D08UPQ AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 -7.712 3.494 0.000 1.00 0.00 C HETATM 2 N UNL 1 -6.997 3.907 0.000 1.00 0.00 N HETATM 3 C UNL 1 -6.283 3.494 0.000 1.00 0.00 C HETATM 4 C UNL 1 -5.569 3.907 0.000 1.00 0.00 C HETATM 5 N UNL 1 -4.854 3.494 0.000 1.00 0.00 N HETATM 6 C UNL 1 -4.140 3.907 0.000 1.00 0.00 C HETATM 7 C UNL 1 -3.425 3.494 0.000 1.00 0.00 C HETATM 8 N UNL 1 -2.711 3.907 0.000 1.00 0.00 N HETATM 9 C UNL 1 -4.140 4.732 0.000 1.00 0.00 C HETATM 10 C UNL 1 -3.425 5.144 0.000 1.00 0.00 C HETATM 11 C UNL 1 -4.854 5.144 0.000 1.00 0.00 C HETATM 12 C UNL 1 -4.140 5.557 0.000 1.00 0.00 C HETATM 13 O UNL 1 -3.425 2.669 0.000 1.00 0.00 O HETATM 14 C UNL 1 -6.283 2.669 0.000 1.00 0.00 C HETATM 15 O UNL 1 -5.569 4.732 0.000 1.00 0.00 O HETATM 16 C UNL 1 -1.996 3.494 0.000 1.00 0.00 C HETATM 17 C UNL 1 -1.282 3.907 0.000 1.00 0.00 C HETATM 18 C UNL 1 -1.282 4.732 0.000 1.00 0.00 C HETATM 19 C UNL 1 -1.996 5.144 0.000 1.00 0.00 C HETATM 20 C UNL 1 -2.711 4.732 0.000 1.00 0.00 C HETATM 21 C UNL 1 -0.567 5.144 0.000 1.00 0.00 C HETATM 22 C UNL 1 -0.567 5.969 0.000 1.00 0.00 C HETATM 23 C UNL 1 -1.282 6.382 0.000 1.00 0.00 C HETATM 24 C UNL 1 -1.996 5.969 0.000 1.00 0.00 C HETATM 25 C UNL 1 -1.996 2.669 0.000 1.00 0.00 C HETATM 26 O UNL 1 -2.711 2.257 0.000 1.00 0.00 O HETATM 27 N UNL 1 -1.282 2.257 0.000 1.00 0.00 N HETATM 28 C UNL 1 -0.567 2.669 0.000 1.00 0.00 C HETATM 29 C UNL 1 -1.282 1.432 0.000 1.00 0.00 C HETATM 30 C UNL 1 0.147 2.257 0.000 1.00 0.00 C HETATM 31 C UNL 1 0.147 1.432 0.000 1.00 0.00 C HETATM 32 C UNL 1 0.862 1.019 0.000 1.00 0.00 C HETATM 33 C UNL 1 1.576 1.432 0.000 1.00 0.00 C HETATM 34 C UNL 1 1.576 2.257 0.000 1.00 0.00 C HETATM 35 C UNL 1 0.862 2.669 0.000 1.00 0.00 C HETATM 36 C UNL 1 2.291 1.019 0.000 1.00 0.00 C HETATM 37 O UNL 1 3.005 1.432 0.000 1.00 0.00 O HETATM 38 N UNL 1 2.291 0.194 0.000 1.00 0.00 N HETATM 39 C UNL 1 3.005 -0.218 0.000 1.00 0.00 C HETATM 40 C UNL 1 3.091 -1.039 0.000 1.00 0.00 C HETATM 41 N UNL 1 3.898 -1.210 0.000 1.00 0.00 N HETATM 42 C UNL 1 4.311 -0.496 0.000 1.00 0.00 C HETATM 43 C UNL 1 3.759 0.117 0.000 1.00 0.00 C HETATM 44 C UNL 1 4.115 -6.382 0.000 1.00 0.00 C HETATM 45 N UNL 1 3.721 -5.657 0.000 1.00 0.00 N HETATM 46 C UNL 1 4.152 -4.953 0.000 1.00 0.00 C HETATM 47 C UNL 1 3.758 -4.229 0.000 1.00 0.00 C HETATM 48 N UNL 1 4.189 -3.525 0.000 1.00 0.00 N HETATM 49 C UNL 1 3.795 -2.800 0.000 1.00 0.00 C HETATM 50 C UNL 1 4.226 -2.096 0.000 1.00 0.00 C HETATM 51 C UNL 1 2.970 -2.779 0.000 1.00 0.00 C HETATM 52 C UNL 1 2.540 -3.482 0.000 1.00 