PM5 PRECISE XYZ C -0.741 1 -0.227 1 -0.16 1 C 0.458 1 0.657 1 0 1 O 0.465 1 1.856 1 -0.228 1 O 1.55 1 -0.013 1 0.429 1 H -1.002 1 -0.675 1 0.802 1 H -0.534 1 -1.002 1 -0.903 1 H -1.588 1 0.37 1 -0.507 1 H 1.393 1 -0.966 1 0.568 1 Bond info. 1 2 1 1 5 1 1 6 1 1 7 1 2 3 2 2 4 1 4 8 1