%chk=000051625.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051625

0 1
 S   -1.170600     -0.9430000      2.8300000E-02
 O    1.678000      -1.655000       1.512200    
 O    3.499600      -1.243400      -1.536600    
 O    2.112100       2.361100      0.2111000    
 O   -4.806200      0.3762000     -0.1868000    
 O   -3.991400      -1.664500     -8.7800004E-02
 N    1.204600      0.1617000      0.1127000    
 N    3.460800      0.4485000      4.8200000E-02
 N  -0.7224000       1.602400     -2.2399999E-02
 N   -3.820600     -0.4122000     -0.1154000    
 C    1.797800      -1.171700      0.1802000    
 C    3.265600     -0.9578000     -0.1668000    
 C    2.238700       1.145400      0.1341000    
 C  -0.1339000      0.4264000      4.0199999E-02
 C   -2.522400      0.1082000     -6.7000002E-02
 C   -2.089800       1.417700     -8.4100001E-02
 H    1.323800      -1.870600     -0.5171000    
 H    3.967200      -1.522900      0.4536000    
 H    4.365900      0.9075000      2.7899999E-02
 H    2.114900      -2.523100       1.546500    
 H    3.339600      -2.193700      -1.666800    
 H   -2.729300       2.289100     -0.1406000    


%chk=000051625-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000051625

0 1
S -1.208701 -1.161766 -0.059317
O 1.797425 -1.816694 1.413074
O 3.766725 -1.309394 -1.537835
O 2.119991 2.427762 0.053439
O -4.856458 0.501852 -0.009118
O -4.147391 -1.686337 -0.096040
N 1.265801 0.155095 0.042020
N 3.493742 0.497464 -0.026829
N -0.736256 1.515014 0.066483
N -3.931787 -0.405576 -0.042366
C 1.871565 -1.195495 0.105286
C 3.383618 -0.933289 -0.174957
C 2.290464 1.199325 0.022916
C -0.093601 0.351733 0.024577
C -2.567797 0.035335 -0.014928
C -2.108634 1.347414 0.037112
H 1.427099 -1.833192 -0.684131
H 3.980100 -1.486496 0.574481
H 4.374765 0.998869 -0.123228
H 0.871914 -2.111958 1.614790
H 4.154980 -2.220783 -1.540990
H -2.765563 2.217417 0.059163


