HMDB0254423 RDKit 3D Melengestrol acetate 61 64 0 0 0 0 0 0 0 0999 V2000 -2.5747 -1.1731 -2.5996 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9553 -0.9553 -1.4626 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4878 -1.2524 -1.2414 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4671 -1.6340 0.1926 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8316 -1.4561 0.9382 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8864 -2.3027 0.3536 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9520 -1.7350 -0.1647 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0629 -2.5612 -0.7767 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1609 -0.2959 -0.2007 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0680 0.2676 -0.9921 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3130 1.7030 -1.0625 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3644 2.2066 -1.4932 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2220 2.5813 -0.5839 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0124 1.8206 -0.1379 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3645 0.5806 0.6582 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2408 1.1503 1.8001 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -0.0717 1.2912 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0174 0.8707 1.2279 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1576 0.1204 1.8328 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6143 -0.9848 0.9033 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3964 -1.9662 1.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5042 -0.4182 -0.2225 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4768 0.9536 -0.0587 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0565 1.9160 -0.8311 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8821 3.3474 -0.4439 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7041 1.5513 -1.8237 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8709 -0.9251 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9958 -0.0310 0.3841 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0930 -2.1292 -0.1162 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0522 -1.5946 -3.4829 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6216 -0.9804 -2.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1631 -2.1014 -1.8841 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0501 -0.3741 -1.5467 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6852 -2.7458 0.2155 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5888 -2.0136 1.9123 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7654 -3.3678 0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8769 -3.6415 -0.5766 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9951 -2.2958 -0.2355 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1281 -2.4198 -1.8554 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6473 -0.4340 -1.6151 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9618 3.2546 -1.4276 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6040 3.2689 0.2247 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3635 2.5315 0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4485 1.4873 -1.0284 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2976 0.3949 2.6275 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6788 2.0071 2.2168 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2444 1.3751 1.4558 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4142 -0.0595 2.4021 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1869 1.2337 0.2181 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1926 1.7425 1.8722 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8943 -0.2490 2.8228 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0089 0.8249 1.9595 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3769 -1.5470 2.0264 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8217 -2.0955 2.6988 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4459 -2.9781 1.3013 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6878 3.4010 0.6494 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8619 3.8848 -0.5903 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0593 3.8382 -0.9618 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5485 -0.5649 1.1931 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6428 0.9338 0.7633 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6320 0.1070 -0.5143 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 7 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 15 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 20 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 24 26 2 0 22 27 1 0 27 28 1 0 27 29 2 0 22 2 1 0 20 4 1 0 17 5 1 0 15 9 1 0 1 30 1 0 1 31 1 0 3 32 1 0 3 33 1 0 4 34 1 0 5 35 1 0 6 36 1 0 8 37 1 0 8 38 1 0 8 39 1 0 10 40 1 0 13 41 1 0 13 42 1 0 14 43 1 0 14 44 1 0 16 45 1 0 16 46 1 0 16 47 1 0 17 48 1 0 18 49 1 0 18 50 1 0 19 51 1 0 19 52 1 0 21 53 1 0 21 54 1 0 21 55 1 0 25 56 1 0 25 57 1 0 25 58 1 0 28 59 1 0 28 60 1 0 28 61 1 0 M END