COMPND asn.inp.log AUTHOR GENERATED BY OPEN BABEL 2.0.0rc1 HETATM 1 N LIG 1 -0.747 1.499 0.840 1.00 0.00 N HETATM 2 C LIG 1 0.311 0.492 0.972 1.00 0.00 C HETATM 3 C LIG 1 1.458 0.588 -0.041 1.00 0.00 C HETATM 4 O LIG 1 2.571 0.152 0.144 1.00 0.00 O HETATM 5 O LIG 1 1.085 1.199 -1.191 1.00 0.00 O HETATM 6 C LIG 1 -0.280 -0.941 0.934 1.00 0.00 C HETATM 7 C LIG 1 -0.994 -1.260 -0.380 1.00 0.00 C HETATM 8 O LIG 1 -0.462 -1.888 -1.283 1.00 0.00 O HETATM 9 N LIG 1 -2.277 -0.786 -0.455 1.00 0.00 N HETATM 10 H LIG 1 -0.406 2.398 1.170 1.00 0.00 H HETATM 11 H LIG 1 -0.965 1.630 -0.146 1.00 0.00 H HETATM 12 H LIG 1 0.782 0.612 1.952 1.00 0.00 H HETATM 13 H LIG 1 -0.975 -1.031 1.775 1.00 0.00 H HETATM 14 H LIG 1 0.524 -1.671 1.051 1.00 0.00 H HETATM 15 H LIG 1 1.847 1.137 -1.792 1.00 0.00 H HETATM 16 H LIG 1 -2.597 -0.096 0.210 1.00 0.00 H HETATM 17 H LIG 1 -2.747 -0.861 -1.346 1.00 0.00 H CONECT 1 11 2 10 CONECT 2 3 1 6 12 CONECT 3 5 4 2 CONECT 4 3 CONECT 5 15 3 CONECT 6 7 2 14 13 CONECT 7 8 9 6 CONECT 8 7 CONECT 9 17 7 16 CONECT 10 1 CONECT 11 1 CONECT 12 2 CONECT 13 6 CONECT 14 6 CONECT 15 5 CONECT 16 9 CONECT 17 9 MASTER 0 0 0 0 0 0 0 0 17 0 17 0 END