LiH2+.mol 3 1 0 0 0 0 0 0 0 0 0 -0.6145 -0.1032 0.0000 LI 0 0 0 0 0 1.6757 -0.0967 0.0000 H 0 0 0 0 0 1.5492 0.6512 0.0000 H 0 0 0 0 0 2 3 1 0 0 0 1