*
1
10     DMSO OPLS (ref 18. of JACS(1996)118,4175 and JPCA(2001)105,1702) density=1.08g/cm3
1 16     0.000    0.000    0.000    0.139    0.395   3.56    
2  8     1.045   -0.033   -1.117   -0.459    0.280   2.93     
3  6    -1.612   -0.099   -0.794    0.160    0.160   3.81    
3  6     0.002   -1.631    0.761    0.160    0.160   3.81    
4  1    -2.384   -0.226   -0.035    0.000    0.000   0.00    
4  1    -1.799    0.819   -1.352    0.000    0.000   0.00    
4  1    -1.630   -0.949   -1.476    0.000    0.000   0.00    
4  1    -0.786   -1.683    1.512    0.000    0.000   0.00    
4  1    -0.175   -2.389   -0.003    0.000    0.000   0.00    
4  1     0.967   -1.811    1.234    0.000    0.000   0.00    
$end