@MOLECULE hydridopotassium 2 1 0 0 0 SMALL USER_CHARGES @ATOM 1 H -2.2635 0.0000 -0.0000 H 1 UNL111111 -0.3006 2 K 0.0584 -0.0000 0.0000 K 1 UNL111111 0.3006 @BOND 1 1 2 1