%chk=000151336.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000151336

0 1
 S   -3.655000     -6.9700003E-02 -0.2676000    
 O   -2.273700      6.2700003E-02  0.5982000    
 O   -4.823400     -4.5400001E-02  0.8706000    
 O    2.856500      -2.683800     -0.3102000    
 O   0.9130000      -2.225900      0.6022000    
 O   -3.792700       1.137400      -1.061100    
 O   -3.684100      -1.370900     -0.9093000    
 N    1.400100      0.5097000      0.3240000    
 N    3.146500       1.560900     -0.5207000    
 N    1.999100      -1.839800      8.0799997E-02
 C   9.3599997E-02  0.3138000      0.9486000    
 C   -1.031800      0.2127000     -7.2300002E-02
 C    1.965200       1.710800      3.6200002E-02
 C    2.253600     -0.4718000     -6.4000003E-02
 C    3.332000      0.2026000     -0.5865000    
 C    1.301100       2.996900      0.3311000    
 H   0.1136000     -0.4999000       1.675600    
 H  -9.5399998E-02   1.188300       1.584500    
 H   -1.067100       1.112700     -0.6959000    
 H  -0.8785000     -0.6459000     -0.7352000    
 H    4.235900     -0.2144000      -1.007600    
 H    1.200200       3.148000       1.410300    
 H    1.894400       3.828500     -6.3400000E-02
 H   0.3111000       3.053300     -0.1306000    
 H   -4.673700     -0.6424000       1.640900    


%chk=000151336-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000151336

0 1
S -3.871365 -0.008707 -0.339301
O -2.328335 0.311012 0.664503
O -4.789051 -0.623299 1.094843
O 2.861939 -2.729035 -0.193815
O 0.761978 -2.253134 0.595729
O -4.598420 1.345116 -0.764746
O -3.543003 -1.160015 -1.411093
N 1.355342 0.555264 0.365606
N 3.250698 1.470496 -0.511361
N 1.932407 -1.895152 0.140126
C 0.009608 0.485234 0.969992
C -1.068339 0.243425 -0.111603
C 2.029871 1.733114 0.038469
C 2.215095 -0.501767 -0.010989
C 3.371623 0.091667 -0.541699
C 1.491559 3.107196 0.281820
H -0.024575 -0.331137 1.704547
H -0.188616 1.442111 1.478300
H -1.042262 1.037887 -0.881403
H -0.946690 -0.752447 -0.571557
H 4.250920 -0.411740 -0.933892
H 1.384911 3.326920 1.360755
H 2.204156 3.828852 -0.144372
H 0.506184 3.266825 -0.192683
H -4.185136 -1.250283 1.592425


