%chk=000176503.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000176503

0 1
 S  -0.5556000       1.985600       0.000000    
 O    3.523900     -2.6200000E-02  6.0000003E-04
 O    2.326200       1.813400     -3.9999999E-04
 N   -2.186100       1.696000     -3.9999999E-04
 N    2.419200      0.5643000      1.9999999E-04
 N   -3.613100     -0.1888000      7.9999998E-04
 C   -1.214100     -0.4595000     -9.9999997E-05
 C  -6.6299997E-02  0.3360000      9.9999997E-05
 C    1.225500     -0.2130000     -1.9999999E-04
 C   -1.058900      -1.863300     -3.9999999E-04
 C   -2.374300      0.3805000       0.000000    
 C    1.349700      -1.604300       0.000000    
 C   0.2238000      -2.420700     -3.0000001E-04
 H   -1.922500      -2.523000     -5.0000002E-04
 H    2.319500      -2.097100      1.9999999E-04
 H   0.3391000      -3.501200     -3.0000001E-04
 H   -3.769500      -1.191800      1.3000000E-03
 H   -4.456900      0.3759000      1.1000000E-03


%chk=000176503-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000176503

0 1
S -0.466878 2.087415 0.000341
O 3.612217 0.013944 0.000211
O 2.271885 1.866985 0.000268
N -2.259808 1.689668 0.000328
N 2.453182 0.579872 -0.000507
N -3.682883 -0.196486 0.000409
C -1.193169 -0.470701 0.000135
C -0.025684 0.351545 0.000007
C 1.248958 -0.257481 -0.000252
C -1.063933 -1.877591 0.000109
C -2.415199 0.353595 0.000284
C 1.379209 -1.662709 -0.000235
C 0.219947 -2.468578 -0.000061
H -1.951056 -2.521202 0.000207
H 2.383251 -2.095450 -0.000408
H 0.318606 -3.557852 -0.000075
H -3.833003 -1.199732 0.000432
H -4.486042 0.427558 0.000506


