HMDB0015459 RDKit 3D Cortisone acetate 59 62 0 0 0 0 0 0 0 0999 V2000 6.8501 -0.9861 -2.3837 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6187 -1.2138 -1.5852 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5156 -1.2265 -2.1823 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6482 -1.4081 -0.2326 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5343 -1.6274 0.5825 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6088 -0.4797 0.4981 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8861 0.4579 -0.2127 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3455 -0.4530 1.2679 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2447 -1.6289 2.0066 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4001 0.7718 2.1747 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1576 1.5934 1.8355 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 0.5459 1.3437 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9553 1.0169 0.5942 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.8375 1.8929 1.4952 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8623 2.5115 0.5695 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6243 1.3969 -0.0507 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9045 1.6119 -0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6684 0.5356 -0.9078 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5158 0.7963 -1.8071 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4202 -0.8432 -0.4394 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0053 -1.0513 -0.0499 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0696 0.0884 -0.4079 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.9676 0.0638 -1.9406 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7568 -0.2241 0.2306 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9123 -1.1607 -0.5182 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1473 -1.6465 -1.5916 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3909 -1.5551 0.1308 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -0.2718 0.4248 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3764 0.4263 -0.8783 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7361 -0.9194 -1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9851 -1.7497 -3.1576 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7871 0.0138 -2.8849 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9097 -1.7911 1.6243 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0095 -2.5810 0.3105 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1518 -2.3606 1.3457 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3236 1.3614 2.0237 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3028 0.3993 3.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7776 2.1478 2.7133 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4519 2.3297 1.0642 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0799 -0.0865 2.1816 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7205 1.6429 -0.2805 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4143 1.1962 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2525 2.6221 2.0561 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5432 3.1988 1.0947 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3017 3.0526 -0.2417 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3792 2.5808 -0.0629 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7016 -1.5410 -1.2553 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1308 -1.0902 0.3969 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9844 -1.2449 1.0632 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6350 -2.0186 -0.4891 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9714 0.4273 -2.2792 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2362 -0.9265 -2.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7029 0.7803 -2.3717 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9790 -0.7173 1.2232 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9718 -2.2479 -0.4843 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1214 -2.0086 1.1096 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7676 1.4385 -0.7861 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0487 -0.2452 -1.4722 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4041 0.4038 -1.4436 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 6 8 1 0 8 9 1 1 8 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 1 6 22 24 1 0 24 25 1 0 25 26 2 0 25 27 1 0 27 28 1 0 28 29 1 6 28 8 1 0 28 12 1 0 24 13 1 0 22 16 1 0 1 30 1 0 1 31 1 0 1 32 1 0 5 33 1 0 5 34 1 0 9 35 1 0 10 36 1 0 10 37 1 0 11 38 1 0 11 39 1 0 12 40 1 1 13 41 1 6 14 42 1 0 14 43 1 0 15 44 1 0 15 45 1 0 17 46 1 0 20 47 1 0 20 48 1 0 21 49 1 0 21 50 1 0 23 51 1 0 23 52 1 0 23 53 1 0 24 54 1 1 27 55 1 0 27 56 1 0 29 57 1 0 29 58 1 0 29 59 1 0 M END