HMDB0032867 RDKit 3D Capillin 21 21 0 0 0 0 0 0 0 0999 V2000 5.7372 1.1376 -0.2319 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3603 0.7041 0.0371 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2221 0.3577 0.2771 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8930 -0.0448 0.5801 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7689 -0.3966 0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5735 -0.8221 1.2036 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 -1.6358 2.1348 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6839 -0.2795 0.4438 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9619 -0.6756 0.7672 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0734 -0.2062 0.0932 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9356 0.6907 -0.9441 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6557 1.0894 -1.2704 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5324 0.6147 -0.5888 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7215 1.7614 -1.1449 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4167 0.2790 -0.4216 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1065 1.6804 0.6612 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1053 -1.3902 1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0602 -0.5331 0.3677 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7989 1.0769 -1.4931 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5278 1.7819 -2.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5306 0.9274 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 3 0 3 4 1 0 4 5 3 0 5 6 1 0 6 7 2 0 6 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 8 1 0 1 14 1 0 1 15 1 0 1 16 1 0 9 17 1 0 10 18 1 0 11 19 1 0 12 20 1 0 13 21 1 0 M END