@MOLECULE beryllium hydride 3 2 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 BE 0.0000 -0.0001 0.0000 Be 1 UNL1 0.2461 2 H 1.2824 0.0006 -0.0000 H 1 UNL1 -0.1231 3 H -1.2824 0.0006 -0.0000 H 1 UNL1 -0.1231 @BOND 1 1 2 1 2 1 3 1