HMDB0002818 RDKit 3D Alloxan 12 12 0 0 0 0 0 0 0 0999 V2000 -2.2979 -1.4460 -0.0594 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2157 -0.8035 -0.0319 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0644 -1.4459 -0.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2756 -0.6969 0.0131 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4155 -1.2159 0.0262 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1899 0.7491 0.0307 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2163 1.4944 0.0586 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0997 1.4290 0.0171 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1958 2.6843 0.0321 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2675 0.6240 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1262 -2.4864 -0.0307 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2114 1.1140 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 1 0 4 5 2 0 4 6 1 0 6 7 2 0 6 8 1 0 8 9 2 0 8 10 1 0 10 2 1 0 3 11 1 0 10 12 1 0 M END