@MOLECULE ethyl {[(e)-{[1-(2-{[(4-carbamimidoylphenyl)amino]methyl}-1-methyl-1h-benzimidazol-5-yl)cyclopropyl](2-pyridinyl)methylene}amino]oxy}acetate 70 74 0 0 0 SMALL GASTEIGER @ATOM 1 O 3.7384 1.6561 -0.1199 O.2 1 UNL11 -0.0924 2 O 2.8906 4.9820 0.6359 O.3 1 UNL11 -0.4426 3 O 2.5334 3.7333 -1.2008 O.2 1 UNL11 -0.4730 4 N 4.5737 0.7426 0.4911 N.2 1 UNL11 -0.2382 5 N -1.3726 -2.1508 0.3503 N.ar 1 UNL11 -0.2946 6 N 5.3687 -2.6846 -0.0919 N.ar 1 UNL11 -0.3716 7 N -0.9924 0.0593 0.0108 N.ar 1 UNL11 -0.3907 8 N -4.2518 -1.0374 -0.1671 N.pl3 1 UNL11 -0.5282 9 N -10.4229 -0.1130 1.2327 N.pl3 1 UNL11 -0.7157 10 N -10.2847 1.0631 -0.8385 N.2 1 UNL11 -0.6290 11 C 3.7697 -0.6862 -1.3433 C.3 1 UNL11 -0.0336 12 C 3.9415 0.1847 -2.5802 C.3 1 UNL11 -0.2985 13 C 4.4098 -1.2428 -2.6024 C.3 1 UNL11 -0.2851 14 C 2.4120 -1.1277 -0.9365 C.ar 1 UNL11 -0.0295 15 C 4.6032 -0.3931 -0.1397 C.2 1 UNL11 0.1254 16 C 1.4213 -0.1837 -0.7336 C.ar 1 UNL11 -0.1057 17 C 2.1817 -2.5101 -0.7285 C.ar 1 UNL11 -0.1127 18 C 5.4826 -1.4436 0.4313 C.ar 1 UNL11 0.1698 19 C 0.1736 -0.6415 -0.2942 C.ar 1 UNL11 0.0492 20 C 0.9587 -2.9887 -0.3055 C.ar 1 UNL11 -0.1996 21 C -0.0524 -2.0452 -0.0831 C.ar 1 UNL11 0.0483 22 C 6.3814 -1.1584 1.4732 C.ar 1 UNL11 -0.2098 23 C -1.8989 -0.8500 0.3922 C.ar 1 UNL11 0.1993 24 C 7.1704 -2.1881 1.9799 C.ar 1 UNL11 -0.0857 25 C -2.0572 -3.3863 0.6683 C.3 1 UNL11 -0.2399 26 C -3.2871 -0.5134 0.8222 C.3 1 UNL11 -0.0888 27 C 6.1337 -3.6701 0.4045 C.ar 1 UNL11 0.0531 28 C 7.0516 -3.4679 1.4443 C.ar 1 UNL11 -0.2329 29 C 3.5895 2.7706 0.7796 C.3 1 UNL11 -0.1703 30 C 2.9466 3.8310 -0.0777 C.2 1 UNL11 0.5804 31 C -5.5814 -0.6020 -0.0823 C.ar 1 UNL11 0.2587 32 C -6.1313 -0.0932 1.1072 C.ar 1 UNL11 -0.2897 33 C -6.4035 -0.7748 -1.2166 C.ar 1 UNL11 -0.2892 34 C -7.4845 0.2193 1.1601 C.ar 1 UNL11 -0.0554 35 C -7.7500 -0.4569 -1.1475 C.ar 1 UNL11 -0.0238 36 C 2.2581 6.0982 -0.0129 C.3 1 UNL11 0.0130 37 C -8.3002 0.0262 0.0451 C.ar 1 UNL11 -0.1510 38 C 2.5617 7.2760 0.8970 C.3 1 UNL11 -0.4658 39 C -9.7417 0.3596 0.0929 C.2 1 UNL11 0.4344 40 H 4.6608 0.9998 -2.5673 H 1 UNL11 0.1631 41 H 3.0580 0.4793 -3.1441 H 