@MOLECULE (5r)-8-amino-5'-c-iodoguanosine 22 24 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 2.9493 1.0044 2.1753 O.2 1 UNL1 -0.2675 2 C 2.6257 0.6100 1.1007 C.2 1 UNL1 0.3645 3 C 1.3683 0.9006 0.4268 C.3 1 UNL1 -0.1459 4 O 0.4008 -0.0464 0.4781 O.3 1 UNL1 -0.0622 5 C -0.6623 0.3854 -0.2954 C.3 1 UNL1 0.0750 6 C -0.4172 1.7089 -0.8994 C.2 1 UNL1 0.3100 7 C 0.9814 2.0764 -0.3534 C.2 1 UNL1 0.3267 8 O 1.5811 3.0900 -0.5483 O.2 1 UNL1 -0.2469 9 O -1.0964 2.3137 -1.6678 O.2 1 UNL1 -0.2224 10 N -1.7597 -0.4156 -0.2495 N.ar 1 UNL1 -0.3353 11 C -1.7526 -1.8706 -0.3646 C.ar 1 UNL1 0.3121 12 N -0.7343 -2.6112 -0.5635 N.pl3 1 UNL1 -0.0940 13 N -3.1259 -2.3341 -0.2319 N.ar 1 UNL1 -0.1716 14 C -3.8741 -1.2962 -0.0415 C.ar 1 UNL1 -0.0228 15 C -3.0816 -0.0075 -0.0157 C.ar 1 UNL1 0.2884 16 N -3.5357 1.1815 0.1993 N.ar 1 UNL1 -0.3709 17 C -4.9622 1.2794 0.4072 C.ar 1 UNL1 0.2951 18 N -5.4628 2.4401 0.6194 N.pl3 1 UNL1 -0.0217 19 N -5.8227 0.1682 0.3881 N.ar 1 UNL1 -0.2961 20 C -5.3478 -1.1496 0.1763 C.ar 1 UNL1 0.4644 21 O -6.1259 -2.0644 0.1838 O.2 1 UNL1 -0.1674 22 I 3.9762 -0.6179 -0.1095 I 1 UNL1 -0.0117 @BOND 1 9 6 2 2 6 7 1 3 6 5 1 4 12 11 1 5 8 7 2 6 11 10 ar 7 11 13 ar 8 7 3 1 9 5 10 1 10 5 4 1 11 10 15 ar 12 13 14 ar 13 22 2 1 14 14 15 ar 15 14 20 ar 16 15 16 ar 17 20 21 2 18 20 19 ar 19 16 17 ar 20 19 17 ar 21 17 18 1 22 3 4 1 23 3 2 1 24 2 1 2