HMDB0253867 RDKit 3D L-alpha-Acetyl-N,N-dinormethadol 51 52 0 0 0 0 0 0 0 0999 V2000 0.7573 -1.0336 2.9826 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4158 -1.3758 1.7124 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3093 -0.5087 0.5282 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0717 -1.1133 -0.5017 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2880 -0.5923 -0.9486 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0766 -1.2340 -2.0272 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7024 0.4493 -0.4052 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1092 -0.1182 0.0788 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8401 -1.3731 -0.1681 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1641 -1.4678 -0.7198 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3965 -0.9109 -0.1987 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4300 -2.9320 -0.9253 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0229 0.6327 -1.2238 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5648 0.0062 -2.3224 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 0.6655 -3.5217 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2619 1.9765 -3.6411 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2863 2.6342 -2.5688 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3944 1.9361 -1.3712 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5487 0.7865 1.1452 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2249 1.9577 1.3204 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0671 2.8798 2.2923 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1315 2.7110 3.1491 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8904 1.5843 2.9959 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5853 0.6663 2.0164 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 -0.0045 3.3313 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3474 -1.5964 3.8046 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2542 -1.5216 3.1148 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1805 -2.4545 1.5065 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5349 -1.4364 1.9426 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9086 0.4235 0.7896 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9606 -1.7827 -1.6182 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4692 -1.9533 -2.6177 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4692 -0.4466 -2.7025 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7572 -1.9692 0.8062 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1547 -1.9878 -0.8427 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1487 -1.1430 -1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8153 -1.3795 0.7157 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2098 -1.1251 -0.9662 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4350 0.2117 -0.1472 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1358 -3.4615 -0.0901 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4474 -3.0817 -1.0766 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8686 -1.0095 -2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 0.2141 -4.4184 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3428 2.5353 -4.5782 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6295 3.6575 -2.6261 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8666 2.4600 -0.5581 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0774 2.1753 0.6942 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5427 3.7794 2.4126 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3756 3.4368 3.9262 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7281 1.4388 3.6606 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1980 -0.2055 1.9974 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 1 0 5 7 2 0 3 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 10 12 1 0 8 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 8 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 18 13 1 0 24 19 1 0 1 25 1 0 1 26 1 0 1 27 1 0 2 28 1 0 2 29 1 0 3 30 1 0 6 31 1 0 6 32 1 0 6 33 1 0 9 34 1 0 9 35 1 0 10 36 1 0 11 37 1 0 11 38 1 0 11 39 1 0 12 40 1 0 12 41 1 0 14 42 1 0 15 43 1 0 16 44 1 0 17 45 1 0 18 46 1 0 20 47 1 0 21 48 1 0 22 49 1 0 23 50 1 0 24 51 1 0 M END