D00QJA AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 -0.614 -0.848 0.673 1.00 0.00 C HETATM 2 C UNL 1 -1.543 -0.304 1.597 1.00 0.00 C HETATM 3 C UNL 1 -2.636 0.343 1.045 1.00 0.00 C HETATM 4 C UNL 1 -2.545 0.459 -0.334 1.00 0.00 C HETATM 5 C UNL 1 -2.377 -0.819 -0.893 1.00 0.00 C HETATM 6 C UNL 1 -1.118 -1.269 -0.569 1.00 0.00 C HETATM 7 C UNL 1 -3.596 -1.786 -0.925 1.00 0.00 C HETATM 8 C UNL 1 -1.505 1.726 -0.712 1.00 0.00 C HETATM 9 N UNL 1 -1.345 2.215 -2.152 1.00 0.00 N HETATM 10 C UNL 1 -2.762 2.330 -2.329 1.00 0.00 C HETATM 11 C UNL 1 -1.302 6.320 -6.220 1.00 0.00 C HETATM 12 C UNL 1 -1.667 5.323 -5.247 1.00 0.00 C HETATM 13 C UNL 1 -2.965 4.149 -4.906 1.00 0.00 C HETATM 14 C UNL 1 -3.743 2.787 -3.925 1.00 0.00 C HETATM 15 C UNL 1 -3.780 1.698 -2.618 1.00 0.00 C HETATM 16 C UNL 1 -3.627 -3.170 -0.599 1.00 0.00 C HETATM 17 C UNL 1 -4.883 -3.842 -0.408 1.00 0.00 C HETATM 18 C UNL 1 -6.125 -3.227 -0.595 1.00 0.00 C HETATM 19 C UNL 1 -6.105 -1.916 -1.042 1.00 0.00 C HETATM 20 C UNL 1 -4.881 -1.228 -1.166 1.00 0.00 C HETATM 21 C UNL 1 -7.380 -3.992 -0.304 1.00 0.00 C HETATM 22 N UNL 1 -8.586 -3.328 -0.386 1.00 0.00 N HETATM 23 O UNL 1 -7.329 -5.182 0.032 1.00 0.00 O HETATM 24 C UNL 1 -3.992 4.610 -6.076 1.00 0.00 C HETATM 25 C UNL 1 -5.279 4.909 -5.634 1.00 0.00 C HETATM 26 C UNL 1 -6.270 3.996 -5.962 1.00 0.00 C HETATM 27 C UNL 1 -5.947 2.945 -6.832 1.00 0.00 C HETATM 28 C UNL 1 -4.866 3.109 -7.694 1.00 0.00 C HETATM 29 C UNL 1 -3.915 4.070 -7.379 1.00 0.00 C HETATM 30 C UNL 1 -9.885 -4.005 -0.421 1.00 0.00 C HETATM 31 C UNL 1 -10.430 -4.418 0.950 1.00 0.00 C HETATM 32 CL UNL 1 -0.479 5.187 -3.938 1.00 0.00 Cl HETATM 33 C UNL 1 -3.339 4.822 -8.572 1.00 0.00 C HETATM 34 C UNL 1 -2.444 -4.076 -0.372 1.00 0.00 C HETATM 35 C UNL 1 -11.849 -4.917 0.793 1.00 0.00 C HETATM 36 O UNL 1 -12.639 -4.493 -0.034 1.00 0.00 O HETATM 37 O UNL 1 -12.202 -5.855 1.698 1.00 0.00 O HETATM 38 C UNL 1 -6.615 1.611 -6.719 1.00 0.00 C HETATM 39 F UNL 1 -7.082 1.367 -5.462 1.00 0.00 F HETATM 40 F UNL 1 -7.662 1.439 -7.564 1.00 0.00 F HETATM 41 F UNL 1 -5.750 0.584 -6.980 1.00 0.00 F HETATM 42 C UNL 1 0.861 -0.527 0.796 1.00 0.00 C HETATM 43 F UNL 1 1.062 0.507 1.667 1.00 0.00 F HETATM 44 F UNL 1 1.611 -1.536 1.211 1.00 0.00 F HETATM 45 F UNL 1 1.378 -0.082 -0.394 1.00 0.00 F HETATM 46 H UNL 1 -1.340 -0.226 2.660 1.00 0.00 H HETATM 47 H UNL 1 -3.349 0.912 1.628 1.00 0.00 H HETATM 48 H UNL 1 -0.514 -1.820 -1.282 1.00 0.00 H HETATM 49 H UNL 1 -0.511 1.554 -0.302 1.00 0.00 H HETATM 50 H UNL 1 -1.915 2.571 -0.123 1.00 0.00 H HETATM 51 H UNL 1 -0.959 3.162 -2.110 1.00 0.00 H HETATM 52 H UNL 1 -1.041 7.035 -6.917 1.00 0.00 H HETATM 53 H UNL 1 -4.679 2.553 -4.475 1.00 0.00 H HETATM 54 H UNL 1 -4.041 0.699 -2.900 1.00 0.00 H HETATM 55 H UNL 1 -4.873 -4.885 -0.082 1.00 0.00 H HETATM 56 H UNL 1 -7.010 -1.367 -1.276 1.00 0.00 H HETATM 57 H UNL 1 -4.981 -0.179 -1.412 1.00 0.00 H HETATM 58 H UNL 1 -8.605 -2.363 -0.677 1.00 0.00 H HETATM 59 H UNL 1 -5.439 5.609 -4.819 1.00 0.00 H HETATM 60 H UNL 1 -7.193 3.983 -5.387 1.00 0.00 H HETATM 61 H UNL 1 -4.780 2.512 -8.600 1.00 0.00 H HETATM 62 H UNL 1 -9.802 -4.885 -1.062 1.00 0.00 H HETATM 63 H UNL 1 -10.579 -3.311 -0.906 1.00 0.00 H HETATM 64 H UNL 1 -10.446 -3.571 1.644 1.00 0.00 H HETATM 65 H UNL 1 -9.801 -5.204 1.380 1.00 0.00 H HETATM 66 H UNL 1 -3.444 4.238 -9.500 1.00 0.00 H HETATM 67 H UNL 1 -2.280 5.060 -8.468 1.00 0.00 H HETATM 68 H UNL 1 -3.902 5.752 -8.747 1.00 0.00 H HETATM 69 H UNL 1 -1.480 -3.654 -0.632 1.00 0.00 H HETATM 70 H UNL 1 -2.551 -4.968 -1.001 1.00 0.00 H HETATM 71 H UNL 1 -2.413 -4.398 0.675 1.00 0.00 H HETATM 72 H UNL 1 -11.487 -6.119 2.308 1.00 0.00 H CONECT 1 2 6 42 CONECT 2 1 3 46 CONECT 3 2 4 47 CONECT 4 3 5 8 CONECT 5 4 6 7 CONECT 6 5 1 48 CONECT 7 5 16 20 CONECT 8 4 9 49 50 CONECT 9 8 10 51 CONECT 10 9 11 15 CONECT 11 10 12 52 CONECT 12 11 13 32 CONECT 13 12 14 24 CONECT 14 13 15 53 CONECT 15 14 10 54 CONECT 16 7 17 34 CONECT 17 16 18 55 CONECT 18 17 19 21 CONECT 19 18 20 56 CONECT 20 19 7 57 CONECT 21 18 22 23 CONECT 22 21 30 58 CONECT 23 21 CONECT 24 13 25 29 CONECT 25 24 26 59 CONECT 26 25 27 60 CONECT 27 26 28 38 CONECT 28 27 29 61 CONECT 29 28 24 33 CONECT 30 22 31 62 63 CONECT 31 30 35 64 65 CONECT 32 12 CONECT 33 29 66 67 68 CONECT 34 16 69 70 71 CONECT 35 31 36 37 CONECT 36 35 CONECT 37 35 72 CONECT 38 27 39 40 41 CONECT 39 38 CONECT 40 38 CONECT 41 38 CONECT 42 1 43 44 45 CONECT 43 42 CONECT 44 42 CONECT 45 42 CONECT 46 2 CONECT 47 3 CONECT 48 6 CONECT 49 8 CONECT 50 8 CONECT 51 9 CONECT 52 11 CONECT 53 14 CONECT 54 15 CONECT 55 17 CONECT 56 19 CONECT 57 20 CONECT 58 22 CONECT 59 25 CONECT 60 26 CONECT 61 28 CONECT 62 30 CONECT 63 30 CONECT 64 31 CONECT 65 31 CONECT 66 33 CONECT 67 33 CONECT 68 33 CONECT 69 34 CONECT 70 34 CONECT 71 34 CONECT 72 37 MASTER 0 0 0 0 0 0 0 0 72 0 72 0 END M END $$$$