D03TWD AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 -4.426 1.808 0.000 1.00 0.00 C HETATM 2 C UNL 1 -4.426 0.983 0.000 1.00 0.00 C HETATM 3 C UNL 1 -3.712 0.570 0.000 1.00 0.00 C HETATM 4 C UNL 1 -2.998 0.983 0.000 1.00 0.00 C HETATM 5 C UNL 1 -2.998 1.808 0.000 1.00 0.00 C HETATM 6 C UNL 1 -3.712 2.220 0.000 1.00 0.00 C HETATM 7 O UNL 1 -5.141 2.220 0.000 1.00 0.00 O HETATM 8 C UNL 1 -5.855 1.808 0.000 1.00 0.00 C HETATM 9 C UNL 1 -5.855 0.983 0.000 1.00 0.00 C HETATM 10 O UNL 1 -5.141 0.570 0.000 1.00 0.00 O HETATM 11 C UNL 1 -2.283 0.570 0.000 1.00 0.00 C HETATM 12 C UNL 1 -2.283 -0.255 0.000 1.00 0.00 C HETATM 13 C UNL 1 -1.569 -0.667 0.000 1.00 0.00 C HETATM 14 C UNL 1 -0.854 -0.255 0.000 1.00 0.00 C HETATM 15 C UNL 1 -0.854 0.570 0.000 1.00 0.00 C HETATM 16 C UNL 1 -1.569 0.983 0.000 1.00 0.00 C HETATM 17 C UNL 1 -1.569 1.808 0.000 1.00 0.00 C HETATM 18 C UNL 1 -0.140 0.983 0.000 1.00 0.00 C HETATM 19 O UNL 1 0.575 0.570 0.000 1.00 0.00 O HETATM 20 C UNL 1 1.289 0.983 0.000 1.00 0.00 C HETATM 21 C UNL 1 2.004 0.570 0.000 1.00 0.00 C HETATM 22 C UNL 1 2.718 0.983 0.000 1.00 0.00 C HETATM 23 C UNL 1 2.718 1.808 0.000 1.00 0.00 C HETATM 24 C UNL 1 2.004 2.220 0.000 1.00 0.00 C HETATM 25 C UNL 1 1.289 1.808 0.000 1.00 0.00 C HETATM 26 O UNL 1 3.433 0.570 0.000 1.00 0.00 O HETATM 27 C UNL 1 3.433 -0.255 0.000 1.00 0.00 C HETATM 28 C UNL 1 2.718 -0.667 0.000 1.00 0.00 C HETATM 29 C UNL 1 3.433 2.220 0.000 1.00 0.00 C HETATM 30 N UNL 1 4.147 1.808 0.000 1.00 0.00 N HETATM 31 C UNL 1 2.004 -0.255 0.000 1.00 0.00 C HETATM 32 C UNL 1 1.289 -0.667 0.000 1.00 0.00 C HETATM 33 C UNL 1 1.289 -1.492 0.000 1.00 0.00 C HETATM 34 C UNL 1 2.004 -1.905 0.000 1.00 0.00 C HETATM 35 C UNL 1 2.718 -1.492 0.000 1.00 0.00 C HETATM 36 CL UNL 1 0.575 2.220 0.000 1.00 0.00 Cl HETATM 37 C UNL 1 4.233 0.987 0.000 1.00 0.00 C HETATM 38 C UNL 1 5.040 0.816 0.000 1.00 0.00 C HETATM 39 C UNL 1 5.453 1.530 0.000 1.00 0.00 C HETATM 40 C UNL 1 4.901 2.143 0.000 1.00 0.00 C HETATM 41 O UNL 1 5.376 0.062 0.000 1.00 0.00 O HETATM 42 C UNL 1 2.003 -2.727 0.000 1.00 0.00 C HETATM 43 N UNL 1 1.178 -2.727 0.000 1.00 0.00 N HETATM 44 C UNL 1 5.272 2.727 0.000 1.00 0.00 C HETATM 45 O UNL 1 5.855 2.144 0.000 1.00 0.00 O HETATM 46 O UNL 1 4.487 2.472 0.000 1.00 0.00 O CONECT 1 2 6 7 CONECT 2 1 3 10 CONECT 3 2 4 CONECT 4 3 5 11 CONECT 5 4 6 CONECT 6 5 1 CONECT 7 1 8 CONECT 8 7 9 CONECT 9 8 10 CONECT 10 9 2 CONECT 11 4 12 16 CONECT 12 11 13 CONECT 13 12 14 CONECT 14 13 15 CONECT 15 14 16 18 CONECT 16 15 11 17 CONECT 17 16 CONECT 18 15 19 CONECT 19 18 20 CONECT 20 19 21 25 CONECT 21 20 22 CONECT 22 21 23 26 CONECT 23 22 24 29 CONECT 24 23 25 CONECT 25 24 20 36 CONECT 26 22 27 CONECT 27 26 28 CONECT 28 27 31 35 CONECT 29 23 30 CONECT 30 29 37 40 CONECT 31 28 32 CONECT 32 31 33 CONECT 33 32 34 CONECT 34 33 35 42 CONECT 35 34 28 CONECT 36 25 CONECT 37 30 38 CONECT 38 37 39 41 CONECT 39 38 40 CONECT 40 39 30 44 CONECT 41 38 CONECT 42 34 43 CONECT 43 42 CONECT 44 40 45 46 CONECT 45 44 CONECT 46 44 MASTER 0 0 0 0 0 0 0 0 46 0 46 0 END $$$$