@MOLECULE 3-(2-deoxy-beta-d-erythro-pentofuranosyl)-6,7-dihydroxy-6-methyl-3,4,6,7-tetrahydro-9h-imidazo[1,2-a]purin-9-one 24 28 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 C -0.1015 0.9116 -0.0199 C.ar 1 UNL1 0.2565 2 C 0.8779 2.0989 0.0764 C.ar 1 UNL1 0.0770 3 N 0.2387 3.2111 0.0932 N.ar 1 UNL1 -0.4157 4 N -1.3647 1.5711 -0.0431 N.ar 1 UNL1 -0.4755 5 C -1.2170 2.9839 0.0167 C.ar 1 UNL1 0.5636 6 N 0.1874 -0.3387 -0.0742 N.ar 1 UNL1 -0.3020 7 N 2.5691 0.3887 0.0877 N.ar 1 UNL1 -0.6577 8 C 1.5525 -0.6577 -0.0414 C.ar 1 UNL1 0.4510 9 C 2.3385 1.7830 0.1327 C.ar 1 UNL1 0.5638 10 N 2.0673 -1.8540 -0.1047 N.pl3 1 UNL1 -0.3050 11 C 3.4931 -1.7250 0.0118 C.3 1 UNL1 -0.1463 12 C 3.8589 -0.2663 0.0781 C.2 1 UNL1 0.5695 13 O 3.2244 2.5786 0.2141 O.2 1 UNL1 -0.2648 14 C1* -2.5734 0.8943 -0.0982 C.2 1 UNL1 0.2985 15 C2* -3.8441 1.2311 -0.3417 C.2 1 UNL1 -0.1530 16 C3* -4.7724 0.1318 -0.2504 C.2 1 UNL1 0.5022 17 O3* -5.9577 0.0375 -0.3978 O.2 1 UNL1 -0.3980 18 C4* -3.8151 -0.9573 0.1003 C.2 1 UNL1 -0.3617 19 O4* -2.4821 -0.4788 0.1869 O.2 1 UNL1 -0.1357 20 C5* -4.0424 -2.2443 0.3151 C.1 1 UNL1 0.5389 21 O5* -4.2846 -3.3547 0.5042 O.2 1 UNL1 -0.1548 22 O 4.2592 -2.5858 -0.8775 O.3 1 UNL1 -0.2552 23 O 4.9102 0.2823 0.1536 O.2 1 UNL1 -0.3256 24 C 4.3731 -2.9667 0.3571 C.3 1 UNL1 0.5298 @BOND 1 22 11 1 2 22 24 1 3 17 16 2 4 15 16 1 5 15 14 2 6 16 18 1 7 10 8 1 8 10 11 1 9 14 4 1 10 14 19 1 11 6 8 ar 12 6 1 ar 13 4 1 ar 14 4 5 ar 15 8 7 ar 16 1 2 ar 17 11 12 1 18 11 24 1 19 5 3 ar 20 2 3 ar 21 2 9 ar 22 12 7 am 23 12 23 2 24 7 9 ar 25 18 19 1 26 18 20 2 27 9 13 2 28 20 21 2