%chk=000094374.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094374

0 1
 S    2.658800     -0.2572000      8.2999999E-03
 S   -2.661100     -0.2570000     -1.0000000E-03
 O   5.5000000E-03 -7.0000000E-02  1.6000000E-03
 O    2.695500     -0.9314000       1.292300    
 O    2.707600      -1.014300      -1.228100    
 O   -2.722500      -1.014100      -1.237000    
 O   -2.687800     -0.9357000       1.281000    
 C    1.179400      0.7350000     -3.1500001E-02
 C   -1.174700      0.7229000     -4.9600001E-02
 C    3.890100      0.9570000     -2.5500000E-02
 C   -3.890200      0.9596000     -1.7000001E-02
 C    5.160800      0.5501000     -6.0000001E-03
 C   -5.161400      0.5551000      1.2600000E-02
 H    1.201700       1.322600     -0.9552000    
 H    1.200300       1.394200      0.8425000    
 H   -1.193800       1.299400     -0.9805000    
 H   -1.200900       1.396700      0.8135000    
 H    3.630300       2.008100     -6.1299998E-02
 H   -3.628200       2.010100     -5.0600000E-02
 H    5.964800       1.278100     -2.6000001E-02
 H    5.434500     -0.4989000      2.9899999E-02
 H   -5.964100       1.284700      3.5999999E-03
 H   -5.436900     -0.4934000      4.6000000E-02


%chk=000094374-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000094374

0 1
S 2.693392 -0.338880 -0.007219
S -2.693393 -0.335853 0.041736
O 0.000231 0.179266 0.016359
O 2.706505 -1.134834 1.413848
O 2.681969 -1.143095 -1.423810
O -2.691294 -1.231092 -1.319131
O -2.698410 -1.037141 1.511903
C 1.194486 0.969088 -0.001237
C -1.193414 0.968089 -0.042973
C 4.130532 0.922054 -0.023063
C -4.129544 0.923126 -0.047991
C 5.397503 0.472589 -0.029665
C -5.396904 0.475632 -0.019306
H 1.333070 1.548825 -0.934743
H 1.349469 1.562412 0.920887
H -1.335347 1.489277 -1.009787
H -1.343916 1.617287 0.841590
H 3.803351 1.968036 -0.025496
H -3.801446 1.966347 -0.119840
H 6.240699 1.173577 -0.038989
H 5.635240 -0.597224 -0.025985
H -6.239542 1.175558 -0.069487
H -5.635536 -0.591444 0.054397


