HEADER PROTEIN 07-JUN-21 NONE TITLE NULL COMPND MOLECULE: HMDB05795.mol SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 07-JUN-21 0 HETATM 1 C UNK 0 -11.799 4.045 0.000 0.00 0.00 C+0 HETATM 2 C UNK 0 -11.799 2.504 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 -10.467 1.734 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 -9.135 2.504 0.000 0.00 0.00 C+0 HETATM 5 C UNK 0 -9.135 4.045 0.000 0.00 0.00 C+0 HETATM 6 C UNK 0 -10.467 4.816 0.000 0.00 0.00 C+0 HETATM 7 C UNK 0 -7.802 4.816 0.000 0.00 0.00 C+0 HETATM 8 C UNK 0 -6.464 4.045 0.000 0.00 0.00 C+0 HETATM 9 C UNK 0 -5.132 4.816 0.000 0.00 0.00 C+0 HETATM 10 C UNK 0 -5.132 6.352 0.000 0.00 0.00 C+0 HETATM 11 C UNK 0 -6.464 7.117 0.000 0.00 0.00 C+0 HETATM 12 C UNK 0 -7.802 6.352 0.000 0.00 0.00 C+0 HETATM 13 O UNK 0 -10.467 6.357 0.000 0.00 0.00 O+0 HETATM 14 O UNK 0 -13.132 4.816 0.000 0.00 0.00 O+0 HETATM 15 O UNK 0 -13.132 1.734 0.000 0.00 0.00 O+0 HETATM 16 O UNK 0 -8.171 7.770 0.000 0.00 0.00 O+0 HETATM 17 O UNK 0 -6.464 8.658 0.000 0.00 0.00 O+0 HETATM 18 C UNK 0 -3.805 4.051 0.000 0.00 0.00 C+0 HETATM 19 C UNK 0 -2.483 4.816 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 -2.483 6.352 0.000 0.00 0.00 C+0 HETATM 21 O UNK 0 -3.805 7.112 0.000 0.00 0.00 O+0 HETATM 22 C UNK 0 -6.464 2.504 0.000 0.00 0.00 C+0 HETATM 23 O UNK 0 -5.132 1.729 0.000 0.00 0.00 O+0 HETATM 24 C UNK 0 -3.799 2.504 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 -2.462 1.734 0.000 0.00 0.00 C+0 HETATM 26 C UNK 0 -1.129 2.504 0.000 0.00 0.00 C+0 HETATM 27 C UNK 0 -1.129 4.051 0.000 0.00 0.00 C+0 HETATM 28 O UNK 0 -1.150 7.122 0.000 0.00 0.00 O+0 HETATM 29 O UNK 0 -7.802 1.734 0.000 0.00 0.00 O+0 HETATM 30 O UNK 0 -2.462 0.193 0.000 0.00 0.00 O+0 HETATM 31 C UNK 0 0.203 4.827 0.000 0.00 0.00 C+0 HETATM 32 O UNK 0 0.203 1.734 0.000 0.00 0.00 O+0 HETATM 33 C UNK 0 1.541 4.061 0.000 0.00 0.00 C+0 HETATM 34 C UNK 0 2.868 4.827 0.000 0.00 0.00 C+0 HETATM 35 C UNK 0 2.868 6.363 0.000 0.00 0.00 C+0 HETATM 36 C UNK 0 1.541 7.122 0.000 0.00 0.00 C+0 HETATM 37 C UNK 0 0.203 6.363 0.000 0.00 0.00 C+0 HETATM 38 O UNK 0 -0.332 7.904 0.000 0.00 0.00 O+0 HETATM 39 O UNK 0 4.201 7.133 0.000 0.00 0.00 O+0 HETATM 40 O UNK 0 1.547 8.664 0.000 0.00 0.00 O+0 HETATM 41 C UNK 0 2.312 2.729 0.000 0.00 0.00 C+0 HETATM 42 O UNK 0 3.644 3.500 0.000 0.00 0.00 O+0 HETATM 43 O UNK 0 3.082 1.397 0.000 0.00 0.00 O+0 HETATM 44 C UNK 0 -9.135 0.963 0.000 0.00 0.00 C+0 HETATM 45 O UNK 0 -10.467 0.193 0.000 0.00 0.00 O+0 HETATM 46 O UNK 0 -8.364 -0.369 0.000 0.00 0.00 O+0 HETATM 47 C UNK 0 -7.272 -1.461 0.000 0.00 0.00 C+0 HETATM 48 C UNK 0 3.082 -0.144 0.000 0.00 0.00 C+0 HETATM 49 C UNK 0 1.750 -0.915 0.000 0.00 0.00 C+0 HETATM 50 O UNK 0 1.750 -2.456 0.000 0.00 0.00 