D04JLF AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 -0.498 1.742 1.394 1.00 0.00 C HETATM 2 N UNL 1 -0.452 0.406 1.098 1.00 0.00 N HETATM 3 C UNL 1 -1.369 -0.649 1.590 1.00 0.00 C HETATM 4 C UNL 1 -2.850 -0.518 1.135 1.00 0.00 C HETATM 5 C UNL 1 -3.664 -1.122 2.304 1.00 0.00 C HETATM 6 N UNL 1 -2.796 -1.154 3.481 1.00 0.00 N HETATM 7 C UNL 1 -1.422 -0.799 3.137 1.00 0.00 C HETATM 8 N UNL 1 -3.219 -1.067 -0.213 1.00 0.00 N HETATM 9 C UNL 1 -4.279 -0.480 -0.872 1.00 0.00 C HETATM 10 C UNL 1 -4.647 -0.743 -2.302 1.00 0.00 C HETATM 11 O UNL 1 -4.962 0.406 -0.308 1.00 0.00 O HETATM 12 C UNL 1 -6.013 -0.690 -2.692 1.00 0.00 C HETATM 13 C UNL 1 -6.366 -0.604 -4.048 1.00 0.00 C HETATM 14 C UNL 1 -5.377 -0.611 -5.028 1.00 0.00 C HETATM 15 C UNL 1 -4.039 -0.697 -4.659 1.00 0.00 C HETATM 16 C UNL 1 -3.667 -0.688 -3.305 1.00 0.00 C HETATM 17 N UNL 1 -0.989 2.337 2.458 1.00 0.00 N HETATM 18 C UNL 1 -0.820 3.730 2.376 1.00 0.00 C HETATM 19 C UNL 1 -0.182 4.185 1.221 1.00 0.00 C HETATM 20 S UNL 1 0.302 2.823 0.293 1.00 0.00 S HETATM 21 C UNL 1 -1.250 4.703 3.310 1.00 0.00 C HETATM 22 C UNL 1 -1.114 6.076 3.030 1.00 0.00 C HETATM 23 C UNL 1 -0.523 6.493 1.844 1.00 0.00 C HETATM 24 C UNL 1 -0.015 5.560 0.936 1.00 0.00 C HETATM 25 CL UNL 1 -0.443 8.173 1.477 1.00 0.00 Cl HETATM 26 C UNL 1 -3.316 -1.206 4.773 1.00 0.00 C HETATM 27 O UNL 1 -2.371 -1.350 5.751 1.00 0.00 O HETATM 28 O UNL 1 -4.517 -1.129 5.004 1.00 0.00 O HETATM 29 C UNL 1 -2.651 -0.819 7.074 1.00 0.00 C HETATM 30 C UNL 1 -3.440 -1.576 8.141 1.00 0.00 C HETATM 31 C UNL 1 -2.939 -1.783 9.443 1.00 0.00 C HETATM 32 C UNL 1 -3.765 -2.311 10.451 1.00 0.00 C HETATM 33 C UNL 1 -5.123 -2.460 10.212 1.00 0.00 C HETATM 34 C UNL 1 -5.649 -1.915 9.050 1.00 0.00 C HETATM 35 C UNL 1 -4.793 -1.844 7.952 1.00 0.00 C HETATM 36 O UNL 1 -6.982 -0.786 -1.722 1.00 0.00 O HETATM 37 C UNL 1 -8.097 0.097 -1.852 1.00 0.00 C HETATM 38 O UNL 1 -2.342 -0.596 -2.966 1.00 0.00 O HETATM 39 C UNL 1 -1.678 0.512 -3.583 1.00 0.00 C HETATM 40 H UNL 1 -0.122 0.214 0.154 1.00 0.00 H HETATM 41 H UNL 1 -0.975 -1.594 1.189 1.00 0.00 H HETATM 42 H UNL 1 -3.074 0.552 1.090 1.00 0.00 H HETATM 43 H UNL 1 -3.973 -2.153 2.101 1.00 0.00 H HETATM 44 H UNL 1 -4.563 -0.530 2.503 1.00 0.00 H HETATM 45 H UNL 1 -0.762 -1.611 3.471 1.00 0.00 H HETATM 46 H UNL 1 -1.145 0.106 3.684 1.00 0.00 H HETATM 47 H UNL 1 -3.017 -2.035 -0.453 1.00 0.00 H HETATM 48 H UNL 1 -7.404 -0.516 -4.358 1.00 0.00 H HETATM 49 H UNL 1 -5.646 -0.530 -6.079 1.00 0.00 H HETATM 50 H UNL 1 -3.278 -0.711 -5.436 1.00 0.00 H HETATM 51 H UNL 1 -1.717 4.389 4.241 1.00 0.00 H HETATM 52 H UNL 1 -1.492 6.809 3.740 1.00 0.00 H HETATM 53 H UNL 1 0.466 5.887 0.019 1.00 0.00 H HETATM 54 H UNL 1 -3.110 0.173 6.969 1.00 0.00 H HETATM 55 H UNL 1 -1.659 -0.628 7.501 1.00 0.00 H HETATM 56 H UNL 1 -1.895 -1.596 9.677 1.00 0.00 H HETATM 57 H UNL 1 -3.363 -2.586 11.423 1.00 0.00 H HETATM 58 H UNL 1 -5.782 -2.959 10.916 1.00 0.00 H HETATM 59 H UNL 1 -6.050 -0.896 9.284 1.00 0.00 H HETATM 60 H UNL 1 -5.054 -2.470 7.093 1.00 0.00 H HETATM 61 H UNL 1 -7.914 0.958 -2.505 1.00 0.00 H HETATM 62 H UNL 1 -8.338 0.482 -0.855 1.00 0.00 H HETATM 63 H UNL 1 -8.966 -0.463 -2.211 1.00 0.00 H HETATM 64 H UNL 1 -0.745 0.146 -4.022 1.00 0.00 H HETATM 65 H UNL 1 -1.438 1.252 -2.814 1.00 0.00 H HETATM 66 H UNL 1 -2.250 1.021 -4.367 1.00 0.00 H CONECT 1 2 17 20 CONECT 2 1 3 40 CONECT 3 4 7 2 41 CONECT 4 3 5 8 42 CONECT 5 4 6 43 44 CONECT 6 5 7 26 CONECT 7 6 3 45 46 CONECT 8 9 4 47 CONECT 9 8 10 11 CONECT 10 9 12 16 CONECT 11 9 CONECT 12 10 13 36 CONECT 13 12 14 48 CONECT 14 13 15 49 CONECT 15 14 16 50 CONECT 16 15 10 38 CONECT 17 1 18 CONECT 18 17 19 21 CONECT 19 18 20 24 CONECT 20 19 1 CONECT 21 18 22 51 CONECT 22 21 23 52 CONECT 23 22 24 25 CONECT 24 23 19 53 CONECT 25 23 CONECT 26 6 27 28 CONECT 27 26 29 CONECT 28 26 CONECT 29 27 30 54 55 CONECT 30 29 31 35 CONECT 31 30 32 56 CONECT 32 31 33 57 CONECT 33 32 34 58 CONECT 34 33 35 59 CONECT 35 34 30 60 CONECT 36 12 37 CONECT 37 36 61 62 63 CONECT 38 16 39 CONECT 39 38 64 65 66 CONECT 40 2 CONECT 41 3 CONECT 42 4 CONECT 43 5 CONECT 44 5 CONECT 45 7 CONECT 46 7 CONECT 47 8 CONECT 48 13 CONECT 49 14 CONECT 50 15 CONECT 51 21 CONECT 52 22 CONECT 53 24 CONECT 54 29 CONECT 55 29 CONECT 56 31 CONECT 57 32 CONECT 58 33 CONECT 59 34 CONECT 60 35 CONECT 61 37 CONECT 62 37 CONECT 63 37 CONECT 64 39 CONECT 65 39 CONECT 66 39 MASTER 0 0 0 0 0 0 0 0 66 0 66 0 END M END $$$$