HMDB0245739 RDKit 3D Polihexanide 32 31 0 0 0 0 0 0 0 0999 V2000 -4.8287 0.9921 0.1583 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3599 -0.3844 0.4997 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9531 -0.6966 0.1206 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9096 0.1688 0.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5529 -0.3292 0.2288 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5679 0.4902 0.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8431 -0.0016 0.3221 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2870 0.0883 -1.0157 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5333 0.4509 -1.9795 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6394 -0.2439 -1.2986 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6352 0.3145 -0.4394 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0195 1.5388 -0.6153 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1906 -0.4788 0.5904 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4841 1.0177 -0.7575 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4251 1.4466 1.0028 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9418 1.6133 -0.0952 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0110 -1.1085 -0.0686 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5728 -0.6144 1.5788 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7439 -1.7407 0.3575 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8794 -0.5280 -0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9827 1.2334 0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8890 0.0157 1.8562 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5088 -0.2743 -0.8796 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3929 -1.3865 0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4636 1.5613 0.4633 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5629 0.5257 1.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4736 -0.4536 1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8924 0.5089 -2.9671 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9021 -0.8622 -2.0884 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5943 2.0951 -1.3822 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8372 -1.2464 0.3216 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9934 -0.3441 1.6031 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 1 0 6 7 1 0 7 8 1 0 8 9 2 3 8 10 1 0 10 11 1 0 11 12 2 3 11 13 1 0 1 14 1 0 1 15 1 0 1 16 1 0 2 17 1 0 2 18 1 0 3 19 1 0 3 20 1 0 4 21 1 0 4 22 1 0 5 23 1 0 5 24 1 0 6 25 1 0 6 26 1 0 7 27 1 0 9 28 1 0 10 29 1 0 12 30 1 0 13 31 1 0 13 32 1 0 M END