HMDB0015644 RDKit 3D Betahistine 22 22 0 0 0 0 0 0 0 0999 V2000 -3.1470 0.0113 1.0591 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8878 -0.4660 0.5320 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6271 0.1055 -0.7956 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3141 -0.3921 -1.3455 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8274 -0.0355 -0.4859 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0873 -0.4502 -0.9069 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2218 -0.1712 -0.1804 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0929 0.5360 0.9895 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8461 0.9412 1.3976 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7749 0.6417 0.6504 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8047 0.2102 0.1655 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0417 1.0180 1.5539 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5956 -0.7216 1.7405 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9290 -1.5064 0.4493 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4333 -0.2181 -1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6382 1.2027 -0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2165 0.0012 -2.3776 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -1.4974 -1.4244 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1978 -1.0101 -1.8314 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2176 -0.4974 -0.5107 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9623 0.7875 1.6103 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7411 1.5106 2.3392 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 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 5 1 0 1 11 1 0 1 12 1 0 1 13 1 0 2 14 1 0 3 15 1 0 3 16 1 0 4 17 1 0 4 18 1 0 6 19 1 0 7 20 1 0 8 21 1 0 9 22 1 0 M END