HMDB0256612 RDKit 3D Piroximone 27 28 0 0 0 0 0 0 0 0999 V2000 3.3016 1.2346 0.1189 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6728 0.3212 -0.9029 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8065 -0.6931 -0.2357 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1125 -1.9823 -0.0065 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1221 -2.6217 0.6197 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0928 -3.8257 0.9751 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1593 -1.7136 0.7936 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5397 -0.5060 0.2789 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2485 0.7134 0.3009 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 1.8179 0.3095 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7004 0.6738 0.3141 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4364 -0.3888 -0.1683 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8113 -0.4138 -0.1232 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4834 0.6173 0.4018 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7998 1.6689 0.8803 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4278 1.7411 0.8586 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3276 2.3004 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3610 0.8903 0.2722 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8187 1.0867 1.1207 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0603 0.9582 -1.5873 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4889 -0.1778 -1.4689 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0327 -2.4083 -0.2984 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7482 -1.9109 1.2673 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9449 -1.2474 -0.6164 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3820 -1.2457 -0.5011 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3486 2.5047 1.3089 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8962 2.6065 1.2539 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 5 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 8 3 2 0 16 11 1 0 1 17 1 0 1 18 1 0 1 19 1 0 2 20 1 0 2 21 1 0 4 22 1 0 7 23 1 0 12 24 1 0 13 25 1 0 15 26 1 0 16 27 1 0 M END