@MOLECULE 5'-o-[{[{[(3ar,5r,6r,6ar)-2,6-dihydroxy-2-oxidotetrahydrofuro[2,3-d][1,3,2]dioxaphosphol-5-yl]methoxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]adenosine 61 65 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 P 3.6363 1.6914 0.3982 P.3 1 UNL1 0.3579 2 P -3.2691 0.8392 -1.9513 P.3 1 UNL1 0.3680 3 P -4.0683 -0.3858 0.7228 P.3 1 UNL1 0.3502 4 O 0.7209 2.3522 -1.4069 O.3 1 UNL1 -0.4036 5 O 2.7270 2.7314 1.2503 O.3 1 UNL1 -0.2472 6 O -0.1866 -2.9950 2.0319 O.3 1 UNL1 -0.4233 7 O 2.9232 1.8091 -1.0355 O.3 1 UNL1 -0.2368 8 O 0.2226 2.7166 2.1035 O.3 1 UNL1 -0.5190 9 O -0.7999 -0.4513 3.8798 O.3 1 UNL1 -0.5437 10 O 1.6996 -0.4869 3.2346 O.3 1 UNL1 -0.5581 11 O -1.7982 1.3277 -1.6219 O.3 1 UNL1 -0.1882 12 O -3.3146 -1.7714 0.9313 O.3 1 UNL1 -0.2210 13 O 4.9788 2.4978 0.1430 O.3 1 UNL1 -0.3298 14 O 3.7604 0.3807 1.0112 O.2 1 UNL1 -0.2863 15 O -3.8660 -0.0864 -0.8135 O.3 1 UNL1 -0.1739 16 O -4.1089 2.1938 -1.9031 O.3 1 UNL1 -0.3984 17 O -3.2218 0.7565 1.4498 O.3 1 UNL1 -0.4055 18 O -3.3029 0.0311 -3.1543 O.2 1 UNL1 -0.1866 19 O -5.4646 -0.5575 1.0791 O.2 1 UNL1 -0.2303 20 N 1.6416 -2.7374 0.6214 N.ar 1 UNL1 -0.3832 21 N 2.7554 -3.9943 -0.9258 N.ar 1 UNL1 -0.3368 22 N 0.7882 -0.9699 -0.9137 N.ar 1 UNL1 -0.5441 23 N 1.5154 -1.2684 -3.1985 N.ar 1 UNL1 -0.5785 24 N 2.8204 -3.0721 -3.9109 N.pl3 1 UNL1 -0.5623 25 C 1.8462 3.4660 0.3912 C.3 1 UNL1 -0.0325 26 C 0.3736 3.1696 0.7999 C.3 1 UNL1 0.0738 27 C -0.1157 2.1522 -0.2620 C.3 1 UNL1 0.0311 28 C 1.9638 2.8835 -1.0551 C.3 1 UNL1 0.2668 29 C -0.5804 -0.6840 2.5177 C.3 1 UNL1 0.0906 30 C 0.9123 -0.8646 2.1389 C.3 1 UNL1 0.0218 31 C -1.2302 -2.0188 2.0989 C.3 1 UNL1 0.0277 32 C 1.0832 -2.3943 1.9217 C.3 1 UNL1 0.2497 33 C -1.5438 2.4468 -0.7399 C.3 1 UNL1 -0.0548 34 C -1.9097 -1.9730 0.7198 C.3 1 UNL1 -0.0714 35 C 1.4613 -2.1053 -0.6042 C.ar 1 UNL1 0.3125 36 C 2.4235 -3.8994 0.3555 C.ar 1 UNL1 0.1345 37 C 2.1796 -2.8971 -1.5631 C.ar 1 UNL1 -0.2134 38 C 2.1835 -2.4229 -2.9007 C.ar 1 UNL1 0.4676 39 C 0.8620 -0.6052 -2.2145 C.ar 1 UNL1 0.3374 40 H 2.1211 4.5320 0.5020 H 1 UNL1 0.1496 41 H -0.2268 4.1066 0.8058 H 1 UNL1 0.1449 42 H -0.0023 1.0905 0.0602 H 1 UNL1 0.1862 43 H 2.2556 3.5363 -1.9003 H 1 UNL1 0.1524 44 H -1.0285 0.2151 2.0347 H 1 UNL1 0.1783 45 H 1.1739 -0.2714 1.2382 H 1 UNL1 0.1809 46 H -1.9100 -2.4172 2.8857 H 1 UNL1 0.1703 47 H 1.7042 -2.8738 2.7226 H 1 UNL1 0.1639 48 H -1.5888 3.3755 -1.3440 H 1 UNL1 0.1307 49 H -2.2220 2.5438 0.1359 H 1 UNL1 0.1629 50 H -1.9066 -2.9856 0.2519 H 1 UNL1 0.1563 51 H -1.3919 -1.2865 0.0212 H 1 UNL1 0.1745 52 H 0.7217 1.8844 2.2845 H 1 UNL1 0.3412 53 H -0.1036 -0.8673 4.4362 H 1 UNL1 0.3377 54 H 2.5874 -0.1861 2.9232 H 1 UNL1 0.3547 55 H 2.6971 -4.5887 1.1387 H 1 UNL1 0.1951 56 H 5.7694 1.9296 0.4815 H 1 UNL1 0.3285 57 H 0.3346 0.3276 -2.5085 H 1 UNL1 0.2291 58 H -5.1074 1.9751 -1.8974 H 1 UNL1 0.3298 59 H -3.2868 0.6455 2.4624 H 1 UNL1 0.3224 60 H 3.3099 -3.9263 -3.7266 H 1 UNL1 0.3273 61 H 2.8023 -2.7064 -4.8426 H 1 UNL1 0.3224 @BOND 1 61 24 1 2 24 60 1 3 24 38 1 4 23 38 ar 5 23 39 ar 6 18 2 2 7 38 37 ar 8 57 39 1 9 39 22 ar 10 2 16 1 11 2 11 1 12 2 15 1 13 16 58 1 14 43 28 1 15 11 33 1 16 37 21 ar 17 37 35 ar 18 4 28 1 19 4 27 1 20 48 33 1 21 28 7 1 22 28 25 1 23 7 1 1 24 21 36 ar 25 22 35 ar 26 15 3 1 27 33 27 1 28 33 49 1 29 35 20 ar 30 27 42 1 31 27 26 1 32 51 34 1 33 13 1 1 34 13 56 1 35 50 34 1 36 36 20 ar 37 36 55 1 38 25 40 1 39 25 26 1 40 25 5 1 41 1 14 2 42 1 5 1 43 20 32 1 44 34 12 1 45 34 31 1 46 3 12 1 47 3 19 2 48 3 17 1 49 26 41 1 50 26 8 1 51 45 30 1 52 17 59 1 53 32 6 1 54 32 30 1 55 32 47 1 56 6 31 1 57 44 29 1 58 31 29 1 59 31 46 1 60 8 52 1 61 30 29 1 62 30 10 1 63 29 9 1 64 54 10 1 65 9 53 1