diamond                                 
   1.0000000000000000     
     1.7809307797928542   -1.7809307797928542    0.0000000000000000
     1.7809307797928542    0.0000000000000000    1.7809307797928546
     0.0000000000000000   -1.7809307797928542    1.7809307797928535
  C             
     2
Direct
     0.0000000000000000    0.0000000000000000    0.0000000000000000
     0.7500000000000002    0.7499999999999998    0.7499999999999999
