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Diffstat (limited to 'hacks/images/molecules/codeine.pdb')
| -rw-r--r-- | hacks/images/molecules/codeine.pdb | 93 |
1 files changed, 93 insertions, 0 deletions
diff --git a/hacks/images/molecules/codeine.pdb b/hacks/images/molecules/codeine.pdb new file mode 100644 index 0000000..36a79fa --- /dev/null +++ b/hacks/images/molecules/codeine.pdb @@ -0,0 +1,93 @@ +HEADER Methylmorphine: Codeine, a cough reflex inhibitor +COMPND al3083 +AUTHOR Created by Dave Woodcock at Okanagan University College +AUTHOR email:woodcock@okanagan.bc.ca +AUTHOR Date revised: Wed Aug 30 12:33:12 2000 GENERATED BY BABEL 1.6 +HETATM 1 C 1 0.000 0.000 0.000 1.00 0.00 +HETATM 2 C 1 1.400 0.000 0.000 1.00 0.00 +HETATM 3 C 1 2.107 1.211 0.000 1.00 0.00 +HETATM 4 C 1 1.445 2.445 -0.038 1.00 0.00 +HETATM 5 C 1 0.048 2.457 0.012 1.00 0.00 +HETATM 6 C 1 -0.629 1.242 0.047 1.00 0.00 +HETATM 7 C 1 -2.076 1.497 -0.256 1.00 0.00 +HETATM 8 C 1 -2.718 0.335 -1.023 1.00 0.00 +HETATM 9 C 1 -2.362 -0.955 -0.251 1.00 0.00 +HETATM 10 C 1 -0.830 -1.234 -0.281 1.00 0.00 +HETATM 11 C 1 -1.864 2.827 -1.015 1.00 0.00 +HETATM 12 C 1 -2.785 1.642 1.099 1.00 0.00 +HETATM 13 C 1 -2.549 0.335 1.888 1.00 0.00 +HETATM 14 N 1 -2.944 -0.846 1.100 1.00 0.00 +HETATM 15 C 1 -2.815 -2.080 1.892 1.00 0.00 +HETATM 16 H 1 -3.800 0.464 -1.011 1.00 0.00 +HETATM 17 C 1 -2.286 0.268 -2.470 1.00 0.00 +HETATM 18 C 1 -2.002 1.392 -3.142 1.00 0.00 +HETATM 19 C 1 -1.354 2.572 -2.453 1.00 0.00 +HETATM 20 H 1 -2.774 3.428 -1.022 1.00 0.00 +HETATM 21 O 1 -0.789 3.474 -0.352 1.00 0.00 +HETATM 22 H 1 -1.514 3.472 -3.047 1.00 0.00 +HETATM 23 O 1 0.051 2.305 -2.404 1.00 0.00 +HETATM 24 O 1 2.148 3.606 -0.170 1.00 0.00 +HETATM 25 H 1 1.942 -0.944 -0.064 1.00 0.00 +HETATM 26 H 1 3.196 1.191 -0.044 1.00 0.00 +HETATM 27 H 1 -2.856 -1.789 -0.750 1.00 0.00 +HETATM 28 H 1 -0.570 -1.581 -1.281 1.00 0.00 +HETATM 29 H 1 -0.575 -2.018 0.429 1.00 0.00 +HETATM 30 H 1 -3.852 1.800 0.945 1.00 0.00 +HETATM 31 H 1 -2.368 2.484 1.653 1.00 0.00 +HETATM 32 H 1 -3.143 0.370 2.801 1.00 0.00 +HETATM 33 H 1 -1.498 0.252 2.165 1.00 0.00 +HETATM 34 H 1 -3.495 -2.034 2.743 1.00 0.00 +HETATM 35 H 1 -1.796 -2.189 2.261 1.00 0.00 +HETATM 36 H 1 -3.075 -2.943 1.279 1.00 0.00 +HETATM 37 H 1 -2.526 -0.630 -3.039 1.00 0.00 +HETATM 38 H 1 -1.938 1.338 -4.229 1.00 0.00 +HETATM 39 H 1 0.396 2.184 -3.295 1.00 0.00 +HETATM 40 C 1 2.068 4.090 -1.493 1.00 0.00 +HETATM 41 H 1 2.413 3.325 -2.189 1.00 0.00 +HETATM 42 H 1 1.038 4.360 -1.728 1.00 0.00 +HETATM 43 H 1 2.699 4.974 -1.590 1.00 0.00 +CONECT 1 2 2 6 10 +CONECT 2 1 1 3 25 +CONECT 3 2 4 4 26 +CONECT 4 3 3 5 24 +CONECT 5 4 6 6 21 +CONECT 6 1 5 5 7 +CONECT 7 6 8 11 12 +CONECT 8 7 9 16 17 +CONECT 9 8 10 14 27 +CONECT 10 1 9 28 29 +CONECT 11 7 19 20 21 +CONECT 12 7 13 30 31 +CONECT 13 12 14 32 33 +CONECT 14 9 13 15 +CONECT 15 14 34 35 36 +CONECT 16 8 +CONECT 17 8 18 18 37 +CONECT 18 17 17 19 38 +CONECT 19 11 18 22 23 +CONECT 20 11 +CONECT 21 5 11 +CONECT 22 19 +CONECT 23 19 39 +CONECT 24 4 40 +CONECT 25 2 +CONECT 26 3 +CONECT 27 9 +CONECT 28 10 +CONECT 29 10 +CONECT 30 12 +CONECT 31 12 +CONECT 32 13 +CONECT 33 13 +CONECT 34 15 +CONECT 35 15 +CONECT 36 15 +CONECT 37 17 +CONECT 38 18 +CONECT 39 23 +CONECT 40 24 41 42 43 +CONECT 41 40 +CONECT 42 40 +CONECT 43 40 +MASTER 0 0 0 0 0 0 0 0 43 0 43 0 +END |