metals/minimizer/thiols.md

molecule{
  name = "S";
  
  atom[0]{
    type = "S";
    position( 0.0, 0.0, 0.0 );
  }
}

 
Revision:	1253
Committed:	Thu Jun 5 15:54:47 2008 UTC (17 years, 2 months ago) by chuckv
File size:	94 byte(s)
Log Message:	Added model for thiols.