%chk=000011045.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000011045

0 1
 S    2.435000     -9.3400002E-02 -3.5700001E-02
 O    2.919600       1.164500      0.8820000    
 O    2.824500      -1.310000      0.6537000    
 O    2.841400      0.1609000      -1.405000    
 O   0.8435000      -3.035500      -1.120600    
 O    1.048200       2.940800       1.078900    
 O   0.8615000      -3.037200       1.074600    
 O    1.028500       2.943900      -1.116200    
 O   -4.173000     -0.9862000      2.1500001E-02
 O   -4.105000       1.208000      2.5100000E-02
 N   0.5806000      -2.495900     -2.0300001E-02
 N   0.7335000       2.419700     -1.6700000E-02
 N   -3.531200      9.2100002E-02  1.8100001E-02
 C   0.6763000     -3.8600001E-02 -1.9400001E-02
 C  -5.8300000E-02  -1.224400     -1.4100000E-02
 C   1.6799999E-02   1.190400     -1.2000000E-02
 C   -1.452500      -1.181000     -1.2000001E-03
 C   -1.377300       1.233700      7.9999998E-04
 C   -2.112000      4.8000000E-02  6.3000000E-03
 H   -2.007000      -2.117500      2.7999999E-03
 H   -1.872600       2.202800      6.3000000E-03
 H    3.894400       1.306000      0.9228000    


%chk=000011045-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000011045

0 1
S 2.675150 -0.256362 0.087081
O 2.981816 1.175665 1.213022
O 2.816621 -1.504684 1.084981
O 3.507002 -0.098215 -1.270964
O 1.531192 -2.612340 -1.178475
O 0.135590 3.550621 0.145100
O -0.051493 -3.598807 0.148513
O 1.868136 2.456856 -0.860297
O -4.199838 -1.011839 0.435767
O -4.110643 1.272955 0.462598
N 0.526777 -2.583923 -0.377439
N 0.726799 2.488707 -0.260687
N -3.572573 0.108638 0.371035
C 0.703305 -0.053659 -0.128203
C -0.073022 -1.232166 -0.110405
C 0.025053 1.183065 -0.076745
C -1.467692 -1.201304 0.063582
C -1.372157 1.253486 0.094981
C -2.091066 0.052288 0.176275
H -2.045818 -2.129630 0.101059
H -1.875773 2.222804 0.158012
H 3.377533 1.908945 0.652910


