MgdiOH.mol 5 4 0 0 0 0 0 0 0 0 0 -0.0734 0.1082 0.3031 O 0 0 0 0 0 1.7175 0.0006 -0.0013 MG 0 0 0 0 0 3.5090 -0.1097 -0.3047 O 0 0 0 0 0 4.3232 0.0662 0.1832 H 0 0 0 0 0 -0.8907 -0.0646 -0.1804 H 0 0 0 0 0 1 2 1 0 0 0 1 5 1 0 0 0 2 3 1 0 0 0 3 4 1 0 0 0