@MOLECULE 1-[(2r,4s,5r)-4-hydroxy-5-{[(methylsulfanyl)oxy]methyl}tetrahydro-2-furanyl]-5-methyl-2,4(1h,3h)-pyrimidinedione 35 36 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 S -2.5719 2.4657 0.0641 S.3 1 UNL1 0.2526 2 O -1.1405 -0.6032 -0.8767 O.3 1 UNL1 -0.4343 3 O -2.6829 -3.1434 0.2320 O.3 1 UNL1 -0.5475 4 O -2.9345 1.1592 1.0705 O.3 1 UNL1 -0.4259 5 O 2.4589 -2.5147 -0.3406 O.2 1 UNL1 -0.5312 6 O 4.4351 1.4395 0.6331 O.2 1 UNL1 -0.4756 7 N 1.1533 -0.6369 -0.4578 N.ar 1 UNL1 -0.5134 8 N 3.4569 -0.5237 0.1580 N.ar 1 UNL1 -0.6259 9 C -1.6616 -2.3005 0.7192 C.3 1 UNL1 0.1174 10 C -0.0239 -1.4546 -0.8823 C.3 1 UNL1 0.3417 11 C -0.3082 -2.6254 0.0713 C.3 1 UNL1 -0.3899 12 C -2.0363 -0.8982 0.1961 C.3 1 UNL1 0.0517 13 C -1.9335 0.1894 1.2685 C.3 1 UNL1 -0.0873 14 C 1.0773 0.7472 -0.4271 C.ar 1 UNL1 0.1196 15 C 2.3709 -1.3084 -0.2243 C.ar 1 UNL1 0.7025 16 C 2.1398 1.5088 -0.0603 C.ar 1 UNL1 -0.2445 17 C 3.4166 0.8954 0.2784 C.ar 1 UNL1 0.6034 18 C 2.0615 2.9881 0.0202 C.3 1 UNL1 -0.4045 19 C -3.0453 1.8603 -1.5698 C.3 1 UNL1 -0.5497 20 H -1.6446 -2.3768 1.8247 H 1 UNL1 0.1308 21 H 0.1183 -1.7460 -1.9529 H 1 UNL1 0.1601 22 H 0.4856 -2.7727 0.8270 H 1 UNL1 0.1898 23 H -0.3453 -3.5788 -0.4902 H 1 UNL1 0.1841 24 H -3.0413 -0.8999 -0.2949 H 1 UNL1 0.1860 25 H -0.9192 0.6223 1.3297 H 1 UNL1 0.1489 26 H -2.2070 -0.2014 2.2739 H 1 UNL1 0.1562 27 H -2.5247 -4.0742 0.4868 H 1 UNL1 0.3219 28 H 0.1111 1.1921 -0.7146 H 1 UNL1 0.2015 29 H 4.3408 -1.0041 0.3456 H 1 UNL1 0.3463 30 H 3.0491 3.4573 -0.1313 H 1 UNL1 0.1728 31 H 1.7113 3.3159 1.0125 H 1 UNL1 0.1613 32 H 1.3822 3.4181 -0.7282 H 1 UNL1 0.1535 33 H -4.0544 1.4308 -1.5716 H 1 UNL1 0.1742 34 H -2.3567 1.0952 -1.9510 H 1 UNL1 0.1784 35 H -3.0385 2.7031 -2.2724 H 1 UNL1 0.1749 @BOND 1 35 19 1 2 21 10 1 3 34 19 1 4 33 19 1 5 19 1 1 6 10 2 1 7 10 7 1 8 10 11 1 9 2 12 1 10 32 18 1 11 28 14 1 12 23 11 1 13 7 14 ar 14 7 15 ar 15 14 16 ar 16 5 15 2 17 24 12 1 18 15 8 ar 19 30 18 1 20 16 18 1 21 16 17 ar 22 18 31 1 23 1 4 1 24 11 9 1 25 11 22 1 26 8 17 ar 27 8 29 1 28 12 9 1 29 12 13 1 30 3 27 1 31 3 9 1 32 17 6 2 33 9 20 1 34 4 13 1 35 13 25 1 36 13 26 1