@MOLECULE 4-amino-5-fluoro-1-(beta-l-ribofuranosyl)-2(1h)-pyrimidinone 30 31 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 F -3.1202 2.0284 -0.0673 F 1 UNL1 -0.1224 2 O4* 1.4552 0.7549 -1.0469 O.3 1 UNL1 -0.3971 3 O2* 2.1577 -2.3658 0.2181 O.3 1 UNL1 -0.5558 4 O3* 4.0988 -0.5920 -0.0415 O.3 1 UNL1 -0.5363 5 O5* 1.1191 3.1446 0.1374 O.3 1 UNL1 -0.5300 6 O -0.5332 -2.6211 -0.1038 O.2 1 UNL1 -0.5370 7 N -0.4977 -0.3679 -0.3796 N.ar 1 UNL1 -0.5123 8 N -2.5466 -1.5360 0.1605 N.ar 1 UNL1 -0.6077 9 N -4.5245 -0.3936 0.4333 N.pl3 1 UNL1 -0.5549 10 C2* 1.7269 -1.0660 0.5032 C.3 1 UNL1 0.0436 11 C3* 2.9512 -0.1260 0.6129 C.3 1 UNL1 0.0894 12 C1* 0.9335 -0.5049 -0.7174 C.3 1 UNL1 0.2383 13 C4* 2.4742 1.1472 -0.1258 C.3 1 UNL1 0.0095 14 C5* 1.8900 2.1903 0.8319 C.3 1 UNL1 -0.0508 15 C -1.1303 0.8399 -0.3717 C.ar 1 UNL1 0.1483 16 C -1.2095 -1.6131 -0.0972 C.ar 1 UNL1 0.7260 17 C -2.4767 0.8730 -0.0929 C.ar 1 UNL1 -0.1796 18 C -3.1909 -0.3512 0.1673 C.ar 1 UNL1 0.4725 19 H2* 1.1282 -1.0798 1.4388 H 1 UNL1 0.1504 20 H3* 3.2682 0.0575 1.6599 H 1 UNL1 0.1500 21 H1* 1.0352 -1.1339 -1.6399 H 1 UNL1 0.1789 22 H4* 3.2663 1.5631 -0.7874 H 1 UNL1 0.1715 23 H5*1 2.6847 2.7143 1.3948 H 1 UNL1 0.1321 24 H5*2 1.1594 1.7591 1.5433 H 1 UNL1 0.1500 25 H2* 1.3465 -2.9321 0.0803 H 1 UNL1 0.3746 26 H3* 3.9486 -1.5003 -0.3998 H 1 UNL1 0.3523 27 H -0.5391 1.7551 -0.5824 H 1 UNL1 0.2288 28 H5* 1.5796 3.4452 -0.6740 H 1 UNL1 0.3197 29 H -4.9686 -1.2789 0.6075 H 1 UNL1 0.3277 30 H -5.0844 0.4308 0.4675 H 1 UNL1 0.3202 @BOND 1 21 12 1 2 2 12 1 3 2 13 1 4 22 13 1 5 12 7 1 6 12 10 1 7 28 5 1 8 27 15 1 9 26 4 1 10 7 15 ar 11 7 16 ar 12 15 17 ar 13 13 11 1 14 13 14 1 15 6 16 2 16 16 8 ar 17 17 1 1 18 17 18 ar 19 4 11 1 20 25 3 1 21 5 14 1 22 8 18 ar 23 18 9 1 24 3 10 1 25 9 30 1 26 9 29 1 27 10 11 1 28 10 19 1 29 11 20 1 30 14 23 1 31 14 24 1