@MOLECULE 2'-deoxy-5-fluoro-3'-c-octanoyluridine 51 52 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 F -5.4199 0.0129 1.9702 F 1 UNL1 -0.1002 2 O -2.0072 -2.0213 -0.7245 O.3 1 UNL1 -0.3907 3 O 0.8692 -2.0388 -1.7504 O.3 1 UNL1 -0.5518 4 O 1.0127 0.1946 0.8840 O.2 1 UNL1 -0.4520 5 O -1.9925 -2.3890 1.9771 O.3 1 UNL1 -0.5451 6 O -2.6377 1.7239 -2.2415 O.2 1 UNL1 -0.5205 7 O -5.6803 2.6081 1.0171 O.2 1 UNL1 -0.4281 8 N -3.0803 0.0586 -0.7433 N.ar 1 UNL1 -0.4979 9 N -4.1689 2.1869 -0.6082 N.ar 1 UNL1 -0.6201 10 C 0.1983 -1.2114 -0.8330 C.3 1 UNL1 0.1322 11 C -0.7822 -2.0630 0.0117 C.3 1 UNL1 0.0479 12 C -0.7135 -0.2125 -1.5641 C.3 1 UNL1 -0.3858 13 C -2.1205 -0.8294 -1.4573 C.3 1 UNL1 0.3183 14 C 1.3123 -0.4965 -0.0558 C.2 1 UNL1 0.4638 15 C -0.9937 -1.5400 1.4351 C.3 1 UNL1 -0.0433 16 C 2.7098 -0.6983 -0.5384 C.3 1 UNL1 -0.3623 17 C 3.7035 0.1336 0.2752 C.3 1 UNL1 -0.2542 18 C 5.1331 -0.0809 -0.2322 C.3 1 UNL1 -0.2763 19 C -3.2608 1.3589 -1.2658 C.ar 1 UNL1 0.7005 20 C -3.8168 -0.4106 0.3303 C.ar 1 UNL1 0.1085 21 C 6.1251 0.7559 0.5857 C.3 1 UNL1 -0.2732 22 C 7.5575 0.5467 0.0790 C.3 1 UNL1 -0.2735 23 C -4.7001 0.4216 0.9406 C.ar 1 UNL1 -0.1362 24 C 8.5511 1.3823 0.8973 C.3 1 UNL1 -0.2507 25 C -4.9369 1.7985 0.5267 C.ar 1 UNL1 0.5847 26 C 9.9799 1.1762 0.3946 C.3 1 UNL1 -0.4398 27 H -0.5354 -3.1490 0.0142 H 1 UNL1 0.1750 28 H -0.4089 -0.0653 -2.6167 H 1 UNL1 0.1894 29 H -0.6580 0.8009 -1.1157 H 1 UNL1 0.2013 30 H -2.5777 -1.1268 -2.4343 H 1 UNL1 0.1619 31 H -0.0712 -1.6204 2.0397 H 1 UNL1 0.1380 32 H -1.3541 -0.4942 1.4538 H 1 UNL1 0.1488 33 H 2.9700 -1.7802 -0.4955 H 1 UNL1 0.1850 34 H 2.7776 -0.4482 -1.6210 H 1 UNL1 0.1845 35 H 0.2318 -2.5485 -2.2979 H 1 UNL1 0.3365 36 H 3.6314 -0.1309 1.3488 H 1 UNL1 0.1497 37 H 3.4325 1.2068 0.2228 H 1 UNL1 0.1509 38 H 5.2036 0.1907 -1.3023 H 1 UNL1 0.1378 39 H 5.4038 -1.1517 -0.1727 H 1 UNL1 0.1368 40 H -3.6425 -1.4587 0.6501 H 1 UNL1 0.2333 41 H 5.8560 1.8274 0.5279 H 1 UNL1 0.1391 42 H 6.0589 0.4848 1.6561 H 1 UNL1 0.1379 43 H -2.1105 -2.2019 2.9311 H 1 UNL1 0.3217 44 H 7.8291 -0.5236 0.1360 H 1 UNL1 0.1361 45 H 7.6266 0.8197 -0.9903 H 1 UNL1 0.1367 46 H -4.2917 3.1343 -0.9776 H 1 UNL1 0.3494 47 H 8.4840 1.1096 1.9674 H 1 UNL1 0.1344 48 H 8.2814 2.4539 0.8403 H 1 UNL1 0.1349 49 H 10.0824 1.4731 -0.6551 H 1 UNL1 0.1427 50 H 10.2847 0.1266 0.4719 H 1 UNL1 0.1423 51 H 10.6946 1.7699 0.9755 H 1 UNL1 0.1418 @BOND 1 28 12 1 2 30 13 1 3 35 3 1 4 6 19 2 5 3 10 1 6 34 16 1 7 12 13 1 8 12 29 1 9 12 10 1 10 13 8 1 11 13 2 1 12 38 18 1 13 19 8 ar 14 19 9 ar 15 45 22 1 16 46 9 1 17 10 14 1 18 10 11 1 19 8 20 ar 20 2 11 1 21 49 26 1 22 9 25 ar 23 16 33 1 24 16 14 1 25 16 17 1 26 18 39 1 27 18 17 1 28 18 21 1 29 14 4 2 30 11 27 1 31 11 15 1 32 22 44 1 33 22 21 1 34 22 24 1 35 37 17 1 36 17 36 1 37 20 40 1 38 20 23 ar 39 26 50 1 40 26 24 1 41 26 51 1 42 25 23 ar 43 25 7 2 44 41 21 1 45 21 42 1 46 48 24 1 47 24 47 1 48 23 1 1 49 15 32 1 50 15 5 1 51 15 31 1 52 5 43 1