DL_POLY TEST CASE 1
CUTOFF 8.0
UNITS ev
NCONFIGS 1
ATOMS 3
Mn core 1.0  2.0
Mg core 1.0  2.0
O  core 1.0 -2.0
MOLTYPES 1
MgO
MAXATOM 512
finish
VDW 3
O core  O core buck   22764.3 0.1490 20.370
Mg core O core buck    700.3  0.3372 0.00000
Mn core O core buck    1007.4 0.3262 0.000000
CLOSE