O+0 HETATM 51 C UNK 0 4.415 -0.915 0.000 0.00 0.00 C+0 HETATM 52 O UNK 0 4.094 -2.424 0.000 0.00 0.00 O+0 HETATM 53 C UNK 0 5.560 0.112 0.000 0.00 0.00 C+0 HETATM 54 C UNK 0 5.902 1.525 0.000 0.00 0.00 C+0 HETATM 55 O UNK 0 7.096 0.273 0.000 0.00 0.00 O+0 HETATM 56 C UNK 0 4.714 -3.832 0.000 0.00 0.00 C+0 HETATM 57 O UNK 0 3.569 -4.859 0.000 0.00 0.00 O+0 HETATM 58 C UNK 0 6.052 -4.602 0.000 0.00 0.00 C+0 HETATM 59 C UNK 0 5.421 -6.009 0.000 0.00 0.00 C+0 HETATM 60 C UNK 0 6.325 -7.256 0.000 0.00 0.00 C+0 HETATM 61 C UNK 0 7.861 -7.101 0.000 0.00 0.00 C+0 HETATM 62 C UNK 0 8.487 -5.694 0.000 0.00 0.00 C+0 HETATM 63 C UNK 0 7.583 -4.447 0.000 0.00 0.00 C+0 HETATM 64 O UNK 0 3.890 -6.170 0.000 0.00 0.00 O+0 HETATM 65 O UNK 0 5.699 -8.664 0.000 0.00 0.00 O+0 HETATM 66 O UNK 0 8.765 -8.348 0.000 0.00 0.00 O+0 HETATM 67 C UNK 0 8.728 -3.414 0.000 0.00 0.00 C+0 HETATM 68 C UNK 0 9.873 -4.447 0.000 0.00 0.00 C+0 HETATM 69 C UNK 0 11.339 -3.976 0.000 0.00 0.00 C+0 HETATM 70 C UNK 0 11.666 -2.467 0.000 0.00 0.00 C+0 HETATM 71 C UNK 0 10.521 -1.434 0.000 0.00 0.00 C+0 HETATM 72 C UNK 0 9.054 -1.910 0.000 0.00 0.00 C+0 HETATM 73 C UNK 0 8.428 -0.498 0.000 0.00 0.00 C+0 HETATM 74 O UNK 0 9.573 0.530 0.000 0.00 0.00 O+0 HETATM 75 O UNK 0 13.132 -1.991 0.000 0.00 0.00 O+0 HETATM 76 O UNK 0 12.484 -5.009 0.000 0.00 0.00 O+0 HETATM 77 O UNK 0 10.301 -5.956 0.000 0.00 0.00 O+0 HETATM 78 O UNK 0 7.379 1.959 0.000 0.00 0.00 O+0 CONECT 1 2 6 14 CONECT 2 1 3 15 CONECT 3 2 4 CONECT 4 3 5 44 CONECT 5 4 6 7 CONECT 6 5 1 13 CONECT 7 5 8 12 CONECT 8 7 9 22 CONECT 9 8 10 18 CONECT 10 9 11 21 CONECT 11 10 12 17 CONECT 12 11 7 16 CONECT 13 6 CONECT 14 1 CONECT 15 2 CONECT 16 12 CONECT 17 11 CONECT 18 9 19 24 CONECT 19 18 20 27 CONECT 20 19 21 28 CONECT 21 20 10 CONECT 22 8 23 29 CONECT 23 22 24 CONECT 24 23 18 25 CONECT 25 24 26 30 CONECT 26 25 27 32 CONECT 27 26 19 31 CONECT 28 20 CONECT 29 22 CONECT 30 25 CONECT 31 27 33 37 CONECT 32 26 CONECT 33 31 34 41 CONECT 34 33 35 CONECT 35 34 36 39 CONECT 36 35 37 40 CONECT 37 36 31 38 CONECT 38 37 CONECT 39 35 CONECT 40 36 CONECT 41 33 42 43 CONECT 42 41 CONECT 43 41 48 CONECT 44 4 45 46 CONECT 45 44 CONECT 46 44 47 CONECT 47 46 49 CONECT 48 43 49 51 CONECT 49 48 50 47 CONECT 50 49 CONECT 51 48 52 53 CONECT 52 51 56 CONECT 53 51 54 55 CONECT 54 53 78 CONECT 55 53 73 CONECT 56 52 57 58 CONECT 57 56 CONECT 58 56 59 63 CONECT 59 58 60 64 CONECT 60 59 61 65 CONECT 61 60 62 66 CONECT 62 61 63 CONECT 63 62 58 67 CONECT 64 59 CONECT 65 60 CONECT 66 61 CONECT 67 63 68 72 CONECT 68 67 69 77 CONECT 69 68 70 76 CONECT 70 69 71 75 CONECT 71 70 72 CONECT 72 71 67 73 CONECT 73 55 74 72 CONECT 74 73 CONECT 75 70 CONECT 76 69 CONECT 77 68 CONECT 78 54 MASTER 0 0 0 0 0 0 0 0 78 0 174 0 END