@MOLECULE 3-[2-deoxy-5-o-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)-beta-d-erythro-pentofuranosyl]-3h-imidazo[2,1-i]purine 43 46 0 0 0 SMALL GASTEIGER @ATOM 1 P -3.2015 0.9143 -0.4801 P.3 1 UNL111111 0.3984 2 P -0.7404 2.6103 -0.0355 P.3 1 UNL111111 0.4286 3 P 0.3320 0.6912 2.0612 P.3 1 UNL111111 0.3928 4 O -0.4924 -3.0391 -1.4784 O.3 1 UNL111111 -0.3839 5 O -2.8475 -3.7595 0.8472 O.3 1 UNL111111 -0.5768 6 O -2.7301 -0.5939 -0.4206 O.3 1 UNL111111 -0.2774 7 O -1.9077 1.7836 -0.6631 O.3 1 UNL111111 -0.2049 8 O -4.0962 1.3197 -1.5962 O.2 1 UNL111111 -0.1484 9 O -4.1117 1.1294 0.6767 O.3 1 UNL111111 -0.1015 10 O -0.3401 1.8135 1.2363 O.3 1 UNL111111 -0.2472 11 O -1.0653 3.9985 0.3971 O.3 1 UNL111111 -0.0569 12 O 0.2190 2.9095 -1.1192 O.2 1 UNL111111 -0.1626 13 O 0.5997 -0.5672 1.3283 O.2 1 UNL111111 -0.1926 14 O 1.7941 0.9225 2.4760 O.3 1 UNL111111 0.0382 15 O -0.2347 0.8476 3.4223 O.3 1 UNL111111 -0.1202 16 N 1.5164 -2.6949 -0.3064 N.pl3 1 UNL111111 -0.3409 17 N 3.4876 -2.0364 0.6314 N.2 1 UNL111111 -0.2946 18 N 1.0961 -0.6873 -1.7255 N.2 1 UNL111111 -0.3820 19 N 2.7152 1.0152 -1.4339 N.ar 1 UNL111111 -0.2970 20 N 4.5837 1.0139 -0.1185 N.ar 1 UNL111111 -0.3812 21 C 0.3109 -3.5372 -0.4467 C.3 1 UNL111111 0.3097 22 C -1.8191 -2.8406 0.5245 C.3 1 UNL111111 0.1482 23 C -1.7906 -2.6493 -1.0068 C.3 1 UNL111111 0.0277 24 C -0.5012 -3.5556 0.8601 C.3 1 UNL111111 -0.3836 25 C -2.0276 -1.2173 -1.5194 C.3 1 UNL111111 -0.0482 26 C 1.7912 -1.4339 -0.8084 C.2 1 UNL111111 0.2298 27 C 2.5798 -3.0149 0.5699 C.2 1 UNL111111 0.0870 28 C 3.0341 -1.0318 -0.2015 C.2 1 UNL111111 -0.0497 29 C 3.5256 0.2600 -0.4999 C.ar 1 UNL111111 0.2886 30 C 1.5521 0.5112 -2.0071 C.2 1 UNL111111 0.2433 31 C 3.3215 2.2836 -1.5870 C.ar 1 UNL111111 -0.2082 32 C 4.4197 2.1812 -0.7703 C.ar 1 UNL111111 0.1786 33 H 0.6471 -4.5452 -0.8009 H 1 UNL111111 0.1481 34 H -1.9636 -1.9110 1.1124 H 1 UNL111111 0.1706 35 H -2.4794 -3.3739 -1.4994 H 1 UNL111111 0.1477 36 H -0.7075 -4.5902 1.1973 H 1 UNL111111 0.1803 37 H 0.0194 -3.0547 1.6980 H 1 UNL111111 0.1873 38 H -2.6397 -1.2341 -2.4407 H 1 UNL111111 0.1260 39 H -1.0564 -0.7230 -1.7407 H 1 UNL111111 0.1950 40 H -3.7086 -3.3002 0.9027 H 1 UNL111111 0.3277 41 H 2.6285 -3.9468 1.1060 H 1 UNL111111 0.1933 42 H 1.0087 1.1488 -2.7254 H 1 UNL111111 0.2141 43 H 2.9148 3.0634 -2.1878 H 1 UNL111111 0.1966 @BOND 1 8 1 2 2 43 31 1 3 12 2 2 4 11 2 1 5 42 30 1 6 7 1 1 7 7 2 1 8 1 9 1 9 1 6 1 10 2 10 1 11 38 25 1 12 31 19 ar 13 31 32 ar 14 30 19 1 15 30 18 2 16 39 25 1 17 25 6 1 18 25 23 1 19 19 29 ar 20 32 20 ar 21 18 26 2 22 10 3 1 23 35 23 1 24 23 4 1 25 23 22 1 26 29 20 ar 27 29 28 1 28 4 21 1 29 26 28 1 30 26 16 1 31 3 13 2 32 3 14 1 33 3 15 1 34 34 22 1 35 28 17 2 36 40 5 1 37 22 5 1 38 22 24 1 39 16 21 1 40 16 27 1 41 21 33 1 42 21 24 1 43 24 37 1 44 24 36 1 45 17 27 2 46 27 41 1