HMDB0253448 RDKit 3D Indantadol 28 29 0 0 0 0 0 0 0 0999 V2000 -4.7816 -0.1365 1.0427 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8508 0.0399 -0.0278 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2868 0.2402 -1.1808 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3851 -0.0064 0.1824 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7184 0.2014 -1.0511 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 0.1967 -1.0416 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3119 -1.1127 -0.6222 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6872 -0.6758 -0.1859 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8561 -1.4168 -0.0466 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0426 -0.8507 0.3628 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0153 0.5005 0.6308 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8853 1.2710 0.5072 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7008 0.6677 0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3297 1.1895 -0.1362 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4503 -0.0282 2.0268 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7740 -0.3689 0.8348 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1364 0.8149 0.9028 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1084 -0.9499 0.6941 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1052 0.8781 -1.7035 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0438 0.4174 -2.0819 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4114 -1.7792 -1.5266 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1958 -1.6393 0.1786 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8365 -2.4825 -0.2687 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9507 -1.4387 0.4688 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9488 0.9445 0.9521 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8750 2.3367 0.7221 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1434 1.2361 0.8842 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3422 2.1951 -0.6083 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 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 6 1 0 13 8 1 0 1 15 1 0 1 16 1 0 4 17 1 0 4 18 1 0 5 19 1 0 6 20 1 0 7 21 1 0 7 22 1 0 9 23 1 0 10 24 1 0 11 25 1 0 12 26 1 0 14 27 1 0 14 28 1 0 M END