%chk=000108122.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000108122

0 1
 S   -1.925800       1.236700     -1.1000000E-03
 O    1.020500      0.4062000     -5.0000002E-04
 O    4.513600      0.2401000      1.9000000E-03
 O    3.134500       1.948000       0.000000    
 N   -3.594900     -0.7373000      1.1000000E-03
 N    3.332500      0.6971000      5.0000002E-04
 N   -4.580200       1.412100       0.000000    
 C   0.1080000     -0.6008000     -6.0000003E-04
 C   -1.289900     -0.3542000      6.0000003E-04
 C   0.7377000      -1.823600     -8.9999998E-04
 C    2.246300     -0.1801000     -8.9999998E-04
 C    2.126400      -1.550400     -1.2000001E-03
 C   -2.319800      -1.268200      1.6000000E-03
 C   -3.508900      0.5744000     -3.9999999E-04
 H   0.2724000      -2.799500     -6.9999998E-04
 H    2.934400      -2.268300     -1.1000000E-03
 H   -2.211700      -2.345200      2.3000001E-03
 H   -4.469900       2.420900     -3.0000001E-04
 H   -5.532400       1.061700      1.4000000E-03


%chk=000108122-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000108122

0 1
S -1.895808 1.350183 -0.000295
O 0.997721 0.397844 -0.000193
O 4.578474 0.141855 0.000331
O 3.201613 1.990671 0.000356
N -3.656154 -0.694114 0.000826
N 3.405932 0.711210 -0.000660
N -4.694899 1.455092 0.000258
C 0.096615 -0.688230 -0.000066
C -1.299738 -0.376240 0.000184
C 0.823000 -1.895102 -0.000179
C 2.284038 -0.167583 -0.000439
C 2.209784 -1.559062 -0.000455
C -2.388313 -1.252525 0.000776
C -3.594913 0.641815 0.000308
H 0.397426 -2.895887 -0.000134
H 3.062026 -2.233308 -0.000610
H -2.297545 -2.340032 0.001167
H -4.623101 2.468672 -0.000113
H -5.613360 1.014340 0.000637


