@MOLECULE 5-fluoro-5'-o-octanoyluridine 52 53 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 F -1.5484 2.2120 0.5166 F 1 UNL1 -0.0962 2 O 1.8728 -0.9553 -0.8424 O.3 1 UNL1 -0.3887 3 O 4.5194 -2.4398 0.3448 O.3 1 UNL1 -0.5336 4 O 4.8189 0.1184 0.7031 O.3 1 UNL1 -0.5457 5 O -0.0054 -2.8014 -0.3998 O.3 1 UNL1 -0.4190 6 O 3.6238 2.6246 -0.6916 O.2 1 UNL1 -0.5383 7 O -1.3193 -3.8587 1.0782 O.2 1 UNL1 -0.5052 8 O -0.4162 4.6490 -0.1722 O.2 1 UNL1 -0.4155 9 N 1.8251 1.2946 -0.2634 N.ar 1 UNL1 -0.4814 10 N 1.5963 3.6676 -0.4714 N.ar 1 UNL1 -0.6145 11 C 3.3832 -1.7954 0.8552 C.3 1 UNL1 0.0845 12 C 3.4673 -0.2492 0.8135 C.3 1 UNL1 0.0246 13 C 2.2102 -2.1316 -0.1013 C.3 1 UNL1 0.0449 14 C 2.6964 0.1232 -0.4831 C.3 1 UNL1 0.2390 15 C 0.9562 -2.5949 0.6361 C.3 1 UNL1 -0.0674 16 C 2.4254 2.5516 -0.4980 C.ar 1 UNL1 0.7046 17 C 0.4842 1.1600 0.0569 C.ar 1 UNL1 0.1095 18 C -3.4286 -2.9288 -0.8624 C.3 1 UNL1 -0.2534 19 C -2.0654 -3.5314 -1.2214 C.3 1 UNL1 -0.3501 20 C -3.3190 -1.4337 -0.5382 C.3 1 UNL1 -0.2725 21 C -1.1518 -3.4477 -0.0393 C.2 1 UNL1 0.6084 22 C -4.7103 -0.8363 -0.2946 C.3 1 UNL1 -0.2723 23 C -0.2825 2.2772 0.1460 C.ar 1 UNL1 -0.1166 24 C -4.5975 0.6121 0.1973 C.3 1 UNL1 -0.2711 25 C 0.2042 3.6188 -0.1586 C.ar 1 UNL1 0.5804 26 C -5.9874 1.2317 0.3941 C.3 1 UNL1 -0.2537 27 C -5.8726 2.6323 0.9951 C.3 1 UNL1 -0.4399 28 H 3.2554 -2.1964 1.8833 H 1 UNL1 0.1549 29 H 3.0478 0.2216 1.7262 H 1 UNL1 0.1542 30 H 2.5213 -2.8661 -0.8858 H 1 UNL1 0.1840 31 H 3.3781 0.3233 -1.3567 H 1 UNL1 0.1812 32 H 1.1271 -3.5426 1.1806 H 1 UNL1 0.1579 33 H 0.5508 -1.8421 1.3300 H 1 UNL1 0.1393 34 H 5.2291 -1.7854 0.1442 H 1 UNL1 0.3506 35 H 4.8759 1.0482 0.3531 H 1 UNL1 0.3598 36 H 0.1066 0.1366 0.2251 H 1 UNL1 0.2115 37 H -3.8649 -3.4713 0.0016 H 1 UNL1 0.1554 38 H -4.1327 -3.0827 -1.7048 H 1 UNL1 0.1470 39 H -2.8149 -0.8949 -1.3621 H 1 UNL1 0.1420 40 H -2.6837 -1.2859 0.3560 H 1 UNL1 0.1382 41 H -2.1785 -4.5967 -1.5178 H 1 UNL1 0.1759 42 H -1.6314 -3.0163 -2.1061 H 1 UNL1 0.1817 43 H -5.2598 -1.4415 0.4487 H 1 UNL1 0.1375 44 H -5.3082 -0.8744 -1.2243 H 1 UNL1 0.1357 45 H 2.0225 4.5797 -0.6693 H 1 UNL1 0.3532 46 H -4.0171 1.2169 -0.5248 H 1 UNL1 0.1429 47 H -4.0322 0.6466 1.1476 H 1 UNL1 0.1401 48 H -6.5220 1.2763 -0.5732 H 1 UNL1 0.1324 49 H -6.6017 0.5881 1.0514 H 1 UNL1 0.1327 50 H -5.2547 3.2872 0.3693 H 1 UNL1 0.1479 51 H -5.4131 2.6047 1.9895 H 1 UNL1 0.1430 52 H -6.8556 3.1041 1.0976 H 1 UNL1 0.1403 @BOND 1 42 19 1 2 38 18 1 3 41 19 1 4 39 20 1 5 31 14 1 6 44 22 1 7 19 18 1 8 19 21 1 9 30 13 1 10 18 20 1 11 18 37 1 12 2 14 1 13 2 13 1 14 6 16 2 15 45 10 1 16 48 26 1 17 20 22 1 18 20 40 1 19 46 24 1 20 16 10 ar 21 16 9 ar 22 14 9 1 23 14 12 1 24 10 25 ar 25 5 21 1 26 5 15 1 27 22 24 1 28 22 43 1 29 9 17 ar 30 8 25 2 31 25 23 ar 32 13 15 1 33 13 11 1 34 21 7 2 35 17 23 ar 36 17 36 1 37 34 3 1 38 23 1 1 39 24 26 1 40 24 47 1 41 3 11 1 42 35 4 1 43 50 27 1 44 26 27 1 45 26 49 1 46 15 32 1 47 15 33 1 48 4 12 1 49 12 11 1 50 12 29 1 51 11 28 1 52 27 52 1 53 27 51 1