       2.547100       1.155100    
 H    2.995000       2.424500      -1.196200    
 H    1.399300       3.191400      -1.059100    
 H    2.307400       2.772400      0.4056000    
 H   -6.942100     -0.3740000      0.2071000    
 H   -7.270800      -1.397200      -1.201800    
 H   -6.439500      -2.076200      0.2081000    
 H    6.940900     -0.2190000     -0.3394000    
 H    7.254900      -1.843700      0.2946000    
 H    6.440700      -1.647200      -1.267100    


%chk=000083414-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000083414

0 1
S -3.131345 1.284231 0.728813
S 3.105595 1.463772 0.126875
S -0.395340 -0.907501 1.931109
S 0.418868 0.284123 -2.135323
P -1.021378 1.043077 1.600577
P 1.016494 1.744612 -0.787281
O -0.022762 2.094056 0.595267
C -3.484563 -0.503938 0.181642
C 3.475152 -0.329032 -0.395446
C -3.382898 -0.693624 -1.339080
C 3.361943 -1.323950 0.768848
C -1.056119 2.176839 3.073709
C 1.073260 3.494206 -1.413609
C -3.703892 -2.154963 -1.731312
C 3.702310 -2.757862 0.299263
H -4.497054 -0.715719 0.568434
H -2.758444 -1.144688 0.722467
H 4.493027 -0.287627 -0.821596
H 2.760574 -0.570149 -1.208737
H -4.081216 -0.004730 -1.851549
H -2.362853 -0.428608 -1.672557
H 4.043599 -1.024536 1.587685
H 2.334170 -1.292087 1.174007
H -1.724975 1.743635 3.832424
H -0.032581 2.267247 3.467865
H -1.429949 3.162013 2.755025
H 1.763012 3.535856 -2.269862
H 0.058049 3.787254 -1.721119
H 1.430516 4.150356 -0.605170
H -4.728886 -2.441882 -1.428561
H -3.625023 -2.287787 -2.825299
H -2.997266 -2.858824 -1.254062
H 4.733418 -2.821506 -0.097437
H 3.618710 -3.470255 1.139620
H 3.009547 -3.090710 -0.495635


