COMPND C5H10NH.inp.log AUTHOR GENERATED BY OPEN BABEL 2.0.0rc1 HETATM 1 N LIG 1 -0.193 1.462 0.054 1.00 0.00 N HETATM 2 C LIG 1 0.277 0.774 1.259 1.00 0.00 C HETATM 3 C LIG 1 0.284 0.826 -1.177 1.00 0.00 C HETATM 4 C LIG 1 -0.242 -0.611 -1.254 1.00 0.00 C HETATM 5 C LIG 1 -0.248 -0.665 1.273 1.00 0.00 C HETATM 6 C LIG 1 0.170 -1.407 -0.007 1.00 0.00 C HETATM 7 H LIG 1 0.108 2.432 0.077 1.00 0.00 H HETATM 8 H LIG 1 -0.091 1.323 2.134 1.00 0.00 H HETATM 9 H LIG 1 1.384 0.750 1.332 1.00 0.00 H HETATM 10 H LIG 1 -0.079 1.412 -2.029 1.00 0.00 H HETATM 11 H LIG 1 1.392 0.805 -1.245 1.00 0.00 H HETATM 12 H LIG 1 0.131 -1.095 -2.166 1.00 0.00 H HETATM 13 H LIG 1 -1.337 -0.582 -1.326 1.00 0.00 H HETATM 14 H LIG 1 0.125 -1.189 2.162 1.00 0.00 H HETATM 15 H LIG 1 -1.344 -0.641 1.343 1.00 0.00 H HETATM 16 H LIG 1 -0.263 -2.414 -0.030 1.00 0.00 H HETATM 17 H LIG 1 1.263 -1.531 -0.007 1.00 0.00 H CONECT 1 3 7 2 CONECT 2 1 5 9 8 CONECT 3 10 4 11 1 CONECT 4 12 13 3 6 CONECT 5 6 2 15 14 CONECT 6 4 16 17 5 CONECT 7 1 CONECT 8 2 CONECT 9 2 CONECT 10 3 CONECT 11 3 CONECT 12 4 CONECT 13 4 CONECT 14 5 CONECT 15 5 CONECT 16 6 CONECT 17 6 MASTER 0 0 0 0 0 0 0 0 17 0 17 0 END