%chk=000147019.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147019

0 1
 S    3.241200      -1.707600     -0.1705000    
 O    3.304600     -0.3383000      0.7370000    
 O    2.482400       2.902100     -0.4596000    
 O    4.434500      -2.613800      0.4725000    
 O    3.611900      -1.411100      -1.542200    
 O    1.986700      -2.377700      0.1177000    
 N    2.440700      0.6925000      0.2945000    
 C   -1.707000      0.1780000      8.3200000E-02
 C    1.027600      0.5169000      0.2225000    
 C   -3.141100     -7.9999998E-04  9.3000000E-03
 C   -1.065800       1.044200     -0.8021000    
 C  -0.9660000     -0.5170000       1.039100    
 C   0.3168000       1.215500     -0.7317000    
 C   0.4167000     -0.3456000       1.109500    
 C   -3.985700      0.8238000      0.7526000    
 C   -3.678800     -0.9970000     -0.8055000    
 C    3.054500       1.884900     -6.5099999E-02
 C   -5.368000      0.6520000      0.6813000    
 C   -5.061300      -1.168700     -0.8768000    
 C   -5.905800     -0.3441000     -0.1334000    
 C    4.562100       1.912000      6.7599997E-02
 H   -1.627300       1.581700      -1.562800    
 H   -1.451500      -1.188600       1.743200    
 H   0.7722000       1.845800      -1.486300    
 H   0.9685000     -0.8599000       1.890900    
 H   -3.583000       1.605400       1.392700    
 H   -3.034800      -1.648300      -1.391700    
 H   -6.025800       1.293900       1.260000    
 H   -5.480300      -1.944300      -1.511200    
 H   -6.982200     -0.4779000     -0.1890000    
 H    4.939700       2.896700     -0.2237000    
 H    5.010200       1.161200     -0.5888000    
 H    4.851300       1.722500       1.105000    
 H    4.445900      -2.658500       1.457400    


%chk=000147019-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000147019

0 1
S 3.805130 -1.804992 -0.999157
O 2.842434 -0.468013 1.805327
O 2.643086 2.445482 -0.169026
O 5.610609 -1.220687 -0.844164
O 2.980127 -0.259049 -1.119805
O 3.699980 -2.454685 -2.483970
N 2.333520 0.284475 0.883153
C -1.898019 0.086598 0.253878
C 0.913655 0.229633 0.630912
C -3.368654 0.020898 0.059109
C -1.053552 0.708678 -0.714237
C -1.283331 -0.478152 1.412089
C 0.335679 0.782786 -0.544360
C 0.102909 -0.416356 1.602469
C -4.054040 1.036972 -0.666767
C -4.130969 -1.058226 0.591947
C 3.218139 1.499014 0.377799
C -5.450110 0.977565 -0.851241
C -5.526192 -1.120697 0.401795
C -6.193337 -0.102389 -0.319323
C 4.644304 1.390096 0.825623
H -1.488595 1.096061 -1.640595
H -1.905632 -0.934886 2.187720
H 0.971803 1.206056 -1.320595
H 0.572792 -0.836801 2.495699
H -3.496695 1.894893 -1.058393
H -3.625703 -1.871721 1.124204
H -5.959728 1.775200 -1.402315
H -6.092450 -1.966110 0.807118
H -7.277837 -0.150301 -0.465308
H 5.163098 2.316497 0.537415
H 5.142441 0.519585 0.356719
H 4.697617 1.249225 1.919347
H 5.930624 -1.046749 -1.777466


