@MOLECULE 2'-deoxy-5'-o-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]amino}phosphoryl)adenosine 47 49 0 0 0 SMALL GASTEIGER @ATOM 1 P -1.9350 2.0287 1.6360 P.3 1 UNL11 0.3713 2 P -3.0489 0.3537 -0.8193 P.3 1 UNL11 0.4102 3 P -2.8931 -2.6591 -0.2890 P.3 1 UNL11 0.3893 4 O 2.6599 2.6682 -0.0576 O.3 1 UNL11 -0.4198 5 O 0.2191 2.6309 -2.4028 O.3 1 UNL11 -0.5739 6 O -0.5069 2.6409 1.3003 O.3 1 UNL11 -0.2362 7 O -1.6001 1.1992 2.9703 O.3 1 UNL11 -0.3964 8 O -2.8794 3.1252 1.7418 O.2 1 UNL11 -0.2350 9 O -3.2653 -1.2299 -0.8356 O.3 1 UNL11 -0.2151 10 O -1.8397 0.5596 -1.8372 O.3 1 UNL11 -0.4274 11 O -4.3282 0.9072 -1.2039 O.2 1 UNL11 -0.1984 12 O -4.0834 -3.0099 0.7040 O.3 1 UNL11 -0.3589 13 O -1.6324 -2.3592 0.6537 O.3 1 UNL11 -0.4399 14 O -2.7277 -3.6552 -1.3256 O.2 1 UNL11 -0.2228 15 N 3.8773 0.7198 -0.4380 N.ar 1 UNL11 -0.3863 16 N 5.4077 -0.6507 0.5597 N.ar 1 UNL11 -0.3367 17 N 1.9505 -0.8692 -0.4476 N.ar 1 UNL11 -0.5269 18 N -2.2858 0.6957 0.6326 N.3 1 UNL11 -0.2621 19 N 2.5184 -3.0483 0.4312 N.ar 1 UNL11 -0.5870 20 N 4.6569 -3.6099 1.1984 N.pl3 1 UNL11 -0.5514 21 C 0.9735 1.8081 -1.5412 C.3 1 UNL11 0.1444 22 C 1.2408 2.5715 -0.2236 C.3 1 UNL11 0.0334 23 C 3.3437 1.9478 -1.0484 C.3 1 UNL11 0.3124 24 C 2.3629 1.6529 -2.1874 C.3 1 UNL11 -0.3765 25 C 0.6989 1.8959 1.0474 C.3 1 UNL11 -0.0740 26 C 3.2297 -0.4843 -0.1977 C.ar 1 UNL11 0.2917 27 C 5.1955 0.5683 0.0742 C.ar 1 UNL11 0.1343 28 C 4.2112 -1.3462 0.4038 C.ar 1 UNL11 -0.2108 29 C 3.8100 -2.6785 0.6913 C.ar 1 UNL11 0.4634 30 C 1.6672 -2.1438 -0.1143 C.ar 1 UNL11 0.2967 31 H 0.4584 0.8317 -1.3967 H 1 UNL11 0.1747 32 H 0.8935 3.6305 -0.2966 H 1 UNL11 0.1746 33 H 4.2060 2.5999 -1.3287 H 1 UNL11 0.1517 34 H 2.4952 0.6538 -2.6338 H 1 UNL11 0.1759 35 H 2.4764 2.3801 -3.0153 H 1 UNL11 0.1823 36 H 1.3612 2.1102 1.9162 H 1 UNL11 0.1484 37 H 0.6201 0.8006 0.9385 H 1 UNL11 0.1472 38 H -0.7401 2.4855 -2.2223 H 1 UNL11 0.3453 39 H 5.9122 1.3762 0.0493 H 1 UNL11 0.1997 40 H -1.4851 -0.0571 0.7686 H 1 UNL11 0.3276 41 H 0.6310 -2.4897 -0.3050 H 1 UNL11 0.2236 42 H -2.4756 0.9931 3.4508 H 1 UNL11 0.3162 43 H 5.6011 -3.3575 1.4216 H 1 UNL11 0.3300 44 H 4.3392 -4.5410 1.3869 H 1 UNL11 0.3231 45 H -2.0077 0.0683 -2.7117 H 1 UNL11 0.3264 46 H -4.3217 -2.1806 1.2561 H 1 UNL11 0.3222 47 H -1.3319 -3.2028 1.1325 H 1 UNL11 0.3197 @BOND 1 1 6 1 2 1 7 1 3 1 8 2 4 1 18 1 5 2 9 1 6 2 10 1 7 2 11 2 8 2 18 1 9 3 9 1 10 3 12 1 11 3 13 1 12 3 14 2 13 4 22 1 14 4 23 1 15 5 21 1 16 5 38 1 17 6 25 1 18 7 42 1 19 10 45 1 20 12 46 1 21 13 47 1 22 15 23 1 23 15 26 ar 24 15 27 ar 25 16 27 ar 26 16 28 ar 27 17 26 ar 28 17 30 ar 29 18 40 1 30 19 29 ar 31 19 30 ar 32 20 29 1 33 20 43 1 34 20 44 1 35 21 22 1 36 21 24 1 37 21 31 1 38 22 25 1 39 22 32 1 40 23 24 1 41 23 33 1 42 24 34 1 43 24 35 1 44 25 36 1 45 25 37 1 46 26 28 ar 47 27 39 1 48 28 29 ar 49 30 41 1