@MOLECULE 2-nitro-1-(alpha-d-ribofuranosyl)-1h-imidazole 28 29 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O4* 1.4610 0.4315 -0.9376 O.3 1 UNL1 -0.4164 2 O2* -0.3228 -1.7140 1.2289 O.3 1 UNL1 -0.5406 3 O3* 1.5441 -0.1844 2.2356 O.3 1 UNL1 -0.5327 4 O5* 4.2537 0.7778 -1.4182 O.3 1 UNL1 -0.5234 5 O -3.9836 -0.5539 -0.9156 O.2 1 UNL1 -0.2522 6 O -2.1512 -1.6794 -0.7466 O.2 1 UNL1 -0.5122 7 N -0.7003 0.6300 -0.1450 N.ar 1 UNL1 -0.2351 8 N -2.6831 1.5967 0.3944 N.ar 1 UNL1 -0.2546 9 N -2.8122 -0.6365 -0.6438 N.pl3 1 UNL1 0.6537 10 C2* 0.6757 -1.4422 0.2952 C.3 1 UNL1 0.0432 11 C3* 1.8949 -0.8582 1.0556 C.3 1 UNL1 0.0867 12 C1* 0.2931 -0.3024 -0.7057 C.3 1 UNL1 0.2200 13 C4* 2.4591 0.1881 0.0739 C.3 1 UNL1 0.0058 14 C5* 3.6997 -0.2900 -0.6854 C.3 1 UNL1 -0.0325 15 C -2.0989 0.5056 -0.1586 C.ar 1 UNL1 0.0359 16 C -0.4242 1.8497 0.4317 C.ar 1 UNL1 -0.0542 17 C -1.6673 2.4336 0.7642 C.ar 1 UNL1 -0.0841 18 H2* 0.9234 -2.3765 -0.2541 H 1 UNL1 0.1565 19 H3* 2.6264 -1.6309 1.3687 H 1 UNL1 0.1614 20 H1* -0.0571 -0.6596 -1.7072 H 1 UNL1 0.1814 21 H4* 2.6312 1.1729 0.5641 H 1 UNL1 0.1768 22 H5*1 3.4711 -1.1246 -1.3730 H 1 UNL1 0.1307 23 H5*2 4.5175 -0.5805 0.0036 H 1 UNL1 0.1562 24 H2* -1.1768 -1.8749 0.7495 H 1 UNL1 0.3595 25 H3* 0.5686 -0.2338 2.3788 H 1 UNL1 0.3477 26 H 0.5740 2.2276 0.5665 H 1 UNL1 0.1999 27 H -1.8601 3.3823 1.2357 H 1 UNL1 0.1997 28 H5* 3.5761 1.1522 -2.0248 H 1 UNL1 0.3227 @BOND 1 28 4 1 2 20 12 1 3 4 14 1 4 22 14 1 5 1 12 1 6 1 13 1 7 5 9 2 8 6 9 2 9 12 7 1 10 12 10 1 11 14 23 1 12 14 13 1 13 9 15 1 14 18 10 1 15 15 7 ar 16 15 8 ar 17 7 16 ar 18 13 21 1 19 13 11 1 20 10 11 1 21 10 2 1 22 8 17 ar 23 16 26 1 24 16 17 ar 25 24 2 1 26 17 27 1 27 11 19 1 28 11 3 1 29 3 25 1