D01JEH AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNK A 1 -5.908 -2.517 0.000 1.00 0.00 C HETATM 2 C UNK A 1 -6.121 -3.313 0.000 1.00 0.00 C HETATM 3 N UNK A 1 -5.429 -3.763 0.000 1.00 0.00 N HETATM 4 C UNK A 1 -4.788 -3.244 0.000 1.00 0.00 C HETATM 5 C UNK A 1 -5.084 -2.474 0.000 1.00 0.00 C HETATM 6 C UNK A 1 -5.429 -4.588 0.000 1.00 0.00 C HETATM 7 O UNK A 1 -4.715 -5.000 0.000 1.00 0.00 O HETATM 8 C UNK A 1 -6.144 -5.000 0.000 1.00 0.00 C HETATM 9 N UNK A 1 -6.144 -5.825 0.000 1.00 0.00 N HETATM 10 C UNK A 1 -6.858 -4.588 0.000 1.00 0.00 C HETATM 11 C UNK A 1 -7.655 -4.374 0.000 1.00 0.00 C HETATM 12 C UNK A 1 -7.072 -3.791 0.000 1.00 0.00 C HETATM 13 C UNK A 1 -7.573 -5.000 0.000 1.00 0.00 C HETATM 14 C UNK A 1 -6.858 -6.238 0.000 1.00 0.00 C HETATM 15 O UNK A 1 -7.573 -5.825 0.000 1.00 0.00 O HETATM 16 C UNK A 1 -6.858 -7.063 0.000 1.00 0.00 C HETATM 17 N UNK A 1 -7.573 -7.475 0.000 1.00 0.00 N HETATM 18 C ACE A 0 -7.573 -8.300 0.000 1.00 0.00 C HETATM 19 C UNK A 1 -6.144 -7.475 0.000 1.00 0.00 C HETATM 20 C UNK A 1 -3.991 -3.457 0.000 1.00 0.00 C HETATM 21 O UNK A 1 -3.991 -4.282 0.000 1.00 0.00 O HETATM 22 N UNK A 2 -3.337 -2.955 0.000 1.00 0.00 N HETATM 23 C UNK A 2 -2.574 -3.271 0.000 1.00 0.00 C HETATM 24 C UNK A 2 -1.920 -2.768 0.000 1.00 0.00 C HETATM 25 N UNK A 3 -1.158 -3.084 0.000 1.00 0.00 N HETATM 26 O UNK A 2 -1.920 -1.943 0.000 1.00 0.00 O HETATM 27 C UNK A 2 -2.574 -4.096 0.000 1.00 0.00 C HETATM 28 C UNK A 2 -1.860 -4.508 0.000 1.00 0.00 C HETATM 29 C UNK A 2 -1.860 -5.333 0.000 1.00 0.00 C HETATM 30 C UNK A 2 -1.145 -5.746 0.000 1.00 0.00 C HETATM 31 C UNK A 2 -0.431 -5.333 0.000 1.00 0.00 C HETATM 32 C UNK A 2 -0.431 -4.508 0.000 1.00 0.00 C HETATM 33 C UNK A 2 -1.145 -4.096 0.000 1.00 0.00 C HETATM 34 C UNK A 2 -1.145 -6.571 0.000 1.00 0.00 C HETATM 35 C UNK A 2 -0.431 -6.983 0.000 1.00 0.00 C HETATM 36 C UNK A 2 0.283 -6.571 0.000 1.00 0.00 C HETATM 37 C UNK A 2 0.283 -5.746 0.000 1.00 0.00 C HETATM 38 C UNK A 3 -0.361 -2.871 0.000 1.00 0.00 C HETATM 39 C UNK A 3 0.223 -3.454 0.000 1.00 0.00 C HETATM 40 C UNK A 3 -0.361 -2.046 0.000 1.00 0.00 C HETATM 41 C UNK A 3 0.354 -1.633 0.000 1.00 0.00 C HETATM 42 C UNK A 3 1.068 -2.046 0.000 1.00 0.00 C HETATM 43 C UNK A 3 1.783 -1.633 0.000 1.00 0.00 C HETATM 44 C UNK A 3 1.783 -0.808 0.000 1.00 0.00 C HETATM 45 C UNK A 3 1.068 -0.396 0.000 1.00 0.00 C HETATM 46 C UNK A 3 0.354 -0.808 0.000 1.00 0.00 C HETATM 47 O UNK A 3 0.223 -4.279 0.000 1.00 0.00 O HETATM 48 O UNK A 3 0.985 -3.138 0.000 