HMDB0015385 RDKit 3D Lisdexamfetamine 44 44 0 0 0 0 0 0 0 0999 V2000 1.5914 -0.4858 1.2616 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4064 -0.1235 -0.1799 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7052 -0.3424 -0.9234 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7252 0.5386 -0.2826 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9213 1.8280 -0.7339 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8476 2.6877 -0.1825 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6033 2.2024 0.8759 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4203 0.9157 1.3398 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4854 0.0742 0.7699 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3153 -0.8815 -0.7629 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8408 -0.2398 -1.2677 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9053 1.0111 -1.2009 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9266 -1.0359 -1.8511 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5923 -2.4252 -1.7993 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2659 -0.7461 -1.1727 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1246 -1.0898 0.2805 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3821 -0.8490 1.0694 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8411 0.5703 1.0428 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8255 1.4466 1.5977 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0228 -1.4985 1.3731 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2233 0.2936 1.7373 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5908 -0.5078 1.7713 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1329 0.9456 -0.2276 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0062 -1.3902 -0.7384 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6354 -0.1759 -1.9981 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3001 2.1571 -1.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9644 3.6900 -0.5715 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3220 2.8826 1.2969 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0285 0.5744 2.1665 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3506 -0.9481 1.1499 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3762 -1.9400 -0.8163 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0513 -0.6757 -2.9136 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3482 -3.0289 -1.3998 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4508 -2.7834 -2.7917 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0322 -1.3079 -1.7041 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4519 0.3300 -1.3081 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8394 -2.1515 0.3842 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3015 -0.4767 0.6975 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2022 -1.4985 0.7147 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1972 -1.1277 2.1266 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1680 0.9070 0.0348 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7353 0.6491 1.6953 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2613 2.1547 2.2182 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2313 1.8714 0.8668 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 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 2 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 13 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 9 4 1 0 1 20 1 0 1 21 1 0 1 22 1 0 2 23 1 1 3 24 1 0 3 25 1 0 5 26 1 0 6 27 1 0 7 28 1 0 8 29 1 0 9 30 1 0 10 31 1 0 13 32 1 6 14 33 1 0 14 34 1 0 15 35 1 0 15 36 1 0 16 37 1 0 16 38 1 0 17 39 1 0 17 40 1 0 18 41 1 0 18 42 1 0 19 43 1 0 19 44 1 0 M END