%chk=000148814.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148814

0 1
 S   -1.007900       2.048200     -0.2039000    
 S    1.007800       2.048200      0.2039000    
 O   -7.140500     -0.8748000     -0.3757000    
 O    7.140600     -0.8746000      0.3757000    
 O   -5.467500      -1.853000      -1.415700    
 O    5.467600      -1.852900       1.415800    
 N   -3.636800     -0.3033000     -6.0000001E-03
 N    3.636900     -0.3033000      6.0000001E-03
 N   -3.991800       1.259700       1.531300    
 N    3.991900       1.259600      -1.531300    
 N   -5.899800      -1.013000     -0.5753000    
 N    5.899800      -1.012900      0.5754000    
 C   -3.104600      0.6032000      0.8461000    
 C    3.104700      0.6031000     -0.8461000    
 C   -1.616800      0.7958000      0.9507000    
 C    1.616800      0.7957000     -0.9507000    
 C   -4.993000     -0.2257000      0.1425000    
 C    4.993000     -0.2257000     -0.1425000    
 C   -2.918700      -1.182300     -0.9016000    
 C    2.918700      -1.182300      0.9017000    
 C   -5.187600      0.7453000       1.096600    
 C    5.187600      0.7451000      -1.096700    
 H   -1.405400       1.151900       1.966500    
 H   -1.072200     -0.1460000      0.8389000    
 H    1.405300       1.151800      -1.966600    
 H    1.072200     -0.1461000     -0.8389000    
 H   -3.103200      -2.217100     -0.6017000    
 H   -3.248000     -0.9890000      -1.926100    
 H   -1.845000      -1.000700     -0.8703000    
 H    3.103200      -2.217200      0.6019000    
 H    3.248000     -0.9888000       1.926100    
 H    1.845000      -1.000700      0.8703000    
 H   -6.125100       1.105300       1.496400    
 H    6.125100       1.105000      -1.496500    


%chk=000148814-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000148814

0 1
S -1.104172 1.804631 -0.246744
S 1.104167 1.804653 0.246618
O -7.534122 -0.491074 -0.251180
O 7.534143 -0.491298 0.250971
O -6.017919 -1.445632 -1.683782
O 6.017976 -1.445706 1.683712
N -3.893340 -0.295860 -0.136879
N 3.893364 -0.295822 0.136934
N -4.115466 0.915102 1.789817
N 4.115442 0.914946 -1.789891
N -6.324005 -0.731545 -0.639427
N 6.324043 -0.731410 0.639494
C -3.234249 0.375542 0.893506
C 3.234246 0.375467 -0.893509
C -1.758045 0.499256 1.023283
C 1.758038 0.499146 -1.023275
C -5.264926 -0.172171 0.148500
C 5.264943 -0.172135 -0.148475
C -3.254768 -0.982401 -1.279580
C 3.254821 -0.982255 1.279716
C -5.373877 0.576279 1.334860
C 5.373864 0.576184 -1.334921
H -1.526159 0.879185 2.026735
H -1.221966 -0.442887 0.830067
H 1.526133 0.878965 -2.026766
H 1.221975 -0.442983 -0.829950
H -3.399030 -2.071880 -1.206071
H -3.702962 -0.642847 -2.224281
H -2.182988 -0.732879 -1.278151
H 3.399088 -2.071740 1.206312
H 3.703036 -0.642604 2.224373
H 2.183039 -0.732740 1.278288
H -6.284774 0.863573 1.852371
H 6.284749 0.863438 -1.852475


