D0V1XY AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 N UNL 1 0.141 0.235 0.000 1.00 0.00 N HETATM 2 C UNL 1 0.141 -0.590 0.000 1.00 0.00 C HETATM 3 C UNL 1 0.856 -1.002 0.000 1.00 0.00 C HETATM 4 N UNL 1 1.570 -0.590 0.000 1.00 0.00 N HETATM 5 C UNL 1 1.570 0.235 0.000 1.00 0.00 C HETATM 6 C UNL 1 0.856 0.648 0.000 1.00 0.00 C HETATM 7 C UNL 1 -0.643 0.490 0.000 1.00 0.00 C HETATM 8 C UNL 1 -1.129 -0.177 0.000 1.00 0.00 C HETATM 9 C UNL 1 -0.643 -0.845 0.000 1.00 0.00 C HETATM 10 C UNL 1 -0.979 1.244 0.000 1.00 0.00 C HETATM 11 C UNL 1 -1.800 1.330 0.000 1.00 0.00 C HETATM 12 C UNL 1 -2.284 0.663 0.000 1.00 0.00 C HETATM 13 C UNL 1 -1.949 -0.091 0.000 1.00 0.00 C HETATM 14 O UNL 1 -0.396 1.827 0.000 1.00 0.00 O HETATM 15 O UNL 1 0.856 1.473 0.000 1.00 0.00 O HETATM 16 C UNL 1 2.284 0.648 0.000 1.00 0.00 C HETATM 17 O UNL 1 2.284 1.473 0.000 1.00 0.00 O HETATM 18 C UNL 1 2.284 -1.002 0.000 1.00 0.00 C HETATM 19 O UNL 1 0.856 -1.827 0.000 1.00 0.00 O HETATM 20 S UNL 1 1.096 0.098 0.000 1.00 0.00 S HETATM 21 S UNL 1 0.735 -0.555 0.000 1.00 0.00 S CONECT 1 2 6 7 CONECT 2 1 3 9 21 CONECT 3 2 4 19 CONECT 4 3 5 18 CONECT 5 4 6 16 20 CONECT 6 5 1 15 CONECT 7 1 8 10 CONECT 8 7 9 13 CONECT 9 8 2 CONECT 10 7 11 14 CONECT 11 10 12 CONECT 12 11 13 CONECT 13 12 8 CONECT 14 10 CONECT 15 6 CONECT 16 5 17 CONECT 17 16 CONECT 18 4 CONECT 19 3 CONECT 20 5 21 CONECT 21 20 2 MASTER 0 0 0 0 0 0 0 0 21 0 21 0 END M END $$$$