HMDB0258670 RDKit 3D Tabun 21 20 0 0 0 0 0 0 0 0999 V2000 2.7248 0.2169 -0.8017 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9142 -1.0561 -0.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5451 -0.8205 -0.7052 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0048 -0.1999 0.7646 P 0 0 0 0 0 5 0 0 0 0 0 0 0.8896 0.8998 1.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1014 -1.4624 2.0065 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2950 -2.3580 2.7318 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6149 0.4202 0.5376 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4312 -0.4083 -0.3076 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6555 1.8137 0.1983 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4385 0.1992 0.0591 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2559 0.3098 -1.7826 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0579 1.1124 -0.7554 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1249 -1.6600 -1.6248 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1909 -1.6899 0.1455 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0943 -0.4466 -1.3626 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4800 -0.0757 -0.1898 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3977 -1.4434 0.1007 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5418 2.0544 -0.4249 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7566 2.1931 -0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7685 2.4012 1.1422 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 4 6 1 0 6 7 3 0 4 8 1 0 8 9 1 0 8 10 1 0 1 11 1 0 1 12 1 0 1 13 1 0 2 14 1 0 2 15 1 0 9 16 1 0 9 17 1 0 9 18 1 0 10 19 1 0 10 20 1 0 10 21 1 0 M END