%chk=000126266.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126266

0 1
 S    3.299400       1.117500       0.000000    
 O   -4.105900      1.4300000E-02  8.9999998E-04
 N   0.6166000       1.308500     -1.9999999E-04
 N    1.348400     -0.7901000      3.0000001E-04
 C  -0.5107000      0.5278000     -3.0000001E-04
 C  -2.7600000E-02 -0.7777000       0.000000    
 C    1.701000      0.4759000      9.9999997E-05
 C   -1.870200      0.8419000     -6.0000003E-04
 C  -0.9404000      -1.845800      9.9999997E-05
 C   -2.764700     -0.2334000     -7.9999998E-04
 C   -2.310300      -1.554200     -3.0000001E-04
 C    4.298100     -0.4006000      1.9999999E-04
 C    5.777300     -6.5200001E-02  9.9999997E-05
 C   -4.510900       1.381100      5.0000002E-04
 H   0.6424000       2.319400     -3.9999999E-04
 H   -2.156600       1.885400     -6.0000003E-04
 H  -0.5972000      -2.875400      5.0000002E-04
 H   -3.025100      -2.373700      9.9999997E-05
 H    4.056100     -0.9942000      0.8879000    
 H    4.056200     -0.9944000     -0.8873000    
 H    6.059500      0.5086000     -0.8892000    
 H    6.059500      0.5089000      0.8893000    
 H    6.368600     -0.9870000      1.9999999E-04
 H   -4.186800       1.898500      0.9099000    
 H   -5.605900       1.393300      1.1000000E-03
 H   -4.187800       1.897600     -0.9098000    


%chk=000126266-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000126266

0 1
S 3.446227 1.203561 -0.000047
O -4.164155 -0.043009 0.000365
N 0.656873 1.414769 0.000020
N 1.415566 -0.743025 0.000132
C -0.496250 0.610083 0.000159
C -0.002499 -0.735817 0.000197
C 1.764076 0.549187 0.000060
C -1.869719 0.930727 0.000226
C -0.920572 -1.811105 0.000310
C -2.761913 -0.169046 0.000326
C -2.294720 -1.518291 0.000358
C 4.383642 -0.454012 -0.000006
C 5.889903 -0.169628 -0.000098
C -4.720361 1.308785 -0.000142
H 0.692878 2.432332 -0.000058
H -2.223596 1.964910 0.000207
H -0.562628 -2.844772 0.000346
H -3.044687 -2.314459 0.000424
H 4.050775 -1.003800 0.893412
H 4.050685 -1.003894 -0.893332
H 6.198097 0.397788 -0.896077
H 6.198189 0.397877 0.895793
H 6.440439 -1.128148 -0.000079
H -4.416073 1.872289 0.904612
H -5.811548 1.171904 -0.000360
H -4.415630 1.871796 -0.905051


