%chk=000069096.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000069096

0 1
 S  -0.6724000      -1.217100      3.5000001E-03
 O   -5.809600     -0.6547000      7.6000001E-03
 O   -4.562100       1.242700     -2.1800000E-02
 N    2.610000      -1.705000     -4.8000002E-03
 N    4.244200     -0.1892000     -4.9000001E-03
 N   0.4262000       1.254100      6.8000001E-03
 N    2.809900       1.773600      3.0000000E-03
 C    1.987800     -0.4892000     -6.9999998E-04
 C   -2.120000     -0.1151000      9.3000000E-03
 C   0.6702000     -7.5700000E-02  3.1999999E-03
 C   -3.429700     -0.8913000      1.0500000E-02
 C    3.023300      0.4358000     -8.9999998E-04
 C    3.960300      -1.474100     -7.3000002E-03
 C   -4.633900      2.0199999E-02 -9.8999999E-03
 C    1.495800       2.085000      6.5000001E-03
 H   -2.072600      0.5289000      0.8949000    
 H   -2.074900      0.5311000     -0.8748000    
 H   -3.488600      -1.535000     -0.8749000    
 H   -3.498600      -1.512900      0.9106000    
 H    2.159600      -2.610600     -5.9000002E-03
 H    4.677300      -2.282800     -1.0700000E-02
 H    1.264100       3.144600      9.4999997E-03
 H   -6.580400     -4.8000000E-02  3.7000000E-03


%chk=000069096-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000069096

0 1
S -0.713146 -1.234350 -0.000187
O -5.859298 -0.749944 0.013925
O -4.719763 1.275393 -0.009545
N 2.645936 -1.768035 -0.002851
N 4.327543 -0.208851 -0.000651
N 0.451946 1.274832 0.004114
N 2.851997 1.793835 0.003943
C 2.014201 -0.523748 -0.000147
C -2.173573 -0.025084 0.002123
C 0.679528 -0.061115 0.001390
C -3.460688 -0.860592 0.006060
C 3.079018 0.444692 0.001220
C 4.024031 -1.515853 -0.003048
C -4.693239 0.026671 0.001718
C 1.536272 2.127182 0.005247
H -2.080979 0.613614 0.891954
H -2.085786 0.612145 -0.889229
H -3.516555 -1.526782 -0.875795
H -3.516223 -1.519321 0.893375
H 2.195104 -2.682475 -0.004414
H 4.757844 -2.319314 -0.004965
H 1.296970 3.193971 0.007428
H -6.655239 -0.151571 0.010834


