HMDB0248042 RDKit 3D Afimoxifene 58 60 0 0 0 0 0 0 0 0999 V2000 -1.0620 2.9791 -1.5218 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7325 2.1295 -0.2883 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9045 1.1828 -0.0424 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6297 -0.0770 0.0778 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5450 -1.1920 0.3054 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4764 -1.6825 -0.5371 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3159 -2.7411 -0.1625 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1900 -3.2974 1.0927 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9950 -4.3407 1.5016 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2351 -2.8139 1.9891 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4387 -1.7767 1.5751 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2122 -0.5512 0.0803 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1837 -1.5717 -0.7532 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4589 -2.0715 -0.7383 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3704 -1.5103 0.1622 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6188 -2.0312 0.1493 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7670 -1.7512 0.8491 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3575 -0.3934 0.6718 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7207 -0.1174 -0.7044 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2912 1.1801 -0.8795 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5591 -1.1413 -1.2637 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9889 -0.4966 0.9953 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6922 -0.0112 0.9577 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2142 1.8298 0.0365 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3572 2.8476 1.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5210 3.5634 1.1577 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6010 3.2768 0.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4933 2.2896 -0.6146 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2966 1.5858 -0.7444 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0815 3.4019 -1.4273 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 2.3778 -2.4143 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3267 3.8092 -1.5384 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5072 2.7554 0.5582 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1685 1.5728 -0.5989 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5765 -1.2861 -1.5298 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0573 -3.1279 -0.8352 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8758 -4.0971 1.9652 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1278 -3.2429 2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7002 -1.4152 2.2893 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5528 -1.9761 -1.4319 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 -2.8740 -1.3965 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6318 -1.9763 1.9466 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5358 -2.5286 0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7982 0.4485 1.0452 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3360 -0.3952 1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1891 1.0979 -1.5508 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5351 1.8330 -1.3604 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5869 1.6709 0.0862 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0352 -1.8148 -1.9515 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3731 -0.6514 -1.8706 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0868 -1.7568 -0.5202 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6384 -0.0362 1.7109 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3889 0.7973 1.6293 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4994 3.0559 1.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5577 4.3356 1.9252 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5009 3.8338 0.4634 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3137 2.0446 -1.2661 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2507 0.8481 -1.5191 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 3 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 8 10 1 0 10 11 2 0 4 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 19 21 1 0 15 22 1 0 22 23 2 0 3 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 11 5 1 0 23 12 1 0 29 24 1 0 1 30 1 0 1 31 1 0 1 32 1 0 2 33 1 0 2 34 1 0 6 35 1 0 7 36 1 0 9 37 1 0 10 38 1 0 11 39 1 0 13 40 1 0 14 41 1 0 17 42 1 0 17 43 1 0 18 44 1 0 18 45 1 0 20 46 1 0 20 47 1 0 20 48 1 0 21 49 1 0 21 50 1 0 21 51 1 0 22 52 1 0 23 53 1 0 25 54 1 0 26 55 1 0 27 56 1 0 28 57 1 0 29 58 1 0 M END