@MOLECULE 3-hydroxy-1-(3-hydroxypropyl)-2-methyl-piperidine-2,3,5,6-tetraid-4-one 26 26 0 0 0 SMALL USER_CHARGES @ATOM 1 O -4.6895 0.0667 1.0548 O.3 1 UNL11111111 -0.5324 2 O 2.7470 1.6547 0.4184 O.3 1 UNL11111111 -0.3879 3 O 3.7043 -0.8176 0.6393 O.2 1 UNL11111111 -0.4438 4 N -0.1331 -0.3301 -0.6564 N.4 1 UNL11111111 -0.3093 5 C -1.5574 -0.2208 -0.9958 C.3 1 UNL11111111 -0.0745 6 C -2.4309 -0.2561 0.2680 C.3 1 UNL11111111 -0.3623 7 C 0.6222 0.8028 -0.3220 C.3 1 UNL11111111 0.0368 8 C 0.3971 -1.5895 -0.4770 C.3 1 UNL11111111 0.0884 9 C -3.9100 -0.1257 -0.1045 C.3 1 UNL11111111 0.0001 10 C 1.9111 0.6397 0.1022 C.3 1 UNL11111111 0.0335 11 C -0.0005 2.1496 -0.4770 C.3 1 UNL11111111 -0.4391 12 C 1.6745 -1.7876 -0.0558 C.3 1 UNL11111111 -0.4224 13 C 2.5592 -0.6846 0.2712 C.2 1 UNL11111111 0.4700 14 H -1.8321 -1.0572 -1.6814 H 1 UNL11111111 0.1476 15 H -1.7402 0.7122 -1.5762 H 1 UNL11111111 0.1548 16 H -2.2521 -1.1868 0.8386 H 1 UNL11111111 0.1562 17 H -2.1491 0.5627 0.9619 H 1 UNL11111111 0.1726 18 H -0.2646 -2.4306 -0.7177 H 1 UNL11111111 0.1590 19 H -4.1179 0.7922 -0.6881 H 1 UNL11111111 0.1437 20 H -4.2836 -1.0051 -0.6575 H 1 UNL11111111 0.1157 21 H 0.6670 2.9645 -0.1551 H 1 UNL11111111 0.1579 22 H -0.9170 2.2533 0.1256 H 1 UNL11111111 0.1680 23 H -0.2586 2.3613 -1.5268 H 1 UNL11111111 0.1657 24 H 2.0916 -2.7850 0.0508 H 1 UNL11111111 0.1919 25 H -4.6231 -0.7034 1.6537 H 1 UNL11111111 0.3122 26 H 2.3186 2.5412 0.2971 H 1 UNL11111111 0.2977 @BOND 1 14 5 1 2 15 5 1 3 23 11 1 4 5 4 1 5 5 6 1 6 18 8 1 7 19 9 1 8 20 9 1 9 4 8 1 10 4 7 1 11 11 7 1 12 11 21 1 13 11 22 1 14 8 12 1 15 7 10 1 16 9 6 1 17 9 1 1 18 12 24 1 19 12 13 1 20 10 13 1 21 10 2 1 22 6 16 1 23 6 17 1 24 13 3 2 25 26 2 1 26 1 25 1