0.00 C HETATM 53 C UNL 1 2.146 -2.757 0.000 1.00 0.00 C HETATM 54 O UNL 1 5.051 -2.118 0.000 1.00 0.00 O HETATM 55 C UNL 1 4.977 -4.975 0.000 1.00 0.00 C HETATM 56 O UNL 1 2.933 -4.207 0.000 1.00 0.00 O HETATM 57 C UNL 1 2.387 -2.195 0.000 1.00 0.00 C HETATM 58 C UNL 1 5.108 -0.282 0.000 1.00 0.00 C HETATM 59 N UNL 1 5.321 0.515 0.000 1.00 0.00 N HETATM 60 O UNL 1 5.691 -0.866 0.000 1.00 0.00 O HETATM 61 C UNL 1 6.118 0.728 0.000 1.00 0.00 C HETATM 62 C UNL 1 6.702 0.145 0.000 1.00 0.00 C HETATM 63 C UNL 1 7.498 0.358 0.000 1.00 0.00 C HETATM 64 C UNL 1 7.712 1.155 0.000 1.00 0.00 C HETATM 65 C UNL 1 7.129 1.739 0.000 1.00 0.00 C HETATM 66 C UNL 1 6.332 1.525 0.000 1.00 0.00 C HETATM 67 C UNL 1 7.342 2.536 0.000 1.00 0.00 C HETATM 68 C UNL 1 6.759 3.119 0.000 1.00 0.00 C HETATM 69 C UNL 1 5.962 2.905 0.000 1.00 0.00 C HETATM 70 C UNL 1 5.748 2.109 0.000 1.00 0.00 C HETATM 71 C UNL 1 -0.567 1.019 0.000 1.00 0.00 C HETATM 72 C UNL 1 -1.996 1.019 0.000 1.00 0.00 C HETATM 73 C UNL 1 -2.711 1.432 0.000 1.00 0.00 C HETATM 74 C UNL 1 -3.425 1.019 0.000 1.00 0.00 C HETATM 75 C UNL 1 -3.425 0.194 0.000 1.00 0.00 C HETATM 76 C UNL 1 -2.711 -0.218 0.000 1.00 0.00 C HETATM 77 C UNL 1 -1.996 0.194 0.000 1.00 0.00 C HETATM 78 F UNL 1 -1.282 -0.218 0.000 1.00 0.00 F CONECT 1 2 CONECT 2 1 3 CONECT 3 2 4 14 CONECT 4 3 5 15 CONECT 5 4 6 CONECT 6 5 7 9 CONECT 7 6 8 13 CONECT 8 7 16 20 CONECT 9 6 10 11 12 CONECT 10 9 CONECT 11 9 CONECT 12 9 CONECT 13 7 CONECT 14 3 CONECT 15 4 CONECT 16 8 17 25 CONECT 17 16 18 CONECT 18 17 19 21 CONECT 19 18 20 24 CONECT 20 19 8 CONECT 21 18 22 CONECT 22 21 23 CONECT 23 22 24 CONECT 24 23 19 CONECT 25 16 26 27 CONECT 26 25 CONECT 27 25 28 29 CONECT 28 27 30 CONECT 29 27 71 72 CONECT 30 28 31 35 CONECT 31 30 32 CONECT 32 31 33 CONECT 33 32 34 36 CONECT 34 33 35 CONECT 35 34 30 CONECT 36 33 37 38 CONECT 37 36 CONECT 38 36 39 CONECT 39 38 40 43 CONECT 40 39 41 CONECT 41 40 42 50 CONECT 42 41 43 58 CONECT 43 42 39 CONECT 44 45 CONECT 45 44 46 CONECT 46 45 47 55 CONECT 47 46 48 56 CONECT 48 47 49 CONECT 49 48 50 51 CONECT 50 49 54 41 CONECT 51 49 52 53 57 CONECT 52 51 CONECT 53 51 CONECT 54 50 CONECT 55 46 CONECT 56 47 CONECT 57 51 CONECT 58 42 59 60 CONECT 59 58 61 CONECT 60 58 CONECT 61 59 62 66 CONECT 62 61 63 CONECT 63 62 64 CONECT 64 63 65 CONECT 65 64 66 67 CONECT 66 65 61 70 CONECT 67 65 68 CONECT 68 67 69 CONECT 69 68 70 CONECT 70 69 66 CONECT 71 29 CONECT 72 29 73 77 CONECT 73 72 74 CONECT 74 73 75 CONECT 75 74 76 CONECT 76 75 77 CONECT 77 76 72 78 CONECT 78 77 MASTER 0 0 0 0 0 0 0 0 78 0 78 0 END M END $$$$