D0CR2E AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 S UNL 1 -0.027 0.667 0.000 1.00 0.00 S HETATM 2 N UNL 1 -0.240 -0.129 0.000 1.00 0.00 N HETATM 3 C UNL 1 0.452 -0.579 0.000 1.00 0.00 C HETATM 4 N UNL 1 1.093 -0.059 0.000 1.00 0.00 N HETATM 5 C UNL 1 0.797 0.711 0.000 1.00 0.00 C HETATM 6 C UNL 1 -1.010 -0.425 0.000 1.00 0.00 C HETATM 7 C UNL 1 -1.807 -0.211 0.000 1.00 0.00 C HETATM 8 C UNL 1 -1.807 0.614 0.000 1.00 0.00 C HETATM 9 C UNL 1 -2.522 1.026 0.000 1.00 0.00 C HETATM 10 C UNL 1 -3.236 0.614 0.000 1.00 0.00 C HETATM 11 C UNL 1 -3.236 -0.211 0.000 1.00 0.00 C HETATM 12 C UNL 1 -2.522 -0.624 0.000 1.00 0.00 C HETATM 13 C UNL 1 1.807 -0.472 0.000 1.00 0.00 C HETATM 14 C UNL 1 2.522 -0.059 0.000 1.00 0.00 C HETATM 15 O UNL 1 1.246 1.403 0.000 1.00 0.00 O HETATM 16 O UNL 1 0.495 -1.403 0.000 1.00 0.00 O HETATM 17 O UNL 1 3.236 -0.472 0.000 1.00 0.00 O CONECT 1 2 5 CONECT 2 1 3 6 CONECT 3 2 4 16 CONECT 4 3 5 13 CONECT 5 4 1 15 CONECT 6 2 7 CONECT 7 6 8 12 CONECT 8 7 9 CONECT 9 8 10 CONECT 10 9 11 CONECT 11 10 12 CONECT 12 11 7 CONECT 13 4 14 CONECT 14 13 17 CONECT 15 5 CONECT 16 3 CONECT 17 14 MASTER 0 0 0 0 0 0 0 0 17 0 17 0 END M END $$$$