@MOLECULE [(2r,3r,4s,5s)-3,4-dihydroxy-5-(4-oxo-4,5-dihydro-1h-pyrrolo[3,2-d]pyrimidin-7-yl)-2-pyrrolidinyl]methyl dihydrogen phosphate 38 40 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 P -2.7567 -1.7978 -0.0691 P.3 1 UNL1 0.3819 2 O -0.6217 2.9466 -1.8835 O.3 1 UNL1 -0.5273 3 O -2.6532 3.0648 -0.3106 O.3 1 UNL1 -0.5259 4 O -2.8661 -0.6395 1.0115 O.3 1 UNL1 -0.1791 5 O -1.5832 -2.7763 0.4111 O.3 1 UNL1 -0.4370 6 O -1.9252 -1.0632 -1.2300 O.3 1 UNL1 -0.4042 7 O 5.1038 -1.6565 0.0207 O.2 1 UNL1 -0.4421 8 O -4.0513 -2.3684 -0.3722 O.2 1 UNL1 -0.2420 9 N -0.3356 2.0772 1.4794 N.3 1 UNL1 -0.5617 10 N 3.9113 1.1044 0.3794 N.ar 1 UNL1 -0.2221 11 N 1.1105 -0.9668 -0.3921 N.ar 1 UNL1 -0.4711 12 N 2.9828 -2.4561 -0.3452 N.ar 1 UNL1 -0.5487 13 C 0.4059 2.2453 0.1970 C.3 1 UNL1 0.0078 14 C -1.6722 1.4905 1.2086 C.3 1 UNL1 -0.0501 15 C -0.5854 1.8939 -0.9494 C.3 1 UNL1 0.0545 16 C -1.9824 1.8365 -0.2737 C.3 1 UNL1 0.1413 17 C 1.6764 1.4865 0.1607 C.ar 1 UNL1 -0.2441 18 C -1.7051 -0.0098 1.5897 C.3 1 UNL1 -0.0910 19 C 1.9255 0.1067 -0.0760 C.ar 1 UNL1 0.1348 20 C 2.9326 2.0663 0.4354 C.ar 1 UNL1 -0.0260 21 C 3.3184 -0.1084 0.0702 C.ar 1 UNL1 -0.2192 22 C 3.9225 -1.4312 -0.0773 C.ar 1 UNL1 0.5945 23 C 1.7083 -2.2260 -0.4781 C.ar 1 UNL1 0.3112 24 H 0.6267 3.3525 0.1326 H 1 UNL1 0.1696 25 H -2.4077 2.0455 1.8523 H 1 UNL1 0.1764 26 H -0.3418 0.9538 -1.4775 H 1 UNL1 0.1290 27 H -2.7003 1.1663 -0.7849 H 1 UNL1 0.1793 28 H 0.2047 1.5525 2.1601 H 1 UNL1 0.2667 29 H -1.9297 -0.1135 2.6784 H 1 UNL1 0.1427 30 H -0.7258 -0.4908 1.4137 H 1 UNL1 0.1353 31 H 3.1482 3.0957 0.6662 H 1 UNL1 0.1801 32 H 0.2262 2.9883 -2.3732 H 1 UNL1 0.3154 33 H -2.0290 3.8138 -0.1848 H 1 UNL1 0.3287 34 H 4.8929 1.2238 0.5278 H 1 UNL1 0.3294 35 H 0.1113 -0.8505 -0.5020 H 1 UNL1 0.3460 36 H 1.0167 -3.0667 -0.6800 H 1 UNL1 0.2005 37 H -1.9655 -3.4989 1.0193 H 1 UNL1 0.3346 38 H -2.0234 -1.5983 -2.0964 H 1 UNL1 0.3318 @BOND 1 32 2 1 2 38 6 1 3 2 15 1 4 26 15 1 5 6 1 1 6 15 16 1 7 15 13 1 8 27 16 1 9 36 23 1 10 35 11 1 11 23 11 ar 12 23 12 ar 13 11 19 ar 14 8 1 2 15 12 22 ar 16 3 16 1 17 3 33 1 18 16 14 1 19 22 7 2 20 22 21 ar 21 19 21 ar 22 19 17 ar 23 1 5 1 24 1 4 1 25 21 10 ar 26 24 13 1 27 17 13 1 28 17 20 ar 29 13 9 1 30 10 20 ar 31 10 34 1 32 5 37 1 33 20 31 1 34 4 18 1 35 14 9 1 36 14 18 1 37 14 25 1 38 30 18 1 39 9 28 1 40 18 29 1