@MOLECULE 2-deoxy-2-(~18~f)fluoro-beta-d-glucopyranose 23 23 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 F 2.7679 0.5859 -0.4344 F 1 UNL1 -0.1924 2 C 1.1041 -1.0604 -0.2093 C.3 1 UNL1 0.0527 3 C 1.5888 0.3462 0.1845 C.3 1 UNL1 -0.0661 4 C -0.3564 -1.2751 0.2447 C.3 1 UNL1 0.0732 5 C -1.2415 -0.1106 -0.2415 C.3 1 UNL1 0.0550 6 C 0.5789 1.4280 -0.2904 C.3 1 UNL1 0.3318 7 C -2.6414 -0.1617 0.3869 C.3 1 UNL1 -0.0137 8 H 2.7657 -2.0489 0.2598 H 1 UNL1 0.3335 9 H -0.3239 -3.2006 -0.1717 H 1 UNL1 0.3376 10 H 0.6872 2.7316 1.1910 H 1 UNL1 0.3343 11 H -3.0819 1.6754 -0.1751 H 1 UNL1 0.3233 12 O 1.8231 -2.0288 0.5248 O.3 1 UNL1 -0.5596 13 O -0.8793 -2.4179 -0.3928 O.3 1 UNL1 -0.5438 14 O 0.9165 2.6651 0.2356 O.3 1 UNL1 -0.5151 15 O -3.4803 0.7796 -0.2415 O.3 1 UNL1 -0.5332 16 O -0.6934 1.1027 0.2473 O.3 1 UNL1 -0.4893 17 H 1.2207 -1.2696 -1.2968 H 1 UNL1 0.1497 18 H 1.7471 0.4103 1.2943 H 1 UNL1 0.1682 19 H -0.4094 -1.4171 1.3474 H 1 UNL1 0.1503 20 H -1.3072 -0.0782 -1.3521 H 1 UNL1 0.1555 21 H 0.5291 1.5845 -1.3881 H 1 UNL1 0.1522 22 H -3.1330 -1.1354 0.1857 H 1 UNL1 0.1657 23 H -2.6161 0.0378 1.4731 H 1 UNL1 0.1302 @BOND 1 21 6 1 2 20 5 1 3 17 2 1 4 1 3 1 5 13 9 1 6 13 4 1 7 6 3 1 8 6 14 1 9 6 16 1 10 15 11 1 11 15 7 1 12 5 4 1 13 5 16 1 14 5 7 1 15 2 3 1 16 2 4 1 17 2 12 1 18 3 18 1 19 22 7 1 20 14 10 1 21 4 19 1 22 8 12 1 23 7 23 1