@MOLECULE pyrimidin-2-one b-ribofuranoside 28 29 0 0 0 SMALL USER_CHARGES @ATOM 1 O4* -1.0485 0.6700 -1.0505 O.3 1 UNL11111111 -0.3989 2 O2* -1.0710 -2.5348 0.2082 O.3 1 UNL11111111 -0.5502 3 O3* -3.3524 -1.2464 -0.1472 O.3 1 UNL11111111 -0.5338 4 O5* -1.2692 3.0533 0.1475 O.3 1 UNL11111111 -0.5335 5 O 1.6176 -2.1794 -0.0329 O.2 1 UNL11111111 -0.5287 6 N 1.0833 0.0063 -0.3213 N.am 1 UNL11111111 -0.4917 7 N 3.3304 -0.6525 0.2863 N.2 1 UNL11111111 -0.4895 8 C2* -0.9594 -1.1713 0.4965 C.3 1 UNL11111111 0.0410 9 C3* -2.3695 -0.5356 0.5527 C.3 1 UNL11111111 0.0937 10 C1* -0.2720 -0.4443 -0.7004 C.3 1 UNL11111111 0.2256 11 C4* -2.1640 0.8175 -0.1699 C.3 1 UNL11111111 0.0089 12 C5* -1.8662 1.9594 0.8071 C.3 1 UNL11111111 -0.0503 13 C 1.4381 1.3234 -0.2969 C.2 1 UNL11111111 0.1840 14 C 2.0403 -1.0426 -0.0128 C.1 1 UNL11111111 0.6904 15 C 2.7349 1.6661 0.0236 C.2 1 UNL11111111 -0.4378 16 C 3.6595 0.6260 0.3028 C.2 1 UNL11111111 0.2066 17 H2* -0.4091 -1.0463 1.4530 H 1 UNL11111111 0.1491 18 H3* -2.7625 -0.4355 1.5852 H 1 UNL11111111 0.1518 19 H1* -0.2044 -1.0779 -1.6233 H 1 UNL11111111 0.1806 20 H4* -3.0033 1.0486 -0.8633 H 1 UNL11111111 0.1738 21 H5*1 -1.1070 1.6894 1.5659 H 1 UNL11111111 0.1479 22 H5*2 -2.7847 2.3077 1.3157 H 1 UNL11111111 0.1344 23 H2* -0.1486 -2.9032 0.1036 H 1 UNL11111111 0.3734 24 H3* -2.9842 -2.0945 -0.4969 H 1 UNL11111111 0.3526 25 H 0.6635 2.0785 -0.5314 H 1 UNL11111111 0.2106 26 H5* -1.7348 3.2534 -0.6918 H 1 UNL11111111 0.3211 27 H 3.0452 2.7037 0.0589 H 1 UNL11111111 0.1896 28 H 4.7093 0.8537 0.5494 H 1 UNL11111111 0.1794 @BOND 1 19 10 1 2 1 10 1 3 1 11 1 4 20 11 1 5 10 6 1 6 10 8 1 7 26 4 1 8 25 13 1 9 24 3 1 10 6 13 1 11 6 14 am 12 13 15 2 13 11 9 1 14 11 12 1 15 3 9 1 16 5 14 2 17 14 7 2 18 15 27 1 19 15 16 1 20 23 2 1 21 4 12 1 22 2 8 1 23 7 16 2 24 16 28 1 25 8 9 1 26 8 17 1 27 9 18 1 28 12 22 1 29 12 21 1