HMDB0014417 RDKit 3D Betazole 17 17 0 0 0 0 0 0 0 0999 V2000 1.6794 1.1962 -0.1073 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7034 -0.1230 -0.6851 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7084 -0.9943 0.0408 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 -0.4669 -0.0565 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1448 0.6553 -0.6888 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5025 0.7102 -0.4896 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8185 -0.3547 0.2423 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7275 -1.0693 0.5086 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7445 1.9511 -0.8246 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5164 1.2975 0.5161 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4879 -0.0465 -1.7688 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7029 -0.5913 -0.5752 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7778 -2.0225 -0.3723 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9943 -0.9919 1.1127 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.3569 -1.2385 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2029 1.4608 -0.8463 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7017 -1.9677 1.0756 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 4 1 0 1 9 1 0 1 10 1 0 2 11 1 0 2 12 1 0 3 13 1 0 3 14 1 0 5 15 1 0 6 16 1 0 8 17 1 0 M END