@MOLECULE methyl n-[{[3-(6-amino-9h-purin-9-yl)-4-fluoro-5-hydroxy-2-methylenecyclopentyl]methoxy}(phenoxy)phosphoryl]-l-alaninate 62 65 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 N 3.2343 -1.0291 -0.7819 N.ar 1 UNL1 -0.5214 2 C 3.5014 -2.1899 -1.4150 C.ar 1 UNL1 0.3004 3 N 4.7082 -2.7970 -1.5250 N.ar 1 UNL1 -0.5744 4 C 5.8074 -2.2105 -0.9616 C.ar 1 UNL1 0.4681 5 C 4.3181 -0.4443 -0.2091 C.ar 1 UNL1 0.2849 6 C 5.6490 -0.9813 -0.2664 C.ar 1 UNL1 -0.2063 7 N 6.5235 -0.1317 0.4048 N.ar 1 UNL1 -0.3295 8 C 5.7894 0.8794 0.8605 C.ar 1 UNL1 0.1227 9 N 4.4209 0.7404 0.5055 N.ar 1 UNL1 -0.3344 10 N 7.0056 -2.8342 -1.0934 N.pl3 1 UNL1 -0.5483 11 C 3.3291 1.6076 0.9195 C.3 1 UNL1 0.0158 12 C 2.3163 0.8750 1.7838 C.2 1 UNL1 -0.0204 13 C 0.9432 0.9825 1.1902 C.3 1 UNL1 -0.2140 14 C 1.0235 2.0933 0.1202 C.3 1 UNL1 0.1300 15 C 2.5180 2.1374 -0.3062 C.3 1 UNL1 0.0015 16 C 2.6243 0.2520 2.9176 C.2 1 UNL1 -0.3189 17 F 2.8802 3.4105 -0.5646 F 1 UNL1 -0.1914 18 O 0.6130 3.3263 0.6382 O.3 1 UNL1 -0.5265 19 C 0.5220 -0.3709 0.5805 C.3 1 UNL1 -0.0003 20 O -0.8911 -0.4365 0.8813 O.3 1 UNL1 -0.2632 21 P -1.9519 -0.8742 -0.2378 P.3 1 UNL1 0.2994 22 N -2.6279 -2.2203 0.5303 N.3 1 UNL1 -0.3383 23 O -1.5217 -0.9951 -1.6205 O.2 1 UNL1 -0.2542 24 O -3.1477 0.1540 0.0973 O.3 1 UNL1 -0.3317 25 C -3.2787 1.4166 -0.4196 C.ar 1 UNL1 0.2879 26 C -4.3447 1.6032 -1.3113 C.ar 1 UNL1 -0.2525 27 C -4.6514 2.8962 -1.7199 C.ar 1 UNL1 -0.1040 28 C -3.9032 3.9799 -1.2597 C.ar 1 UNL1 -0.2170 29 C -2.8432 3.7739 -0.3775 C.ar 1 UNL1 -0.0922 30 C -2.5187 2.4910 0.0533 C.ar 1 UNL1 -0.2430 31 C -3.9184 -2.7814 0.0174 C.3 1 UNL1 0.0369 32 C -5.1134 -2.0443 0.6285 C.2 1 UNL1 0.5560 33 C -3.9790 -4.2365 0.5046 C.3 1 UNL1 -0.4615 34 O -5.2668 -1.7796 1.7912 O.2 1 UNL1 -0.5031 35 O -6.0079 -1.7418 -0.3386 O.3 1 UNL1 -0.4006 36 C -7.1383 -0.9755 0.0696 C.3 1 UNL1 -0.1715 37 H 2.6479 -2.7033 -1.8966 H 1 UNL1 0.2081 38 H 6.1528 1.7270 1.4213 H 1 UNL1 0.1995 39 H 7.0809 -3.6963 -1.5978 H 1 UNL1 0.3243 40 H 7.8299 -2.4232 -0.6971 H 1 UNL1 0.3292 41 H 3.7679 2.4645 1.5029 H 1 UNL1 0.1708 42 H 0.1884 1.2729 1.9684 H 1 UNL1 0.1907 43 H 0.3326 1.9513 -0.7407 H 1 UNL1 0.1809 44 H 2.6941 1.5105 -1.2205 H 1 UNL1 0.1774 45 H 3.6242 0.1862 3.3166 H 1 UNL1 0.1529 46 H 1.8962 -0.2574 3.5332 H 1 UNL1 0.1646 47 H 1.1257 3.5832 1.4304 H 1 UNL1 0.3124 48 H 0.9627 -1.2256 1.1375 H 1 UNL1 0.1406 49 H 0.8336 -0.4592 -0.4814 H 1 UNL1 0.1710 50 H -2.6939 -2.0951 1.5810 H 1 UNL1 0.3021 51 H -4.9140 0.7496 -1.6682 H 1 UNL1 0.1665 52 H -5.4773 3.0618 -2.4088 H 1 UNL1 0.1409 53 H -4.1443 4.9848 -1.5907 H 1 UNL1 0.1456 54 H -2.2563 4.6205 -0.0226 H 1 UNL1 0.1499 55 H -1.6921 2.3392 0.7458 H 1 UNL1 0.1796 56 H -3.9794 -2.7644 -1.1090 H 1 UNL1 0.1874 57 H -4.0325 -4.3041 1.5989 H 1 UNL1 0.1620 58 H -3.0797 -4.7852 0.1881 H 1 UNL1 0.1726 59 H -4.8501 -4.7563 0.0909 H 1 UNL1 0.1555 60 H -7.7024 -0.8519 -0.8616 H 1 UNL1 0.1452 61 H -6.8081 -0.0089 0.4692 H 1 UNL1 0.1488 62 H -7.7166 -1.5225 0.8204 H 1 UNL1 0.1365 @BOND 1 52 27 1 2 37 2 1 3 27 26 ar 4 27 28 ar 5 51 26 1 6 23 21 2 7 39 10 1 8 53 28 1 9 3 2 ar 10 3 4 ar 11 2 1 ar 12 26 25 ar 13 28 29 ar 14 44 15 1 15 56 31 1 16 10 4 1 17 10 40 1 18 4 6 ar 19 60 36 1 20 1 5 ar 21 43 14 1 22 17 15 1 23 49 19 1 24 25 30 ar 25 25 24 1 26 29 54 1 27 29 30 ar 28 35 36 1 29 35 32 1 30 15 14 1 31 15 11 1 32 6 5 ar 33 6 7 ar 34 21 24 1 35 21 22 1 36 21 20 1 37 5 9 ar 38 31 33 1 39 31 22 1 40 31 32 1 41 30 55 1 42 36 61 1 43 36 62 1 44 59 33 1 45 14 18 1 46 14 13 1 47 58 33 1 48 7 8 ar 49 33 57 1 50 9 8 ar 51 9 11 1 52 22 50 1 53 19 20 1 54 19 48 1 55 19 13 1 56 32 34 2 57 18 47 1 58 8 38 1 59 11 41 1 60 11 12 1 61 13 12 1 62 13 42 1 63 12 16 2 64 16 45 1 65 16 46 1