@MOLECULE 9-(2-deoxy-beta-d-erythro-pentofuranosyl)-9h-purine 29 31 0 0 0 SMALL GASTEIGER @ATOM 1 O4* 1.9126 0.2897 1.0890 O.3 1 UNL1111111111 -0.3814 2 O3* 3.5614 -2.0609 -0.2924 O.3 1 UNL1111111111 -0.5381 3 O5* 2.4832 2.4847 -0.5018 O.3 1 UNL1111111111 -0.5298 4 N -0.3475 0.1813 0.6740 N.ar 1 UNL1111111111 -0.4021 5 N -1.6216 2.0287 0.2781 N.ar 1 UNL1111111111 -0.3625 6 N -2.0330 -1.5479 0.0755 N.ar 1 UNL1111111111 -0.4478 7 N -4.1399 -0.5742 -0.6010 N.ar 1 UNL1111111111 -0.4435 8 C1* 0.8328 -0.6105 1.0636 C.3 1 UNL1111111111 0.3046 9 C3* 2.4709 -1.2500 -0.6292 C.3 1 UNL1111111111 0.1279 10 C2* 1.1748 -1.7197 0.0579 C.3 1 UNL1111111111 -0.4027 11 C4* 2.6835 0.1910 -0.1067 C.3 1 UNL1111111111 0.0309 12 C5* 2.2382 1.2390 -1.1313 C.3 1 UNL1111111111 -0.0528 13 C -1.5829 -0.2839 0.2496 C.ar 1 UNL1111111111 0.2261 14 C -0.4266 1.5971 0.6762 C.ar 1 UNL1111111111 0.1812 15 C -2.3857 0.8958 0.0025 C.ar 1 UNL1111111111 -0.0906 16 C -3.7015 0.6800 -0.4346 C.ar 1 UNL1111111111 0.1426 17 C -3.3095 -1.6280 -0.3453 C.ar 1 UNL1111111111 0.2282 18 H1* 0.7068 -0.9504 2.1223 H 1 UNL1111111111 0.1652 19 H3* 2.4429 -1.3361 -1.7351 H 1 UNL1111111111 0.1581 20 H2*1 0.3630 -1.9053 -0.6705 H 1 UNL1111111111 0.1939 21 H2*2 1.3169 -2.6958 0.5583 H 1 UNL1111111111 0.1872 22 H4* 3.7195 0.3914 0.2485 H 1 UNL1111111111 0.1777 23 H5*1 1.1658 1.1557 -1.3810 H 1 UNL1111111111 0.1295 24 H5*2 2.8426 1.1753 -2.0555 H 1 UNL1111111111 0.1294 25 H3* 3.7092 -2.0858 0.6768 H 1 UNL1111111111 0.3225 26 H 0.4220 2.2145 0.9691 H 1 UNL1111111111 0.2296 27 H5* 2.1791 3.2177 -1.0762 H 1 UNL1111111111 0.3162 28 H -4.3978 1.5011 -0.6478 H 1 UNL1111111111 0.1977 29 H -3.7291 -2.6359 -0.4997 H 1 UNL1111111111 0.2030 @BOND 1 1 8 1 2 1 11 1 3 2 9 1 4 2 25 1 5 3 12 1 6 3 27 1 7 4 8 1 8 4 13 ar 9 4 14 ar 10 5 14 ar 11 5 15 ar 12 6 13 ar 13 6 17 ar 14 7 16 ar 15 7 17 ar 16 8 10 1 17 8 18 1 18 9 10 1 19 9 11 1 20 9 19 1 21 10 20 1 22 10 21 1 23 11 12 1 24 11 22 1 25 12 23 1 26 12 24 1 27 13 15 ar 28 14 26 1 29 15 16 ar 30 16 28 1 31 17 29 1