@MOLECULE 3-carbamoyl-1-(5-o-phosphono-beta-d-ribofuranosyl)pyridinium 38 39 0 0 0 SMALL GASTEIGER @ATOM 1 O -4.7463 -1.8054 -1.1026 O.2 1 UNL1111 -0.2218 2 P -4.5924 -1.0337 0.1122 P.3 1 UNL1111 0.3575 3 O -4.9391 -1.7414 1.5021 O.3 1 UNL1111 -0.3440 4 O -5.5263 0.2467 0.1355 O.3 1 UNL1111 -0.2878 5 O -3.1441 -0.4656 0.5250 O.3 1 UNL1111 -0.3806 6 C -2.0592 -0.3078 -0.4012 C.3 1 UNL1111 -0.0113 7 C -1.3037 0.8880 0.2018 C.3 1 UNL1111 0.0256 8 O -0.1382 0.3447 0.8214 O.3 1 UNL1111 -0.4166 9 C -0.8639 1.9635 -0.8097 C.3 1 UNL1111 0.0521 10 O -1.5248 3.1759 -0.5853 O.3 1 UNL1111 -0.5237 11 C 0.6633 2.1167 -0.5897 C.3 1 UNL1111 0.0150 12 O 0.9502 3.3440 0.0355 O.3 1 UNL1111 -0.5370 13 C 1.0346 1.0485 0.4793 C.3 1 UNL1111 0.2557 14 N 1.9985 0.0859 -0.0486 N.ar 1 UNL1111 -0.3246 15 C 3.2927 0.0801 0.4376 C.ar 1 UNL1111 0.0818 16 C 4.2199 -0.8196 -0.0314 C.ar 1 UNL1111 -0.1919 17 C 5.5882 -0.6832 0.5161 C.2 1 UNL1111 0.6072 18 O 5.9008 0.2377 1.2536 O.2 1 UNL1111 -0.5534 19 N 6.5460 -1.6219 0.1888 N.am 1 UNL1111 -0.6802 20 C 3.8440 -1.7922 -0.9990 C.ar 1 UNL1111 -0.2250 21 C 2.5213 -1.8089 -1.4409 C.ar 1 UNL1111 -0.1090 22 C 1.5985 -0.8867 -0.9712 C.ar 1 UNL1111 -0.1096 23 H -4.0623 -2.0099 1.9680 H 1 UNL1111 0.3249 24 H -5.4240 0.7269 1.0387 H 1 UNL1111 0.3086 25 H -2.3515 -0.1298 -1.4528 H 1 UNL1111 0.1394 26 H -1.4438 -1.2344 -0.3393 H 1 UNL1111 0.1494 27 H -1.8904 1.3398 1.0415 H 1 UNL1111 0.1730 28 H -1.1340 1.7298 -1.8611 H 1 UNL1111 0.1619 29 H -1.3163 3.5302 0.3123 H 1 UNL1111 0.3286 30 H 1.2533 2.0256 -1.5222 H 1 UNL1111 0.1533 31 H 0.7760 4.0910 -0.5826 H 1 UNL1111 0.3362 32 H 1.4112 1.5135 1.4290 H 1 UNL1111 0.1761 33 H 3.5532 0.8404 1.1892 H 1 UNL1111 0.1915 34 H 7.4705 -1.5294 0.5602 H 1 UNL1111 0.3136 35 H 6.3639 -2.4057 -0.3929 H 1 UNL1111 0.3029 36 H 4.5606 -2.4996 -1.3860 H 1 UNL1111 0.1462 37 H 2.2024 -2.5543 -2.1687 H 1 UNL1111 0.1532 38 H 0.5566 -0.8847 -1.2664 H 1 UNL1111 0.1627 @BOND 1 1 2 2 2 2 3 1 3 2 4 1 4 2 5 1 5 3 23 1 6 4 24 1 7 5 6 1 8 6 7 1 9 6 25 1 10 6 26 1 11 7 8 1 12 7 9 1 13 7 27 1 14 8 13 1 15 9 10 1 16 9 11 1 17 9 28 1 18 10 29 1 19 11 12 1 20 11 13 1 21 11 30 1 22 12 31 1 23 13 14 1 24 13 32 1 25 14 15 ar 26 14 22 ar 27 15 16 ar 28 15 33 1 29 16 17 1 30 16 20 ar 31 17 18 2 32 17 19 am 33 19 34 1 34 19 35 1 35 20 21 ar 36 20 36 1 37 21 22 ar 38 21 37 1 39 22 38 1