1.00 0.00 O HETATM 49 O UNK A 3 2.497 -0.396 0.000 1.00 0.00 O HETATM 50 C UNK A 3 2.497 0.429 0.000 1.00 0.00 C HETATM 51 C UNK A 3 3.212 0.842 0.000 1.00 0.00 C HETATM 52 N UNK A 3 3.795 0.259 0.000 1.00 0.00 N HETATM 53 N UNK A 3 4.530 0.633 0.000 1.00 0.00 N HETATM 54 N UNK A 1 4.401 1.448 0.000 1.00 0.00 N HETATM 55 C UNK A 3 3.586 1.577 0.000 1.00 0.00 C HETATM 56 C UNK A 1 4.984 2.031 0.000 1.00 0.00 C HETATM 57 C UNK A 1 5.809 2.031 0.000 1.00 0.00 C HETATM 58 C UNK A 1 6.064 2.816 0.000 1.00 0.00 C HETATM 59 N UNK A 1 5.397 3.301 0.000 1.00 0.00 N HETATM 60 C UNK A 1 4.729 2.816 0.000 1.00 0.00 C HETATM 61 C UNK A 1 5.452 4.122 0.000 1.00 0.00 C HETATM 62 O UNK A 1 4.654 4.330 0.000 1.00 0.00 O HETATM 63 C UNK A 1 6.032 4.710 0.000 1.00 0.00 C HETATM 64 N UNK A 1 5.812 5.505 0.000 1.00 0.00 N HETATM 65 C UNK A 1 6.830 4.502 0.000 1.00 0.00 C HETATM 66 C UNK A 1 7.655 4.508 0.000 1.00 0.00 C HETATM 67 C UNK A 1 7.409 5.089 0.000 1.00 0.00 C HETATM 68 C UNK A 1 6.391 6.093 0.000 1.00 0.00 C HETATM 69 O UNK A 1 7.190 5.885 0.000 1.00 0.00 O HETATM 70 C UNK A 1 6.172 6.888 0.000 1.00 0.00 C HETATM 71 N UNK A 1 6.752 7.475 0.000 1.00 0.00 N HETATM 72 C UNK A 1 5.374 7.096 0.000 1.00 0.00 C HETATM 73 C UNK A 1 7.242 3.787 0.000 1.00 0.00 C HETATM 74 C ACE A 0 6.752 8.300 0.000 1.00 0.00 C HETATM 75 C UNK A 1 4.010 2.709 0.000 1.00 0.00 C HETATM 76 O UNK A 1 4.046 3.533 0.000 1.00 0.00 O HETATM 77 N UNK A 2 3.333 2.236 0.000 1.00 0.00 N HETATM 78 C UNK A 2 2.586 2.586 0.000 1.00 0.00 C HETATM 79 C UNK A 2 1.910 2.113 0.000 1.00 0.00 C HETATM 80 N UNK A 3 1.162 2.463 0.000 1.00 0.00 N HETATM 81 O UNK A 2 1.873 1.289 0.000 1.00 0.00 O HETATM 82 C UNK A 2 2.623 3.410 0.000 1.00 0.00 C HETATM 83 C UNK A 2 1.928 3.854 0.000 1.00 0.00 C HETATM 84 C UNK A 2 1.964 4.678 0.000 1.00 0.00 C HETATM 85 C UNK A 2 1.269 5.122 0.000 1.00 0.00 C HETATM 86 C UNK A 2 0.537 4.742 0.000 1.00 0.00 C HETATM 87 C UNK A 2 0.500 3.918 0.000 1.00 0.00 C HETATM 88 C UNK A 2 1.195 3.474 0.000 1.00 0.00 C HETATM 89 C UNK A 2 1.306 5.946 0.000 1.00 0.00 C HETATM 90 C UNK A 2 0.611 6.390 0.000 1.00 0.00 C HETATM 91 C UNK A 2 -0.121 6.010 0.000 1.00 0.00 C HETATM 92 C UNK A 2 -0.158 5.186 0.000 1.00 0.00 C HETATM 93 C UNK A 3 0.357 2.285 0.000 1.00 0.00 C HETATM 94 C UNK A 3 -0.200 2.894 0.000 1.00 0.00 C HETATM 95 C UNK A 3 0.320 1.461 0.000 1.00 0.00 C HETATM 96 C UNK A 3 -0.412 1.081 0.000 1.00 0.00 C HETATM 97 C UNK A 3 -1.108 1.525 0.000 1.00 0.00 C HETATM 98 C UNK A 3 -1.840 1.145 0.000 1.00 