%chk=000081131.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081131

0 1
 S    1.299900       2.014700     -4.0000002E-03
 O   -4.234500      -1.914800     -3.9999999E-04
 N   0.7649000      -1.064400     -3.8999999E-03
 C  -0.3691000     -0.2372000     -2.7999999E-03
 C  -0.2687000       1.163000     -2.0000001E-03
 C    2.111400     -0.6683000     -1.8000000E-03
 C    2.489200      0.6838000     -1.2000001E-03
 C   -1.644800     -0.8271000     -1.3000000E-03
 C   -2.798400     -4.3600000E-02  1.5000000E-03
 C   -1.435000       1.944000      8.9999998E-04
 C   -2.693200       1.342500      2.7000001E-03
 C    3.113400      -1.653800     -9.9999997E-05
 C    3.850600       1.025500      1.7000000E-03
 C    4.463700      -1.305400      2.7999999E-03
 C    4.832100      3.5000000E-02  4.3000001E-03
 C   -4.109000     -0.6738000      1.2000001E-03
 C   -5.372500      0.1799000      2.2000000E-03
 H   0.5917000      -2.063200     -4.9999999E-03
 H   -1.720800      -1.913100     -2.2000000E-03
 H   -1.378000       3.030600      1.7000000E-03
 H   -3.561700       1.993500      4.6000001E-03
 H    2.844000      -2.708000     -6.0000003E-04
 H    4.164200       2.067300      2.4000001E-03
 H    5.224900      -2.079900      4.3000001E-03
 H    5.882400      0.3109000      6.8000001E-03
 H   -5.413100      0.7966000     -0.8994000    
 H   -5.412700      0.7948000      0.9050000    
 H   -6.248200     -0.4771000      1.7000000E-03


%chk=000081131-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000081131

0 1
S 1.338166 2.092851 -0.003656
O -4.208040 -1.982339 0.000027
N 0.768583 -1.050537 -0.004110
C -0.364165 -0.215266 -0.002528
C -0.263094 1.207921 -0.001433
C 2.124793 -0.667498 -0.001470
C 2.535442 0.692856 -0.000295
C -1.649784 -0.798556 -0.001882
C -2.828567 -0.009275 -0.000298
C -1.431139 1.998156 0.000531
C -2.709960 1.404120 0.001021
C 3.124235 -1.675588 0.000171
C 3.903950 1.024691 0.002650
C 4.494706 -1.341651 0.002779
C 4.892769 0.012782 0.004134
C -4.152112 -0.714667 0.000049
C -5.432319 0.115725 0.002990
H 0.583641 -2.054107 -0.005277
H -1.770513 -1.889076 -0.002636
H -1.336531 3.089722 0.001542
H -3.598098 2.042363 0.002399
H 2.815900 -2.728729 -0.000602
H 4.202239 2.079335 0.003692
H 5.244913 -2.139238 0.003891
H 5.952483 0.285375 0.006290
H -5.484926 0.768927 -0.887889
H -5.481793 0.767657 0.894981
H -6.298078 -0.563554 0.004029


