COMPND CH3PHCH3.inp.log AUTHOR GENERATED BY OPEN BABEL 2.0.0rc1 HETATM 1 P LIG 1 0.781 0.778 0.038 1.00 0.00 P HETATM 2 C LIG 1 0.843 -0.778 -0.999 1.00 0.00 C HETATM 3 C LIG 1 -0.774 0.463 1.029 1.00 0.00 C HETATM 4 H LIG 1 0.191 1.622 -0.949 1.00 0.00 H HETATM 5 H LIG 1 -0.114 -1.023 -1.469 1.00 0.00 H HETATM 6 H LIG 1 1.150 -1.617 -0.368 1.00 0.00 H HETATM 7 H LIG 1 1.601 -0.658 -1.780 1.00 0.00 H HETATM 8 H LIG 1 -0.564 -0.294 1.791 1.00 0.00 H HETATM 9 H LIG 1 -1.616 0.122 0.418 1.00 0.00 H HETATM 10 H LIG 1 -1.063 1.382 1.548 1.00 0.00 H CONECT 1 2 4 3 CONECT 2 7 5 6 1 CONECT 3 1 9 10 8 CONECT 4 1 CONECT 5 2 CONECT 6 2 CONECT 7 2 CONECT 8 3 CONECT 9 3 CONECT 10 3 MASTER 0 0 0 0 0 0 0 0 10 0 10 0 END