D00PLP AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 -0.928 2.141 0.624 1.00 0.00 C HETATM 2 C UNL 1 0.449 1.877 0.259 1.00 0.00 C HETATM 3 N UNL 1 0.926 2.387 -0.960 1.00 0.00 N HETATM 4 C UNL 1 2.396 2.387 -0.960 1.00 0.00 C HETATM 5 O UNL 1 1.205 1.319 1.067 1.00 0.00 O HETATM 6 C UNL 1 5.277 6.951 -2.973 1.00 0.00 C HETATM 7 C UNL 1 4.557 5.810 -2.470 1.00 0.00 C HETATM 8 C UNL 1 5.161 4.726 -1.749 1.00 0.00 C HETATM 9 C UNL 1 4.433 3.685 -1.186 1.00 0.00 C HETATM 10 C UNL 1 3.116 3.528 -1.463 1.00 0.00 C HETATM 11 O UNL 1 6.562 4.715 -1.653 1.00 0.00 O HETATM 12 C UNL 1 7.097 3.649 -0.831 1.00 0.00 C HETATM 13 C UNL 1 8.625 3.608 -0.778 1.00 0.00 C HETATM 14 N UNL 1 9.197 4.772 -0.110 1.00 0.00 N HETATM 15 C UNL 1 3.211 6.382 -2.032 1.00 0.00 C HETATM 16 C UNL 1 1.886 6.267 -2.454 1.00 0.00 C HETATM 17 C UNL 1 1.120 6.634 -1.320 1.00 0.00 C HETATM 18 N UNL 1 1.874 7.211 -0.379 1.00 0.00 N HETATM 19 N UNL 1 3.059 7.354 -1.021 1.00 0.00 N HETATM 20 C UNL 1 3.589 8.707 -1.056 1.00 0.00 C HETATM 21 CL UNL 1 1.233 5.586 -3.859 1.00 0.00 Cl HETATM 22 C UNL 1 -1.440 2.080 1.913 1.00 0.00 C HETATM 23 C UNL 1 -2.828 2.320 1.937 1.00 0.00 C HETATM 24 C UNL 1 -3.351 2.567 0.690 1.00 0.00 C HETATM 25 S UNL 1 -2.140 2.511 -0.520 1.00 0.00 S HETATM 26 BR UNL 1 -3.821 2.295 3.542 1.00 0.00 Br HETATM 27 H UNL 1 0.419 3.145 -1.394 1.00 0.00 H HETATM 28 H UNL 1 5.793 7.769 -3.334 1.00 0.00 H HETATM 29 H UNL 1 4.872 2.926 -0.548 1.00 0.00 H HETATM 30 H UNL 1 2.552 4.105 -2.155 1.00 0.00 H HETATM 31 H UNL 1 6.796 2.681 -1.255 1.00 0.00 H HETATM 32 H UNL 1 6.718 3.752 0.196 1.00 0.00 H HETATM 33 H UNL 1 9.034 3.522 -1.788 1.00 0.00 H HETATM 34 H UNL 1 8.923 2.713 -0.215 1.00 0.00 H HETATM 35 H UNL 1 8.941 5.605 -0.641 1.00 0.00 H HETATM 36 H UNL 1 10.213 4.708 -0.137 1.00 0.00 H HETATM 37 H UNL 1 0.067 6.505 -1.121 1.00 0.00 H HETATM 38 H UNL 1 2.805 9.395 -0.714 1.00 0.00 H HETATM 39 H UNL 1 3.823 8.979 -2.089 1.00 0.00 H HETATM 40 H UNL 1 4.457 8.775 -0.406 1.00 0.00 H HETATM 41 H UNL 1 -0.822 1.857 2.779 1.00 0.00 H HETATM 42 H UNL 1 -4.383 2.749 0.430 1.00 0.00 H CONECT 1 2 22 25 CONECT 2 1 3 5 CONECT 3 2 4 27 CONECT 4 3 6 10 CONECT 5 2 CONECT 6 4 7 28 CONECT 7 6 8 15 CONECT 8 7 9 11 CONECT 9 8 10 29 CONECT 10 9 4 30 CONECT 11 8 12 CONECT 12 11 13 31 32 CONECT 13 12 14 33 34 CONECT 14 13 35 36 CONECT 15 7 16 19 CONECT 16 15 17 21 CONECT 17 16 18 37 CONECT 18 17 19 CONECT 19 18 15 20 CONECT 20 19 38 39 40 CONECT 21 16 CONECT 22 1 23 41 CONECT 23 22 24 26 CONECT 24 23 25 42 CONECT 25 24 1 CONECT 26 23 CONECT 27 3 CONECT 28 6 CONECT 29 9 CONECT 30 10 CONECT 31 12 CONECT 32 12 CONECT 33 13 CONECT 34 13 CONECT 35 14 CONECT 36 14 CONECT 37 17 CONECT 38 20 CONECT 39 20 CONECT 40 20 CONECT 41 22 CONECT 42 24 MASTER 0 0 0 0 0 0 0 0 42 0 42 0 END M END $$$$