gopenmol.cube

来自「已经编译好的levoo程序」· CUBE 代码 · 共 10 行

 cube format gOpenMol input file for the density
created by lev00 on: Wed Jul 27 14:43:42 BST 2005            
    2   -0.944863   -0.944863   -0.944863
    1    1.889726    0.000000    0.000000
    1    0.000000    1.889726    0.000000
    1    0.000000    0.000000    1.889726
   12    0.000000    0.000000    0.000000    0.000000
    8    0.000000    3.968424    3.968424    3.968424
  0.63120E-01