@MOLECULE 5-amino-1-[5-(benzylamino)-5-deoxy-beta-d-ribofuranosyl]-1h-imidazole-4-carboxamide 46 48 0 0 0 SMALL GASTEIGER @ATOM 1 O 1.4379 2.3220 -0.7613 O.3 1 UNL1111111111 -0.4053 2 O 3.6134 1.3195 1.2063 O.3 1 UNL1111111111 -0.5289 3 O 1.3071 1.3411 2.4853 O.3 1 UNL1111111111 -0.5486 4 O -4.1303 -0.5194 1.0206 O.2 1 UNL1111111111 -0.6183 5 N -0.7195 1.6759 -0.1856 N.ar 1 UNL1111111111 -0.4331 6 N 2.7108 -0.9224 -2.1235 N.3 1 UNL1111111111 -0.5211 7 N -2.2720 1.0271 -1.6945 N.ar 1 UNL1111111111 -0.3263 8 N -1.8240 0.9980 1.9001 N.pl3 1 UNL1111111111 -0.5868 9 N -4.7585 -0.4170 -1.1459 N.am 1 UNL1111111111 -0.6583 10 C 2.6022 0.6763 0.4790 C.3 1 UNL1111111111 0.0434 11 C 2.4186 1.2901 -0.9198 C.3 1 UNL1111111111 0.0192 12 C 1.2324 0.9049 1.1598 C.3 1 UNL1111111111 0.0114 13 C 0.5875 2.0603 0.3335 C.3 1 UNL1111111111 0.2563 14 C 1.9166 0.3156 -2.0002 C.3 1 UNL1111111111 -0.1629 15 C -1.7450 1.0519 0.5382 C.ar 1 UNL1111111111 0.3499 16 C -1.1025 1.6329 -1.5563 C.ar 1 UNL1111111111 0.0951 17 C 1.8886 -2.1446 -2.0008 C.3 1 UNL1111111111 -0.1257 18 C -2.6960 0.6368 -0.4236 C.ar 1 UNL1111111111 -0.2517 19 C 1.1642 -2.2877 -0.6868 C.ar 1 UNL1111111111 -0.0551 20 C -3.8952 -0.1230 -0.1174 C.2 1 UNL1111111111 0.6539 21 C 1.8664 -2.6495 0.4639 C.ar 1 UNL1111111111 -0.1906 22 C -0.2095 -2.0537 -0.6177 C.ar 1 UNL1111111111 -0.1691 23 C 1.1998 -2.7536 1.6825 C.ar 1 UNL1111111111 -0.1399 24 C -0.8765 -2.1694 0.6004 C.ar 1 UNL1111111111 -0.1416 25 C -0.1714 -2.5112 1.7523 C.ar 1 UNL1111111111 -0.1561 26 H 2.9246 -0.3858 0.4936 H 1 UNL1111111111 0.1739 27 H 3.3221 1.8451 -1.2586 H 1 UNL1111111111 0.1706 28 H 0.6250 -0.0309 1.1693 H 1 UNL1111111111 0.1741 29 H 0.5120 3.0284 0.8932 H 1 UNL1111111111 0.1830 30 H 1.9728 0.8226 -2.9959 H 1 UNL1111111111 0.1684 31 H 0.8369 0.0993 -1.8350 H 1 UNL1111111111 0.1607 32 H 3.5480 2.2996 1.1217 H 1 UNL1111111111 0.3301 33 H 3.4948 -0.9376 -1.4763 H 1 UNL1111111111 0.2573 34 H 2.2346 1.2816 2.8267 H 1 UNL1111111111 0.3547 35 H -0.5005 2.0793 -2.3294 H 1 UNL1111111111 0.1992 36 H 2.5630 -3.0170 -2.1728 H 1 UNL1111111111 0.1558 37 H 1.1710 -2.1559 -2.8560 H 1 UNL1111111111 0.1600 38 H -0.9965 1.0763 2.4609 H 1 UNL1111111111 0.3190 39 H -2.6033 0.4552 2.2689 H 1 UNL1111111111 0.3478 40 H 2.9311 -2.8665 0.4084 H 1 UNL1111111111 0.1508 41 H -0.7707 -1.7845 -1.5136 H 1 UNL1111111111 0.1657 42 H 1.7487 -3.0349 2.5798 H 1 UNL1111111111 0.1531 43 H -1.9553 -1.9933 0.6501 H 1 UNL1111111111 0.1768 44 H -4.5779 -0.0983 -2.0766 H 1 UNL1111111111 0.3206 45 H -5.5929 -0.9345 -0.9734 H 1 UNL1111111111 0.3087 46 H -0.6947 -2.6019 2.7033 H 1 UNL1111111111 0.1599 @BOND 1 1 11 1 2 1 13 1 3 2 10 1 4 2 32 1 5 3 12 1 6 3 34 1 7 4 20 2 8 5 13 1 9 5 15 ar 10 5 16 ar 11 6 14 1 12 6 17 1 13 6 33 1 14 7 16 ar 15 7 18 ar 16 8 15 1 17 8 38 1 18 8 39 1 19 9 20 am 20 9 44 1 21 9 45 1 22 10 11 1 23 10 12 1 24 10 26 1 25 11 14 1 26 11 27 1 27 12 13 1 28 12 28 1 29 13 29 1 30 14 30 1 31 14 31 1 32 15 18 ar 33 16 35 1 34 17 19 1 35 17 36 1 36 17 37 1 37 18 20 1 38 19 21 ar 39 19 22 ar 40 21 23 ar 41 21 40 1 42 22 24 ar 43 22 41 1 44 23 25 ar 45 23 42 1 46 24 25 ar 47 24 43 1 48 25 46 1