@MOLECULE 9-(5-o-phosphono-beta-l-lyxofuranosyl)-1,9-dihydro-6h-purine-6-thione 23 26 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O -2.7506 -3.0271 -0.4177 O.2 1 UNL1 -0.2489 2 C -1.8388 -2.2785 -0.2409 C.2 1 UNL1 0.3295 3 C -1.8254 -0.8329 -0.0144 C.2 1 UNL1 -0.1616 4 C -2.9103 0.0968 0.0512 C.2 1 UNL1 0.5818 5 O -4.1687 -0.2163 -0.1137 O.2 1 UNL1 -0.3104 6 P -4.5923 1.5225 0.1458 P.3 1 UNL1 0.3850 7 O -4.8620 2.0768 -1.1517 O.2 1 UNL1 -0.1814 8 O -5.1032 1.6297 1.4841 O.3 1 UNL1 -0.1841 9 O -2.7996 1.3774 0.2891 O.2 1 UNL1 -0.3053 10 O -0.5797 -0.3274 0.1462 O.2 1 UNL1 0.0285 11 C 0.3243 -1.3713 0.0499 C.3 1 UNL1 0.0644 12 C -0.3381 -2.6598 -0.2052 C.2 1 UNL1 0.3040 13 O 0.1474 -3.7360 -0.3718 O.2 1 UNL1 -0.2502 14 N 1.6415 -1.0629 0.1840 N.ar 1 UNL1 -0.4461 15 C 2.7015 -1.9916 0.6445 C.ar 1 UNL1 0.5484 16 N 3.8991 -1.2467 0.6015 N.ar 1 UNL1 -0.5580 17 C 3.6820 -0.0062 0.1795 C.ar 1 UNL1 0.0588 18 C 2.2008 0.1871 -0.1134 C.ar 1 UNL1 0.2620 19 N 1.6926 1.3173 -0.5637 N.ar 1 UNL1 -0.3763 20 C 2.6720 2.2483 -0.7068 C.ar 1 UNL1 0.3852 21 N 3.9387 2.2994 -0.5212 N.ar 1 UNL1 -0.3897 22 C 4.5254 1.1094 -0.0446 C.ar 1 UNL1 -0.0939 23 S 6.1506 1.1273 0.2077 S.2 1 UNL1 0.5581 @BOND 1 7 6 2 2 20 19 ar 3 20 21 ar 4 19 18 ar 5 21 22 ar 6 1 2 2 7 13 12 2 8 2 12 1 9 2 3 1 10 12 11 1 11 5 4 1 12 5 6 1 13 18 17 ar 14 18 14 ar 15 22 17 ar 16 22 23 2 17 3 4 2 18 3 10 1 19 11 10 1 20 11 14 1 21 4 9 1 22 6 9 1 23 6 8 1 24 17 16 ar 25 14 15 ar 26 16 15 ar