%chk=000081842.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081842

0 1
 S    1.049600       3.018800       1.012500    
 S    2.858700      -2.161800       1.448900    
 O   -3.297500       1.155700      -1.008100    
 C    2.396500       1.844600       1.020100    
 C   7.2999999E-02   2.419700     -0.3525000    
 C    3.186900     -0.4263000       1.211500    
 C   -1.987900       1.555500      -1.215400    
 C    2.134800      0.4895000       1.206000    
 C   -1.246000       2.017300     -0.1432000    
 C    3.703700       2.289900      0.8398000    
 C   0.6278000       2.353600      -1.630600    
 C    4.497500      1.6100001E-02   1.031100    
 C   -1.455400       1.482700      -2.490000    
 C    4.755900       1.374100      0.8452000    
 C  -0.1365000       1.885100      -2.699400    
 C    1.790700      -2.508400      5.8899999E-02
 C   -3.555000      0.3677000      7.1400002E-02
 C    2.253400      -2.304300      -1.238600    
 C   0.4996000      -2.981700      0.2784000    
 C   -2.722300     -0.7134000      0.3603000    
 C   -4.652200      0.6407000      0.8882000    
 C    1.419700      -2.575300      -2.323700    
 C  -0.3342000      -3.252900     -0.8065000    
 C   -2.986600      -1.521500       1.466100    
 C   -4.916600     -0.1673000       1.994100    
 C   0.1260000      -3.049600      -2.107600    
 C   -4.083800      -1.248500       2.282900    
 H    1.113400      0.1467000       1.359700    
 H   -1.679600       2.093800      0.8508000    
 H    3.923700       3.344300      0.6927000    
 H    1.651500       2.667000      -1.819400    
 H    5.330400     -0.6828000       1.031500    
 H   -2.048900       1.117400      -3.322500    
 H    5.776300       1.718500      0.7042000    
 H   0.2952000       1.833900      -3.694700    
 H    3.259800      -1.941100      -1.431200    
 H   0.1261000      -3.147900       1.285500    
 H   -1.873700     -0.9513000     -0.2716000    
 H   -5.304300       1.481500      0.6683000    
 H    1.778000      -2.417800      -3.336700    
 H   -1.339900      -3.627200     -0.6396000    
 H   -2.343100      -2.365900       1.691900    
 H   -5.770900      4.5100000E-02   2.630100    
 H  -0.5231000      -3.261100      -2.952200    
 H   -4.290200      -1.878200       3.143400    


%chk=000081842-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000081842

0 1
S 1.295469 2.691522 1.292315
S 3.868663 -2.252435 0.102060
O -3.206122 1.252983 -1.075267
C 2.819438 1.683288 1.008781
C 0.303867 2.247669 -0.205426
C 3.885627 -0.449919 0.503410
C -1.830830 1.577007 -1.162378
C 2.711980 0.308432 0.698409
C -1.039493 1.854636 -0.021541
C 4.081297 2.297729 1.170243
C 0.856114 2.369442 -1.502924
C 5.161565 0.150404 0.657784
C -1.301211 1.693225 -2.465453
C 5.249410 1.515734 1.003831
C 0.046003 2.088338 -2.625438
C 2.116263 -2.567772 -0.379754
C -3.704745 0.448252 -0.015499
C 1.530816 -1.913628 -1.490216
C 1.389671 -3.543191 0.341775
C -2.973612 -0.630030 0.535612
C -5.028616 0.719292 0.392996
C 0.203466 -2.223441 -1.862530
C 0.069557 -3.866681 -0.052606
C -3.584650 -1.433995 1.523637
C -5.626918 -0.097502 1.377322
C -0.528300 -3.203552 -1.149068
C -4.908061 -1.173440 1.950323
H 1.725197 -0.154023 0.607321
H -1.458391 1.761728 0.984759
H 4.149622 3.364350 1.405110
H 1.896455 2.683812 -1.628624
H 6.071982 -0.439397 0.505379
H -1.946763 1.482575 -3.322999
H 6.234506 1.979590 1.123768
H 0.464331 2.188487 -3.632917
H 2.102195 -1.167010 -2.051508
H 1.850293 -4.036766 1.203539
H -1.955710 -0.846704 0.196605
H -5.565097 1.556279 -0.063728
H -0.253270 -1.703100 -2.711527
H -0.488768 -4.628909 0.502068
H -3.021342 -2.269532 1.954199
H -6.653557 0.110228 1.698275
H -1.553974 -3.447544 -1.447023
H -5.373856 -1.801531 2.716907


