HMDB0014352 RDKit 3D Azithromycin 124126 0 0 0 0 0 0 0 0999 V2000 -4.8658 -0.9288 1.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8977 -2.0368 0.6834 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0504 -1.6357 -0.5257 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.7174 -1.4094 -0.2005 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0673 -0.3201 0.3022 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6622 -0.2977 1.5249 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7961 0.8715 -0.5116 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2183 0.7903 -1.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5093 1.5850 -0.2883 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8874 2.6421 0.5894 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0144 3.8707 0.0634 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4070 4.4802 0.1855 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3779 5.7686 1.0321 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.7815 6.2803 1.0855 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8565 5.3945 2.2387 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7179 6.3634 3.1901 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4548 6.6900 0.2234 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4579 7.9184 0.8326 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1165 5.9986 0.1937 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4832 5.9706 -1.1922 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1923 4.7385 0.7676 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7004 0.9892 0.2040 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5315 2.2311 0.6513 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6786 0.1437 -0.4457 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5764 -0.3385 0.4525 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8273 -0.1024 0.6626 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5130 -1.3056 0.3054 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8688 -1.0133 0.2075 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6102 -2.0286 -0.6355 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4406 -0.8660 1.5753 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3857 -0.7098 2.5963 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8709 -1.8093 3.2691 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9574 -2.4294 4.0539 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1158 -2.8192 2.7068 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2960 0.1833 2.0799 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7852 1.4944 2.1847 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4256 -0.8195 -1.5098 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7715 -1.1467 -2.1878 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8072 -0.1095 -2.6212 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -2.0347 -1.4798 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8334 -3.1691 -0.5927 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3748 -3.0230 0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0351 -4.3197 -1.1286 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2022 -3.6954 -1.7643 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2456 -4.1067 -3.1672 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4280 -4.0871 -1.1304 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.3430 -5.6200 -1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6291 -3.7493 -1.9041 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.5896 -4.7746 -1.6199 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3226 -2.4755 -1.7104 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.8566 -2.6723 -1.7432 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0943 -1.6838 -2.8651 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4388 -0.0025 1.2528 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2168 -1.1844 2.5994 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8777 -0.7360 2.1307 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9265 -2.2524 0.4124 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3833 -2.8993 1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4691 -0.6075 -0.7869 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6238 1.5624 -0.1272 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6346 1.5613 -2.5359 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2804 0.9159 -2.1549 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 -0.1892 -2.3532 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3342 2.1358 -1.2596 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7742 3.9763 -1.0083 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8277 4.7980 -0.7895 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1267 3.8343 0.6663 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8958 7.1897 1.7032 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4348 5.4515 1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0873 6.5522 0.0525 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2838 5.8433 4.0993 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9017 7.1005 2.9288 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6397 6.8415 3.5143 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9217 6.7344 -0.7899 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1774 8.4706 0.4424 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5747 6.5866 0.8282 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0431 6.9078 -1.3956 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2062 5.1416 -1.2282 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2793 5.7784 -1.9743 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 0.5240 1.2164 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4835 2.9318 -0.2314 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2193 2.6039 1.5963 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6122 2.0254 0.6977 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3460 0.8914 -1.0149 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3857 0.6318 0.0329 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8995 -0.0479 -0.3829 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4756 -2.3863 -0.0169 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9580 -2.9179 -0.8544 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0366 -1.5971 -1.5516 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0292 0.1040 1.5455 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2252 -1.6130 1.8148 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8904 -0.0504 3.4177 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7007 -2.8420 3.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4848 -3.3262 4.5226 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3943 -1.7401 4.7766 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7963 -3.5794 3.4996 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5430 -3.4560 1.9163 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1452 -2.4334 2.3404 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4549 0.1150 2.8107 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0971 2.0829 2.5693 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1408 -2.1481 -1.8494 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6433 -1.3041 -3.2937 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4779 -0.3247 -1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3726 0.6839 -2.8121 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7832 -2.4767 -2.5479 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4288 -1.8035 -1.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8908 -3.5903 -0.6134 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6157 -3.9756 1.4197 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6818 -2.7785 0.9157 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 -2.2819 1.3268 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3857 -4.9493 -0.3055 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5495 -4.9004 -1.8728 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8196 -5.0398 -3.3287 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6923 -3.3186 -3.7947 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 -4.3772 -3.5409 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5386 -3.7481 -0.0844 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1866 -5.9420 0.0435 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 -6.0439 -1.5875 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2725 -6.1158 -1.3398 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4245 -3.9392 -3.0018 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7097 -4.8507 -0.6282 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1731 -3.5392 -1.1682 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1363 -2.8881 -2.8159 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3631 -1.7307 -1.5011 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7359 -0.9161 -2.7638 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 2 0 5 7 1 0 7 8 1 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 13 15 1 1 15 16 1 0 13 17 1 0 17 18 1 0 17 19 1 0 19 20 1 0 19 21 1 0 9 22 1 0 22 23 1 0 22 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 28 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 32 34 1 0 31 35 1 0 35 36 1 0 24 37 1 0 37 38 1 0 37 39 1 6 37 40 1 0 40 41 1 0 41 42 1 0 41 43 1 0 43 44 1 0 44 45 1 0 44 46 1 0 46 47 1 0 46 48 1 0 48 49 1 0 48 50 1 0 50 51 1 0 50 52 1 6 50 3 1 0 21 11 1 0 35 26 1 0 1 53 1 0 1 54 1 0 1 55 1 0 2 56 1 0 2 57 1 0 3 58 1 6 7 59 1 1 8 60 1 0 8 61 1 0 8 62 1 0 9 63 1 6 11 64 1 6 12 65 1 0 12 66 1 0 14 67 1 0 14 68 1 0 14 69 1 0 16 70 1 0 16 71 1 0 16 72 1 0 17 73 1 6 18 74 1 0 19 75 1 1 20 76 1 0 20 77 1 0 20 78 1 0 22 79 1 1 23 80 1 0 23 81 1 0 23 82 1 0 24 83 1 6 26 84 1 6 28 85 1 6 29 86 1 0 29 87 1 0 29 88 1 0 30 89 1 0 30 90 1 0 31 91 1 1 33 92 1 0 33 93 1 0 33 94 1 0 34 95 1 0 34 96 1 0 34 97 1 0 35 98 1 1 36 99 1 0 38100 1 0 38101 1 0 38102 1 0 39103 1 0 40104 1 0 40105 1 0 41106 1 1 42107 1 0 42108 1 0 42109 1 0 43110 1 0 43111 1 0 45112 1 0 45113 1 0 45114 1 0 46115 1 1 47116 1 0 47117 1 0 47118 1 0 48119 1 6 49120 1 0 51121 1 0 51122 1 0 51123 1 0 52124 1 0 M END