%chk=000127538.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127538

0 1
 S  -0.4977000      0.7117000      -1.363200    
 O  -0.8117000     -5.9700001E-02  -2.550300    
 O  -0.2171000       2.131700      -1.470500    
 O    4.354800       1.624100       1.648400    
 C   0.9049000     -4.1299999E-02 -0.5898000    
 C   -1.847400      0.5294000     -0.2329000    
 C   0.8510000      -1.377100     -0.1685000    
 C   -2.219200     -0.7405000      0.2296000    
 C    2.062300      0.7259000     -0.4152000    
 C    3.186100      0.1603000      0.1830000    
 C  -0.2962000      -2.275700     -0.3555000    
 C   -1.598800      -2.005600     -0.1862000    
 C    2.002200      -1.929700      0.4180000    
 C   -2.531600       1.678400      0.1799000    
 C    3.157400      -1.166600      0.5990000    
 C   -3.314400     -0.8276000       1.105900    
 C    4.417100      0.9783000      0.3827000    
 C   -3.604600       1.567800       1.061500    
 C   -3.997200      0.3163000       1.523900    
 H    2.103700       1.761500     -0.7404000    
 H  -3.3700000E-02  -3.295600     -0.6340000    
 H   -2.298800      -2.825900     -0.3399000    
 H    2.011500      -2.967300      0.7474000    
 H   -2.254500       2.667100     -0.1728000    
 H    4.027200      -1.621900       1.065200    
 H   -3.649000      -1.794100       1.478800    
 H    5.318900      0.3578000      0.3525000    
 H    4.523500       1.740700     -0.3967000    
 H   -4.137500       2.457800       1.383200    
 H   -4.837300      0.2275000       2.206400    
 H    3.490200       2.062400       1.724900    


%chk=000127538-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000127538

0 1
S -0.552339 0.707295 -1.429447
O -0.854763 -0.188839 -2.757625
O -0.262778 2.315750 -1.581206
O 5.285009 0.831478 1.477774
C 0.916630 -0.027838 -0.498553
C -1.973419 0.515550 -0.201691
C 0.884233 -1.382820 -0.082730
C -2.353332 -0.776908 0.244213
C 2.032208 0.811480 -0.374559
C 3.228210 0.292561 0.173320
C -0.276272 -2.285526 -0.109555
C -1.621529 -2.034192 0.024051
C 2.116742 -1.884613 0.441168
C -2.668651 1.694446 0.105707
C 3.255230 -1.070750 0.571027
C -3.559591 -0.829624 1.009821
C 4.471824 1.162505 0.298781
C -3.836622 1.604166 0.893791
C -4.284471 0.333924 1.330988
H 1.953411 1.848515 -0.724675
H -0.001598 -3.348438 -0.149864
H -2.260937 -2.926059 0.072724
H 2.156300 -2.930122 0.768669
H -2.299887 2.648230 -0.287938
H 4.183111 -1.478131 0.985913
H -3.906437 -1.804976 1.370448
H 5.157744 0.985345 -0.548481
H 4.189692 2.235703 0.287522
H -4.400090 2.508469 1.144303
H -5.200578 0.253307 1.925602
H 4.747051 0.990212 2.294907