0.00 C HETATM 99 C UNK A 3 -1.877 0.320 0.000 1.00 0.00 C HETATM 100 C UNK A 3 -1.181 -0.124 0.000 1.00 0.00 C HETATM 101 C UNK A 3 -0.449 0.257 0.000 1.00 0.00 C HETATM 102 O UNK A 3 -0.163 3.718 0.000 1.00 0.00 O HETATM 103 O UNK A 3 -0.976 2.613 0.000 1.00 0.00 O HETATM 104 O UNK A 3 -2.609 -0.060 0.000 1.00 0.00 O HETATM 105 C UNK A 3 -2.646 -0.884 0.000 1.00 0.00 C HETATM 106 C UNK A 3 -3.378 -1.264 0.000 1.00 0.00 C HETATM 107 N UNK A 3 -3.935 -0.655 0.000 1.00 0.00 N HETATM 108 N UNK A 3 -4.686 -0.997 0.000 1.00 0.00 N HETATM 109 N UNK A 1 -4.593 -1.816 0.000 1.00 0.00 N HETATM 110 C UNK A 3 -3.785 -1.982 0.000 1.00 0.00 C CONECT 1 2 5 CONECT 2 1 3 CONECT 3 2 4 6 CONECT 4 3 5 20 CONECT 5 4 1 109 CONECT 6 3 7 8 CONECT 7 6 CONECT 8 6 9 10 CONECT 9 8 14 CONECT 10 8 11 12 13 CONECT 11 10 CONECT 12 10 CONECT 13 10 CONECT 14 9 15 16 CONECT 15 14 CONECT 16 14 17 19 CONECT 17 16 18 CONECT 18 17 CONECT 19 16 CONECT 20 4 21 22 CONECT 21 20 CONECT 22 20 23 CONECT 23 22 24 27 CONECT 24 23 25 26 CONECT 25 24 38 CONECT 26 24 CONECT 27 23 28 CONECT 28 27 29 33 CONECT 29 28 30 CONECT 30 29 31 34 CONECT 31 30 32 37 CONECT 32 31 33 CONECT 33 32 28 CONECT 34 30 35 CONECT 35 34 36 CONECT 36 35 37 CONECT 37 36 31 CONECT 38 25 39 40 CONECT 39 38 47 48 CONECT 40 38 41 CONECT 41 40 42 46 CONECT 42 41 43 CONECT 43 42 44 CONECT 44 43 45 49 CONECT 45 44 46 CONECT 46 45 41 CONECT 47 39 CONECT 48 39 CONECT 49 44 50 CONECT 50 49 51 CONECT 51 50 52 55 CONECT 52 51 53 CONECT 53 52 54 CONECT 54 53 55 56 CONECT 55 54 51 CONECT 56 54 57 60 CONECT 57 56 58 CONECT 58 57 59 CONECT 59 58 60 61 CONECT 60 59 56 75 CONECT 61 62 63 59 CONECT 62 61 CONECT 63 61 64 65 CONECT 64 63 68 CONECT 65 63 66 67 73 CONECT 66 65 CONECT 67 65 CONECT 68 64 69 70 CONECT 69 68 CONECT 70 68 71 72 CONECT 71 70 74 CONECT 72 70 CONECT 73 65 CONECT 74 71 CONECT 75 76 77 60 CONECT 76 75 CONECT 77 75 78 CONECT 78 77 79 82 CONECT 79 78 80 81 CONECT 80 79 93 CONECT 81 79 CONECT 82 78 83 CONECT 83 82 84 88 CONECT 84 83 85 CONECT 85 84 86 89 CONECT 86 85 87 92 CONECT 87 86 88 CONECT 88 87 83 CONECT 89 85 90 CONECT 90 89 91 CONECT 91 90 92 CONECT 92 91 86 CONECT 93 80 94 95 CONECT 94 93 102 103 CONECT 95 93 96 CONECT 96 95 97 101 CONECT 97 96 98 CONECT 98 97 99 CONECT 99 98 100 104 CONECT 100 99 101 CONECT 101 100 96 CONECT 102 94 CONECT 103 94 CONECT 104 99 105 CONECT 105 104 106 CONECT 106 105 107 110 CONECT 107 106 108 CONECT 108 107 109 CONECT 109 108 110 5 CONECT 110 109 106 MASTER 0 0 0 0 0 0 0 0 110 0 110 0 END M END $$$$