@MOLECULE (1r,2r,5r)-5-(4-amino-1h-imidazo[4,5-c]pyridin-1-yl)-3-(hydroxymethyl)-3-cyclopentene-1,2-diol 33 35 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 C 3.6545 1.6479 0.6844 C.ar 1 UNL1 0.1634 2 N 4.4586 0.6951 0.1614 N.ar 1 UNL1 -0.5217 3 C 3.9204 -0.4889 -0.2458 C.ar 1 UNL1 0.4503 4 C 2.5224 -0.7147 -0.1254 C.ar 1 UNL1 -0.1673 5 C 1.7128 0.3235 0.4351 C.ar 1 UNL1 0.1883 6 C 2.2750 1.5330 0.8540 C.ar 1 UNL1 -0.3951 7 N 0.4165 -0.1842 0.4239 N.ar 1 UNL1 -0.3604 8 C 0.4804 -1.4870 -0.1424 C.ar 1 UNL1 0.1098 9 N 1.7257 -1.8086 -0.4668 N.ar 1 UNL1 -0.3400 10 C -0.7830 0.5284 0.8142 C.3 1 UNL1 0.0195 11 C -1.8353 -0.4353 1.3185 C.2 1 UNL1 -0.2351 12 C -2.9278 -0.4547 0.5469 C.2 1 UNL1 -0.0848 13 C -2.8211 0.4989 -0.6249 C.3 1 UNL1 0.0902 14 C -1.4761 1.2543 -0.4113 C.3 1 UNL1 0.0680 15 O -0.7390 1.2644 -1.5902 O.3 1 UNL1 -0.5097 16 O -3.9235 1.3724 -0.6531 O.3 1 UNL1 -0.5313 17 C -4.1602 -1.2596 0.7402 C.3 1 UNL1 -0.0021 18 O -5.1494 -1.0114 -0.2317 O.3 1 UNL1 -0.5507 19 N 4.7635 -1.4279 -0.7590 N.pl3 1 UNL1 -0.5657 20 H 4.1862 2.5651 0.9798 H 1 UNL1 0.1741 21 H 1.6856 2.3333 1.2729 H 1 UNL1 0.1769 22 H -0.3946 -2.1077 -0.2555 H 1 UNL1 0.1992 23 H -0.5173 1.2827 1.6014 H 1 UNL1 0.1706 24 H -1.6416 -1.0089 2.2092 H 1 UNL1 0.1751 25 H -2.8732 -0.0014 -1.6203 H 1 UNL1 0.1869 26 H -1.6402 2.3338 -0.2038 H 1 UNL1 0.1607 27 H -0.1337 0.4941 -1.6606 H 1 UNL1 0.3277 28 H -3.9514 1.9443 0.1434 H 1 UNL1 0.3184 29 H -4.6181 -1.0789 1.7361 H 1 UNL1 0.1361 30 H -3.9677 -2.3504 0.6336 H 1 UNL1 0.1591 31 H -5.1429 -0.0661 -0.5058 H 1 UNL1 0.3428 32 H 5.7397 -1.2353 -0.8563 H 1 UNL1 0.3208 33 H 4.3974 -2.2993 -1.0877 H 1 UNL1 0.3261 @BOND 1 27 15 1 2 25 13 1 3 15 14 1 4 33 19 1 5 32 19 1 6 19 3 1 7 16 13 1 8 16 28 1 9 13 14 1 10 13 12 1 11 31 18 1 12 9 8 ar 13 9 4 ar 14 14 26 1 15 14 10 1 16 22 8 1 17 3 4 ar 18 3 2 ar 19 18 17 1 20 8 7 ar 21 4 5 ar 22 2 1 ar 23 7 5 ar 24 7 10 1 25 5 6 ar 26 12 17 1 27 12 11 2 28 30 17 1 29 1 6 ar 30 1 20 1 31 17 29 1 32 10 11 1 33 10 23 1 34 6 21 1 35 11 24 1