@MOLECULE 6-oxo-1-(beta-d-ribofuranosyl)-1,6-dihydro-3-pyridinecarboxylic acid 32 33 0 0 0 SMALL USER_CHARGES @ATOM 1 O4* -1.2454 0.8261 -0.9238 O.3 1 UNL11111111 -0.1593 2 O2* -2.7510 -2.0799 0.2735 O.3 1 UNL11111111 -0.4096 3 O3* -4.2428 0.0216 -0.2002 O.3 1 UNL11111111 -0.4851 4 O5* -1.3296 3.5896 0.0601 O.3 1 UNL11111111 -0.3193 5 O -0.2380 -2.9911 -0.0876 O.2 1 UNL11111111 -0.4093 6 O 4.7643 0.6296 0.2374 O.3 1 UNL11111111 -0.4511 7 O 3.2283 2.2032 -0.1400 O.2 1 UNL11111111 -0.3519 8 N 0.3017 -0.8069 -0.3016 N.am 1 UNL11111111 0.3594 9 C2* -2.0650 -0.8909 0.5386 C.3 1 UNL11111111 -0.5331 10 C3* -3.0805 0.2779 0.5418 C.3 1 UNL11111111 0.2218 11 C1* -1.1166 -0.5441 -0.6469 C.3 1 UNL11111111 -0.4336 12 C4* -2.3248 1.4130 -0.1809 C.3 1 UNL11111111 0.0467 13 C5* -1.7217 2.4430 0.7769 C.3 1 UNL11111111 -0.5959 14 C 1.2229 0.1916 -0.2883 C.2 1 UNL11111111 -0.3591 15 C 0.6669 -2.1794 -0.0545 C.2 1 UNL11111111 0.2379 16 C 2.5521 -0.0839 -0.0101 C.2 1 UNL11111111 0.0770 17 C 2.0581 -2.4294 0.2111 C.2 1 UNL11111111 -0.4033 18 C 2.9711 -1.4204 0.2350 C.2 1 UNL11111111 -0.1221 19 C 3.4858 1.0335 0.0122 C.2 1 UNL11111111 0.2347 20 H2* -1.5308 -0.9887 1.5064 H 1 UNL11111111 0.3136 21 H3* -3.4285 0.5449 1.5607 H 1 UNL11111111 0.1410 22 H1* -1.3707 -1.0972 -1.5884 H 1 UNL11111111 0.3065 23 H4* -2.9528 1.8965 -0.9679 H 1 UNL11111111 0.1947 24 H5*1 -0.8632 2.0416 1.3427 H 1 UNL11111111 0.2303 25 H5*2 -2.4805 2.8382 1.4822 H 1 UNL11111111 0.3103 26 H2* -2.0800 -2.8028 0.1208 H 1 UNL11111111 0.4381 27 H3* -4.3073 -0.9393 -0.4212 H 1 UNL11111111 0.3935 28 H 0.8861 1.2240 -0.5057 H 1 UNL11111111 0.3480 29 H 2.3278 -3.4704 0.3873 H 1 UNL11111111 0.2388 30 H5* -0.5911 3.3728 -0.5496 H 1 UNL11111111 0.3047 31 H 4.0315 -1.6125 0.4385 H 1 UNL11111111 0.2658 32 H 5.4075 1.3834 0.2534 H 1 UNL11111111 0.3698 @BOND 1 22 11 1 2 23 12 1 3 1 11 1 4 1 12 1 5 11 8 1 6 11 9 1 7 30 4 1 8 28 14 1 9 27 3 1 10 8 14 1 11 8 15 am 12 14 16 2 13 3 10 1 14 12 10 1 15 12 13 1 16 7 19 2 17 5 15 2 18 15 17 1 19 16 19 1 20 16 18 1 21 19 6 1 22 4 13 1 23 26 2 1 24 17 18 2 25 17 29 1 26 18 31 1 27 6 32 1 28 2 9 1 29 9 10 1 30 9 20 1 31 10 21 1 32 13 24 1 33 13 25 1