@MOLECULE 4-[3-(benzoylamino)phenyl]-1-(2-deoxy-5-o-phosphonopentofuranosyl)-1h-imidazole 54 57 0 0 0 SMALL GASTEIGER @ATOM 1 P -6.6667 -1.7888 -0.2565 P.3 1 UNL111111111 0.3571 2 O -6.0778 -2.8277 -1.0742 O.2 1 UNL111111111 -0.2087 3 O -7.1027 -2.2074 1.2197 O.3 1 UNL111111111 -0.3360 4 O -7.9881 -1.1946 -0.9025 O.3 1 UNL111111111 -0.3006 5 O -5.8337 -0.4603 0.1114 O.3 1 UNL111111111 -0.3934 6 C -4.5654 -0.1264 -0.4742 C.3 1 UNL111111111 -0.0088 7 C -4.4950 1.3762 -0.1588 C.3 1 UNL111111111 0.0573 8 O -3.5355 1.5270 0.8844 O.3 1 UNL111111111 -0.4162 9 C -4.0698 2.2728 -1.3380 C.3 1 UNL111111111 0.1208 10 O -5.0814 3.2566 -1.4059 O.3 1 UNL111111111 -0.5531 11 C -2.7342 2.8978 -0.9115 C.3 1 UNL111111111 -0.4104 12 C -2.5595 2.4954 0.5689 C.3 1 UNL111111111 0.3012 13 N -1.2572 1.8945 0.8267 N.ar 1 UNL111111111 -0.3250 14 C -0.1919 2.5082 1.5022 C.ar 1 UNL111111111 0.0815 15 N 0.8620 1.6879 1.5356 N.ar 1 UNL111111111 -0.3559 16 C 0.4909 0.5087 0.8885 C.ar 1 UNL111111111 0.0336 17 C -0.8331 0.6234 0.4482 C.ar 1 UNL111111111 -0.1039 18 C 1.4191 -0.5943 0.7156 C.ar 1 UNL111111111 0.0522 19 C 2.7828 -0.3254 0.5747 C.ar 1 UNL111111111 -0.1810 20 C 3.6760 -1.3847 0.3866 C.ar 1 UNL111111111 0.2199 21 C 3.2100 -2.7107 0.3618 C.ar 1 UNL111111111 -0.2533 22 C 1.8500 -2.9608 0.5105 C.ar 1 UNL111111111 -0.0986 23 C 0.9501 -1.9121 0.6827 C.ar 1 UNL111111111 -0.2042 24 N 5.0692 -1.1760 0.2316 N.am 1 UNL111111111 -0.5771 25 C 5.6318 -0.0003 -0.2653 C.2 1 UNL111111111 0.5791 26 O 4.9691 0.9679 -0.5541 O.2 1 UNL111111111 -0.4679 27 C 7.1166 -0.0388 -0.4021 C.ar 1 UNL111111111 -0.1337 28 C 7.8689 0.9218 0.2725 C.ar 1 UNL111111111 -0.0959 29 C 9.2561 0.9252 0.1400 C.ar 1 UNL111111111 -0.1575 30 C 9.8804 -0.0250 -0.6670 C.ar 1 UNL111111111 -0.1226 31 C 9.1203 -0.9736 -1.3510 C.ar 1 UNL111111111 -0.1560 32 C 7.7329 -0.9808 -1.2238 C.ar 1 UNL111111111 -0.1261 33 H -6.6555 -1.5713 1.8936 H 1 UNL111111111 0.3224 34 H -8.3223 -0.4024 -0.3426 H 1 UNL111111111 0.3072 35 H -4.4947 -0.3337 -1.5582 H 1 UNL111111111 0.1359 36 H -3.7637 -0.6819 0.0618 H 1 UNL111111111 0.1502 37 H -5.4604 1.7401 0.2850 H 1 UNL111111111 0.1873 38 H -4.0196 1.7489 -2.3138 H 1 UNL111111111 0.1333 39 H -4.9334 3.8677 -2.1522 H 1 UNL111111111 0.3190 40 H -1.8951 2.5391 -1.5340 H 1 UNL111111111 0.1785 41 H -2.7499 3.9959 -1.0240 H 1 UNL111111111 0.1730 42 H -2.7202 3.3420 1.2828 H 1 UNL111111111 0.1493 43 H -0.2361 3.4983 1.9184 H 1 UNL111111111 0.1853 44 H -1.4636 -0.0712 -0.0631 H 1 UNL111111111 0.1796 45 H 3.1320 0.7129 0.6194 H 1 UNL111111111 0.2118 46 H 3.9006 -3.5360 0.2217 H 1 UNL111111111 0.1514 47 H 1.4852 -3.9865 0.4894 H 1 UNL111111111 0.1473 48 H -0.1097 -2.1165 0.8052 H 1 UNL111111111 0.1557 49 H 5.6719 -1.9653 0.4320 H 1 UNL111111111 0.3131 50 H 7.3698 1.6678 0.8938 H 1 UNL111111111 0.1686 51 H 9.8508 1.6707 0.6645 H 1 UNL111111111 0.1548 52 H 10.9648 -0.0256 -0.7666 H 1 UNL111111111 0.1494 53 H 9.6115 -1.7082 -1.9861 H 1 UNL111111111 0.1529 54 H 7.1366 -1.7087 -1.7721 H 1 UNL111111111 0.1569 @BOND 1 1 2 2 2 1 3 1 3 1 4 1 4 1 5 1 5 3 33 1 6 4 34 1 7 5 6 1 8 6 7 1 9 6 35 1 10 6 36 1 11 7 8 1 12 7 9 1 13 7 37 1 14 8 12 1 15 9 10 1 16 9 11 1 17 9 38 1 18 10 39 1 19 11 12 1 20 11 40 1 21 11 41 1 22 12 13 1 23 12 42 1 24 13 14 ar 25 13 17 ar 26 14 15 ar 27 14 43 1 28 15 16 ar 29 16 17 ar 30 16 18 1 31 17 44 1 32 18 19 ar 33 18 23 ar 34 19 20 ar 35 19 45 1 36 20 21 ar 37 20 24 1 38 21 22 ar 39 21 46 1 40 22 23 ar 41 22 47 1 42 23 48 1 43 24 25 am 44 24 49 1 45 25 26 2 46 25 27 1 47 27 28 ar 48 27 32 ar 49 28 29 ar 50 28 50 1 51 29 30 ar 52 29 51 1 53 30 31 ar 54 30 52 1 55 31 32 ar 56 31 53 1 57 32 54 1