D0JJ0T AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 N UNL 1 4.193 0.195 2.306 1.00 0.00 N HETATM 2 C UNL 1 3.945 -0.605 3.613 1.00 0.00 C HETATM 3 N UNL 1 5.062 -0.513 4.769 1.00 0.00 N HETATM 4 C UNL 1 4.698 -0.315 6.344 1.00 0.00 C HETATM 5 C UNL 1 3.352 0.275 0.761 1.00 0.00 C HETATM 6 O UNL 1 2.967 -1.452 3.666 1.00 0.00 O HETATM 7 N UNL 1 5.408 -0.099 7.829 1.00 0.00 N HETATM 8 N UNL 1 4.497 0.658 8.571 1.00 0.00 N HETATM 9 C UNL 1 3.351 0.521 7.954 1.00 0.00 C HETATM 10 C UNL 1 3.422 0.023 6.675 1.00 0.00 C HETATM 11 C UNL 1 2.010 0.984 8.350 1.00 0.00 C HETATM 12 C UNL 1 1.165 0.618 7.091 1.00 0.00 C HETATM 13 C UNL 1 2.124 0.114 5.987 1.00 0.00 C HETATM 14 C UNL 1 6.453 -0.634 8.869 1.00 0.00 C HETATM 15 C UNL 1 1.913 1.160 0.498 1.00 0.00 C HETATM 16 N UNL 1 1.704 1.357 -0.984 1.00 0.00 N HETATM 17 C UNL 1 3.065 1.549 -1.478 1.00 0.00 C HETATM 18 C UNL 1 4.037 0.527 -0.795 1.00 0.00 C HETATM 19 C UNL 1 0.825 2.428 -1.685 1.00 0.00 C HETATM 20 C UNL 1 5.375 1.052 -1.331 1.00 0.00 C HETATM 21 C UNL 1 5.557 1.391 -2.723 1.00 0.00 C HETATM 22 C UNL 1 6.658 2.138 -3.161 1.00 0.00 C HETATM 23 C UNL 1 7.539 2.597 -2.202 1.00 0.00 C HETATM 24 C UNL 1 7.158 2.493 -0.866 1.00 0.00 C HETATM 25 C UNL 1 6.438 1.348 -0.508 1.00 0.00 C HETATM 26 C UNL 1 7.317 0.326 9.513 1.00 0.00 C HETATM 27 C UNL 1 7.859 0.219 10.864 1.00 0.00 C HETATM 28 C UNL 1 7.656 -0.894 11.649 1.00 0.00 C HETATM 29 C UNL 1 6.856 -1.876 11.087 1.00 0.00 C HETATM 30 C UNL 1 6.097 -1.588 9.876 1.00 0.00 C HETATM 31 C UNL 1 -0.731 2.430 -1.580 1.00 0.00 C HETATM 32 C UNL 1 1.298 3.896 -1.465 1.00 0.00 C HETATM 33 O UNL 1 1.448 4.408 -0.358 1.00 0.00 O HETATM 34 O UNL 1 -1.309 3.458 -2.433 1.00 0.00 O HETATM 35 C UNL 1 -2.716 3.627 -2.247 1.00 0.00 C HETATM 36 O UNL 1 1.506 4.536 -2.639 1.00 0.00 O HETATM 37 C UNL 1 1.815 5.969 -2.527 1.00 0.00 C HETATM 38 H UNL 1 5.109 0.632 2.292 1.00 0.00 H HETATM 39 H UNL 1 5.552 -1.426 4.785 1.00 0.00 H HETATM 40 H UNL 1 3.007 -0.769 0.701 1.00 0.00 H HETATM 41 H UNL 1 1.986 2.060 8.543 1.00 0.00 H HETATM 42 H UNL 1 1.637 0.450 9.229 1.00 0.00 H HETATM 43 H UNL 1 0.460 -0.184 7.338 1.00 0.00 H HETATM 44 H UNL 1 0.588 1.472 6.731 1.00 0.00 H HETATM 45 H UNL 1 2.190 0.824 5.161 1.00 0.00 H HETATM 46 H UNL 1 1.811 -0.869 5.638 1.00 0.00 H HETATM 47 H UNL 1 1.943 