HMDB0060811 RDKit 3D cyclic Melatonin 31 33 0 0 0 0 0 0 0 0999 V2000 5.4121 0.5174 -0.4426 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2892 -0.3136 -0.6297 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0213 0.1148 -0.2734 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7974 1.3767 0.2821 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 1.7380 0.6147 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4317 0.8921 0.4138 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8874 0.9968 0.6429 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5322 -0.1319 0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5499 -0.9681 -0.2206 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6852 -0.3460 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9693 -0.7449 -0.4823 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2262 -2.2263 -0.6499 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5024 -2.1936 0.1304 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8049 -0.7807 0.1764 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0535 -0.1097 0.1454 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1485 1.3643 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1207 -0.7925 0.0651 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3080 0.0430 -0.8732 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5529 0.6993 0.6391 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2152 1.4802 -0.9565 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6464 2.0300 0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3173 2.7209 1.0486 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3996 1.8309 1.0612 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1804 -1.7102 -0.9129 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5848 -3.0979 -0.4124 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4249 -2.1899 -1.7454 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3212 -2.7786 -0.3341 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3205 -2.5706 1.1713 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9572 1.6477 1.2737 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3444 1.7869 -0.4272 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1478 1.7153 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 9 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 15 17 2 0 11 3 1 0 10 6 1 0 14 8 1 0 1 18 1 0 1 19 1 0 1 20 1 0 4 21 1 0 5 22 1 0 7 23 1 0 11 24 1 0 12 25 1 0 12 26 1 0 13 27 1 0 13 28 1 0 16 29 1 0 16 30 1 0 16 31 1 0 M END