%chk=000129935.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129935

0 1
 S   0.2817000      -2.204200      0.3421000    
 O   -4.003600      -1.360000      0.2640000    
 O  -0.9848000       1.907100     -0.9673000    
 O    1.621400       2.370400       1.035800    
 O    3.074600       1.428500     -0.4579000    
 N  -0.1137000      0.3789000      0.6106000    
 N    3.218200      -1.707100      -1.405900    
 C   -1.870200     -0.3714000     -0.2089000    
 C  -0.8624000     -0.8658000      0.8437000    
 C  -0.9947000      0.9025000     -0.2921000    
 C   -3.311300     -0.1158000      0.1707000    
 C    1.227800      0.1970000      0.3926000    
 C    1.632700      -1.078500      0.2655000    
 C   -4.004200      0.7645000     -0.8622000    
 C    3.001300      -1.616800      1.3200000E-02
 C    2.087100       1.370800      0.2560000    
 H   -1.823500     -0.9303000      -1.156400    
 H   -1.236000     -0.9367000       1.870600    
 H   -3.380800      0.3724000       1.149700    
 H   -5.073400      0.8433000     -0.6372000    
 H   -3.586600       1.774300     -0.8901000    
 H   -3.924300      0.3294000      -1.864700    
 H    3.131100      -2.600100      0.4793000    
 H    3.763200     -0.9711000      0.4630000    
 H   -3.570400      -1.883200      0.9600000    
 H    3.130500     -0.7919000      -1.844800    
 H    2.523200      -2.313100      -1.839300    
 H    2.174900       3.177600      0.9696000    


%chk=000129935-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000129935

0 1
S 0.206934 -2.334853 0.154827
O -4.174065 -1.249061 0.585189
O -1.055370 1.811466 -1.390392
O 1.594440 2.464079 0.695023
O 3.467427 1.197499 0.134757
N -0.136651 0.338083 0.344531
N 3.717951 -1.416530 -1.247183
C -2.058350 -0.353823 -0.332644
C -0.950302 -0.863516 0.645797
C -1.073385 0.829939 -0.636080
C -3.437931 -0.007339 0.265296
C 1.282949 0.143910 0.303948
C 1.645108 -1.190775 0.174529
C -4.309163 0.758917 -0.732864
C 3.044843 -1.782033 0.006468
C 2.225682 1.262747 0.361791
H -2.192069 -1.002755 -1.214757
H -1.217039 -1.002963 1.705664
H -3.290721 0.598252 1.187056
H -5.271825 1.025736 -0.266187
H -3.800744 1.678399 -1.070213
H -4.516937 0.127332 -1.614536
H 2.987559 -2.882281 0.089743
H 3.672851 -1.426344 0.843233
H -3.746093 -1.706797 1.353654
H 4.014478 -0.433945 -1.259608
H 3.230530 -1.709185 -2.099099
H 2.267692 3.196540 0.671655


