@MOLECULE (5r)-5-(7-amino-2h-pyrazolo[4,3-d]pyrimidin-3-yl)-2,5-anhydro-d-ribitol 32 34 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 1.7445 0.6836 1.3639 O.3 1 UNL1 -0.4142 2 O 2.5088 1.5430 -1.8233 O.3 1 UNL1 -0.5343 3 O 4.1575 -0.0256 -0.6475 O.3 1 UNL1 -0.5578 4 O 1.4354 -2.5197 0.6036 O.3 1 UNL1 -0.5668 5 N -1.0841 2.1246 0.7753 N.ar 1 UNL1 -0.0975 6 N -2.3885 1.8241 0.7368 N.ar 1 UNL1 -0.2103 7 N -0.9353 -1.1276 -0.7279 N.ar 1 UNL1 -0.4974 8 N -3.3279 -1.4662 -0.7523 N.ar 1 UNL1 -0.5731 9 N -4.8617 0.0725 0.0850 N.pl3 1 UNL1 -0.5583 10 C 1.8455 0.5892 -1.0452 C.3 1 UNL1 0.0747 11 C 1.2057 1.2721 0.1898 C.3 1 UNL1 0.0730 12 C 2.8247 -0.4612 -0.4526 C.3 1 UNL1 0.0660 13 C 2.5956 -0.4215 1.0632 C.3 1 UNL1 0.0373 14 C -0.2695 1.1328 0.2421 C.ar 1 UNL1 -0.0570 15 C 1.9360 -1.6928 1.6227 C.3 1 UNL1 -0.0259 16 C -1.1391 0.1007 -0.1603 C.ar 1 UNL1 0.1127 17 C -2.4701 0.5888 0.1623 C.ar 1 UNL1 -0.1674 18 C -3.5719 -0.2737 -0.1703 C.ar 1 UNL1 0.4651 19 C -2.0290 -1.8355 -1.0001 C.ar 1 UNL1 0.2922 20 H 1.1018 0.1505 -1.7458 H 1 UNL1 0.1798 21 H 1.5214 2.3441 0.2470 H 1 UNL1 0.1554 22 H 2.7023 -1.4712 -0.8982 H 1 UNL1 0.1673 23 H 3.5378 -0.1773 1.6089 H 1 UNL1 0.1633 24 H 1.1274 -1.4330 2.3321 H 1 UNL1 0.1368 25 H 2.6770 -2.3415 2.1272 H 1 UNL1 0.1434 26 H 3.3482 1.8265 -1.3860 H 1 UNL1 0.3308 27 H 4.4369 -0.1974 -1.5717 H 1 UNL1 0.3255 28 H -0.7987 2.9949 1.1928 H 1 UNL1 0.3374 29 H 0.6493 -2.1085 0.1701 H 1 UNL1 0.3484 30 H -1.9041 -2.8285 -1.4672 H 1 UNL1 0.2005 31 H -5.0776 0.9454 0.5232 H 1 UNL1 0.3243 32 H -5.6108 -0.5514 -0.1509 H 1 UNL1 0.3262 @BOND 1 2 26 1 2 2 10 1 3 20 10 1 4 27 3 1 5 30 19 1 6 10 12 1 7 10 11 1 8 19 8 ar 9 19 7 ar 10 22 12 1 11 8 18 ar 12 7 16 ar 13 3 12 1 14 12 13 1 15 18 9 1 16 18 17 ar 17 16 17 ar 18 16 14 ar 19 32 9 1 20 9 31 1 21 17 6 ar 22 29 4 1 23 11 14 1 24 11 21 1 25 11 1 1 26 14 5 ar 27 4 15 1 28 6 5 ar 29 5 28 1 30 13 1 1 31 13 23 1 32 13 15 1 33 15 25 1 34 15 24 1