@MOLECULE (2r,3s,4r,5e)-5-[(5-amino-2,6-dioxo-1,2,3,6-tetrahydro-4-pyrimidinyl)imino]-2,3,4-trihydroxypentyl dihydrogen phosphate 38 38 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 C 6.1463 0.4934 -0.3317 C.ar 1 UNL1 0.5802 2 C 4.7727 1.0332 -0.2061 C.ar 1 UNL1 -0.0050 3 C 3.7173 0.1830 0.0166 C.ar 1 UNL1 0.1943 4 N 3.9350 -1.2036 0.1525 N.ar 1 UNL1 -0.5604 5 N 6.2798 -0.8937 -0.1656 N.ar 1 UNL1 -0.6080 6 N 4.6567 2.4180 -0.1932 N.pl3 1 UNL1 -0.5422 7 O 5.3686 -2.9708 0.1443 O.2 1 UNL1 -0.4900 8 O 7.1274 1.1569 -0.5760 O.2 1 UNL1 -0.4637 9 O -6.4076 1.3109 -0.1216 O.3 1 UNL1 -0.3610 10 P -5.8646 -0.1451 -0.4989 P.3 1 UNL1 0.3582 11 O -6.9883 -1.0467 0.1621 O.3 1 UNL1 -0.2560 12 O -5.5873 -0.4696 -1.8833 O.2 1 UNL1 -0.2469 13 O -4.6766 -0.2273 0.5818 O.3 1 UNL1 -0.3755 14 C -3.4087 -0.8458 0.3260 C.3 1 UNL1 -0.0408 15 C -2.3721 0.2626 0.5841 C.3 1 UNL1 0.0771 16 O -2.4808 0.7365 1.9159 O.3 1 UNL1 -0.5801 17 C -0.9443 -0.3236 0.5238 C.3 1 UNL1 0.0970 18 O -0.7546 -1.0038 -0.6870 O.3 1 UNL1 -0.5447 19 C 0.0936 0.8170 0.6622 C.3 1 UNL1 0.0718 20 O -0.0720 1.6057 -0.4979 O.3 1 UNL1 -0.5554 21 C 1.4776 0.2217 0.7983 C.2 1 UNL1 0.0461 22 N 2.4053 0.6719 0.0307 N.2 1 UNL1 -0.3929 23 C 5.2058 -1.7740 0.0497 C.ar 1 UNL1 0.7004 24 H 3.1349 -1.8305 0.1930 H 1 UNL1 0.3423 25 H 7.2150 -1.3076 -0.2396 H 1 UNL1 0.3530 26 H 5.4165 2.9296 -0.6136 H 1 UNL1 0.3058 27 H 3.7403 2.7863 -0.3773 H 1 UNL1 0.2955 28 H -5.7845 2.0117 -0.5311 H 1 UNL1 0.3203 29 H -7.1313 -0.7323 1.1357 H 1 UNL1 0.3100 30 H -3.3565 -1.6404 1.1019 H 1 UNL1 0.1414 31 H -3.2512 -1.3117 -0.6682 H 1 UNL1 0.1600 32 H -2.4944 1.1314 -0.0988 H 1 UNL1 0.1512 33 H -3.4265 0.8842 2.1348 H 1 UNL1 0.3436 34 H -0.8031 -1.1093 1.2998 H 1 UNL1 0.1551 35 H -0.6864 -0.3559 -1.4307 H 1 UNL1 0.3416 36 H -0.1449 1.4771 1.5358 H 1 UNL1 0.1765 37 H 0.8022 1.9060 -0.8406 H 1 UNL1 0.3483 38 H 1.5762 -0.5617 1.5616 H 1 UNL1 0.1529 @BOND 1 12 10 2 2 35 18 1 3 37 20 1 4 18 17 1 5 31 14 1 6 26 6 1 7 8 1 2 8 28 9 1 9 10 9 1 10 10 11 1 11 10 13 1 12 20 19 1 13 27 6 1 14 1 2 ar 15 1 5 ar 16 25 5 1 17 2 6 1 18 2 3 ar 19 5 23 ar 20 32 15 1 21 3 22 1 22 3 4 ar 23 22 21 2 24 23 7 2 25 23 4 ar 26 4 24 1 27 11 29 1 28 14 13 1 29 14 15 1 30 14 30 1 31 17 15 1 32 17 19 1 33 17 34 1 34 15 16 1 35 19 21 1 36 19 36 1 37 21 38 1 38 16 33 1