1 UNL11 0.1715 42 H 3.8679 -1.9874 -3.1813 H 1 UNL11 0.1661 43 H 5.4713 -1.4742 -2.6020 H 1 UNL11 0.1589 44 H 1.5870 0.8823 -0.9014 H 1 UNL11 0.1903 45 H 3.0144 -3.1995 -0.9022 H 1 UNL11 0.1816 46 H 0.7851 -4.0462 -0.1444 H 1 UNL11 0.1588 47 H 6.4505 -0.1481 1.8781 H 1 UNL11 0.1876 48 H 7.8726 -1.9914 2.7895 H 1 UNL11 0.1568 49 H -1.7153 -3.7844 1.6424 H 1 UNL11 0.1545 50 H -3.1535 -3.2305 0.7203 H 1 UNL11 0.1779 51 H -1.8647 -4.1518 -0.1070 H 1 UNL11 0.1587 52 H -3.5129 -0.9689 1.8181 H 1 UNL11 0.1633 53 H -3.3735 0.5996 0.9428 H 1 UNL11 0.1780 54 H 5.9943 -4.6542 -0.0581 H 1 UNL11 0.1707 55 H 7.6510 -4.2909 1.8190 H 1 UNL11 0.1623 56 H 2.9340 2.4740 1.6231 H 1 UNL11 0.1782 57 H 4.5656 3.0965 1.1871 H 1 UNL11 0.1790 58 H -3.8680 -1.0927 -1.1096 H 1 UNL11 0.3014 59 H -5.5149 0.0614 1.9861 H 1 UNL11 0.1611 60 H -5.9819 -1.1538 -2.1433 H 1 UNL11 0.1634 61 H -7.9075 0.6322 2.0776 H 1 UNL11 0.1549 62 H -8.3896 -0.5656 -2.0277 H 1 UNL11 0.1682 63 H 2.6820 6.2173 -1.0262 H 1 UNL11 0.1374 64 H 1.1793 5.8729 -0.0868 H 1 UNL11 0.1357 65 H 2.1920 7.0997 1.9161 H 1 UNL11 0.1604 66 H 3.6422 7.4537 0.9763 H 1 UNL11 0.1585 67 H 2.0952 8.1945 0.5233 H 1 UNL11 0.1544 68 H -11.4190 -0.0796 1.2605 H 1 UNL11 0.2914 69 H -10.0071 -0.8241 1.7953 H 1 UNL11 0.2974 70 H -11.2576 1.3014 -0.8228 H 1 UNL11 0.2699 @BOND 1 1 4 1 2 1 29 1 3 2 30 1 4 2 36 1 5 3 30 2 6 4 15 2 7 5 21 ar 8 5 23 ar 9 5 25 1 10 6 18 ar 11 6 27 ar 12 7 19 ar 13 7 23 ar 14 8 26 1 15 8 31 1 16 8 58 1 17 9 39 1 18 9 68 1 19 9 69 1 20 10 39 2 21 10 70 1 22 11 12 1 23 11 13 1 24 11 14 1 25 11 15 1 26 12 13 1 27 12 40 1 28 12 41 1 29 13 42 1 30 13 43 1 31 14 16 ar 32 14 17 ar 33 15 18 1 34 16 19 ar 35 16 44 1 36 17 20 ar 37 17 45 1 38 18 22 ar 39 19 21 ar 40 20 21 ar 41 20 46 1 42 22 24 ar 43 22 47 1 44 23 26 1 45 24 28 ar 46 24 48 1 47 25 49 1 48 25 50 1 49 25 51 1 50 26 52 1 51 26 53 1 52 27 28 ar 53 27 54 1 54 28 55 1 55 29 30 1 56 29 56 1 57 29 57 1 58 31 32 ar 59 31 33 ar 60 32 34 ar 61 32 59 1 62 33 35 ar 63 33 60 1 64 34 37 ar 65 34 61 1 66 35 37 ar 67 35 62 1 68 36 38 1 69 36 63 1 70 36 64 1 71 37 39 1 72 38 65 1 73 38 66 1 74 38 67 1