2.114 1.024 1.00 0.00 H HETATM 48 H UNL 1 1.062 0.556 0.842 1.00 0.00 H HETATM 49 H UNL 1 3.409 2.573 -1.275 1.00 0.00 H HETATM 50 H UNL 1 3.044 1.431 -2.570 1.00 0.00 H HETATM 51 H UNL 1 3.884 -0.434 -1.313 1.00 0.00 H HETATM 52 H UNL 1 0.994 2.266 -2.765 1.00 0.00 H HETATM 53 H UNL 1 4.844 1.095 -3.495 1.00 0.00 H HETATM 54 H UNL 1 6.812 2.376 -4.214 1.00 0.00 H HETATM 55 H UNL 1 8.500 3.024 -2.477 1.00 0.00 H HETATM 56 H UNL 1 6.584 3.404 -0.569 1.00 0.00 H HETATM 57 H UNL 1 7.123 0.472 -0.466 1.00 0.00 H HETATM 58 H UNL 1 7.515 1.274 9.027 1.00 0.00 H HETATM 59 H UNL 1 8.446 1.040 11.302 1.00 0.00 H HETATM 60 H UNL 1 8.069 -0.991 12.661 1.00 0.00 H HETATM 61 H UNL 1 6.756 -2.819 11.626 1.00 0.00 H HETATM 62 H UNL 1 5.013 -1.692 10.082 1.00 0.00 H HETATM 63 H UNL 1 -1.051 2.597 -0.559 1.00 0.00 H HETATM 64 H UNL 1 -1.118 1.473 -1.958 1.00 0.00 H HETATM 65 H UNL 1 -3.086 4.380 -2.955 1.00 0.00 H HETATM 66 H UNL 1 -2.931 3.990 -1.237 1.00 0.00 H HETATM 67 H UNL 1 -3.254 2.694 -2.438 1.00 0.00 H HETATM 68 H UNL 1 2.014 6.326 -3.505 1.00 0.00 H HETATM 69 H UNL 1 2.689 6.087 -1.914 1.00 0.00 H HETATM 70 H UNL 1 0.973 6.461 -2.120 1.00 0.00 H CONECT 1 2 5 38 CONECT 2 1 3 6 CONECT 3 2 4 39 CONECT 4 3 7 10 CONECT 5 1 15 18 40 CONECT 6 2 CONECT 7 4 8 14 CONECT 8 7 9 CONECT 9 8 10 11 CONECT 10 9 4 13 CONECT 11 9 12 41 42 CONECT 12 11 13 43 44 CONECT 13 12 10 45 46 CONECT 14 7 26 30 CONECT 15 5 16 47 48 CONECT 16 15 17 19 CONECT 17 16 18 49 50 CONECT 18 17 5 20 51 CONECT 19 16 31 32 52 CONECT 20 18 21 25 CONECT 21 20 22 53 CONECT 22 21 23 54 CONECT 23 22 24 55 CONECT 24 23 25 56 CONECT 25 24 20 57 CONECT 26 14 27 58 CONECT 27 26 28 59 CONECT 28 27 29 60 CONECT 29 28 30 61 CONECT 30 29 14 62 CONECT 31 19 34 63 64 CONECT 32 19 33 36 CONECT 33 32 CONECT 34 31 35 CONECT 35 34 65 66 67 CONECT 36 32 37 CONECT 37 36 68 69 70 CONECT 38 1 CONECT 39 3 CONECT 40 5 CONECT 41 11 CONECT 42 11 CONECT 43 12 CONECT 44 12 CONECT 45 13 CONECT 46 13 CONECT 47 15 CONECT 48 15 CONECT 49 17 CONECT 50 17 CONECT 51 18 CONECT 52 19 CONECT 53 21 CONECT 54 22 CONECT 55 23 CONECT 56 24 CONECT 57 25 CONECT 58 26 CONECT 59 27 CONECT 60 28 CONECT 61 29 CONECT 62 30 CONECT 63 31 CONECT 64 31 CONECT 65 35 CONECT 66 35 CONECT 67 35 CONECT 68 37 CONECT 69 37 CONECT 70 37 MASTER 0 0 0 0 0 0 0 0 70 0 70 0 END M END $$$$