%chk=000031178.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031178

0 1
 S   0.9652000      -2.048800      3.9999999E-04
 O   -4.435100      -1.273200     -7.9999998E-04
 C   0.3034000      0.4420000      5.0000002E-04
 C    1.754400      0.4046000      1.9999999E-04
 C  -0.2507000     -0.8390000      6.0000003E-04
 C    2.241900     -0.9033000     -1.9999999E-04
 C  -0.5879000       1.546800      6.9999998E-04
 C   -1.645300      -1.043400      7.9999998E-04
 C   -2.492900      6.5200001E-02  1.0000000E-03
 C    2.701500       1.462100      1.9999999E-04
 C   -1.971200       1.349400      8.9999998E-04
 C    3.624100      -1.179100     -6.0000003E-04
 C    4.072700       1.193600     -5.0000002E-04
 C    4.527500     -0.1157000     -1.0000000E-03
 C   -3.934100     -0.1312000     -3.0000001E-04
 C   -4.873300       1.069900     -1.9000000E-03
 H  -0.1987000       2.562300      5.0000002E-04
 H   -2.040600      -2.055900      6.0000003E-04
 H    2.365800       2.496400      5.0000002E-04
 H   -2.599700       2.234500      7.9999998E-04
 H    3.989000      -2.202500     -6.9999998E-04
 H    4.782800       2.015700     -6.9999998E-04
 H    5.595100     -0.3179000     -1.5000000E-03
 H   -4.721700       1.667800     -0.9043000    
 H   -4.723700       1.668600      0.9002000    
 H   -5.908700      0.7141000     -2.7999999E-03


%chk=000031178-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000031178

0 1
S 0.973475 -2.195140 -0.000112
O -4.468161 -1.320563 -0.000669
C 0.316436 0.437660 -0.000169
C 1.776542 0.397649 -0.000126
C -0.274518 -0.867514 -0.000175
C 2.290811 -0.937596 -0.000098
C -0.540948 1.567039 -0.000190
C -1.662263 -1.055514 -0.000205
C -2.509974 0.084261 -0.000239
C 2.692013 1.481371 -0.000136
C -1.934887 1.391505 -0.000245
C 3.674124 -1.202290 -0.000063
C 4.076731 1.227753 -0.000124
C 4.565596 -0.107083 -0.000078
C -3.996632 -0.144414 -0.000118
C -4.928254 1.063892 -0.000771
H -0.114218 2.575924 -0.000181
H -2.128672 -2.046120 -0.000173
H 2.320803 2.512368 -0.000197
H -2.585433 2.271573 -0.000272
H 4.054032 -2.228899 -0.000048
H 4.784711 2.063299 -0.000147
H 5.645442 -0.290761 -0.000059
H -4.757710 1.696352 -0.891994
H -4.758550 1.696647 0.890397
H -5.970694 0.711600 -0.001207


