@MOLECULE n-[(2r)-1-(2-{[(5-carbamimidoyl-1-methyl-1h-pyrrol-2-yl)methyl]carbamoyl}-1h-pyrrol-1-yl)-3-cyclohexyl-1-oxo-2-propanyl]glycine 65 67 0 0 0 SMALL GASTEIGER @ATOM 1 C 1.4056 -0.1490 -0.7248 C.2 1 UNL1111111111 0.5096 2 O 0.7718 -1.1446 -0.4901 O.2 1 UNL1111111111 -0.4286 3 C 2.9431 -0.1054 -0.7549 C.3 1 UNL1111111111 -0.0039 4 C 3.4173 0.6702 0.4899 C.3 1 UNL1111111111 -0.3109 5 C 4.9434 0.8752 0.4714 C.3 1 UNL1111111111 -0.0800 6 C 5.3283 2.0338 -0.4650 C.3 1 UNL1111111111 -0.2748 7 C 6.8512 2.2243 -0.4730 C.3 1 UNL1111111111 -0.2661 8 C 7.3681 2.4974 0.9455 C.3 1 UNL1111111111 -0.2685 9 C 6.9677 1.3586 1.8925 C.3 1 UNL1111111111 -0.2682 10 C 5.4453 1.1688 1.8963 C.3 1 UNL1111111111 -0.2792 11 N 3.5276 -1.4443 -0.8466 N.3 1 UNL1111111111 -0.5152 12 C 3.3632 -2.2811 0.3604 C.3 1 UNL1111111111 -0.1773 13 C 3.5573 -3.7249 -0.0254 C.2 1 UNL1111111111 0.6347 14 O 3.8770 -4.4527 1.0749 O.3 1 UNL1111111111 -0.5629 15 O 3.4451 -4.2384 -1.1059 O.2 1 UNL1111111111 -0.5002 16 O -1.4808 0.0816 1.1647 O.2 1 UNL1111111111 -0.5290 17 C -1.4951 0.2189 -0.0438 C.2 1 UNL1111111111 0.6008 18 C -0.6716 1.2340 -0.7431 C.ar 1 UNL1111111111 -0.0314 19 C -1.0326 2.5035 -1.1564 C.ar 1 UNL1111111111 -0.1738 20 C 0.1450 3.1350 -1.6739 C.ar 1 UNL1111111111 -0.1935 21 C 1.1920 2.2378 -1.5621 C.ar 1 UNL1111111111 -0.0601 22 N 0.7010 1.0525 -0.9890 N.ar 1 UNL1111111111 -0.3254 23 N -8.0711 1.9161 0.4051 N.2 1 UNL1111111111 -0.6126 24 C -7.5357 0.8199 0.8252 C.2 1 UNL1111111111 0.3998 25 N -7.8749 0.3772 2.1184 N.pl3 1 UNL1111111111 -0.6250 26 C -6.5560 -0.0112 0.1100 C.ar 1 UNL1111111111 -0.1125 27 N -5.2748 -0.2915 0.5552 N.ar 1 UNL1111111111 -0.1260 28 C -4.7017 0.1564 1.8099 C.3 1 UNL1111111111 -0.2725 29 C -6.7285 -0.6179 -1.1446 C.ar 1 UNL1111111111 -0.1950 30 C -5.5224 -1.2772 -1.4607 C.ar 1 UNL1111111111 -0.2328 31 C -4.6314 -1.0610 -0.3959 C.ar 1 UNL1111111111 -0.0059 32 C -3.2225 -1.5251 -0.2751 C.3 1 UNL1111111111 -0.0543 33 N -2.3102 -0.5310 -0.8543 N.am 1 UNL1111111111 -0.5657 34 H 3.2828 0.4378 -1.6840 H 1 UNL1111111111 0.1724 35 H 2.9061 1.6516 0.5463 H 1 UNL1111111111 0.1554 36 H 3.1150 0.1379 1.4130 H 1 UNL1111111111 0.1588 37 H 5.4339 -0.0617 0.1038 H 1 UNL1111111111 0.1624 38 H 4.9737 1.8325 -1.4913 H 1 UNL1111111111 0.1273 39 H 4.8360 2.9684 -0.1400 H 1 UNL1111111111 0.1353 40 H 7.3422 1.3229 -0.8862 H 1 UNL1111111111 0.1387 41 H 7.1265 3.0573 -1.1445 H 1 UNL1111111111 0.1283 42 H 8.4668 2.6148 0.9344 H 1 UNL1111111111 0.1305 43 H 6.9626 3.4567 1.3170 H 1 UNL1111111111 0.1358 44 H 7.4647 0.4197 1.5836 H 1 UNL1111111111 0.1382 45 H 7.3270 1.5714 2.9156 H 1 UNL1111111111 0.1307 46 H 4.9535 2.0746 2.2957 H 1 UNL1111111111 0.1382 47 H 5.1726 0.3429 2.5780 H 1 UNL1111111111 0.1329 48 H 3.2015 -1.9432 -1.6826 H 1 UNL1111111111 0.2917 49 H 4.1369 -1.9726 1.1085 H 1 UNL1111111111 0.1873 50 H 2.3665 -2.1755 0.8602 H 1 UNL1111111111 0.1849 51 H 3.9954 -5.4179 0.8935 H 1 UNL1111111111 0.3593 52 H -2.0040 2.9515 -1.0973 H 1 UNL1111111111 0.1734 53 H 0.1868 4.1284 -2.0702 H 1 UNL1111111111 0.1677 54 H 2.2203 2.3465 -1.8447 H 1 UNL1111111111 0.1673 55 H -7.7757 2.3294 -0.4609 H 1 UNL1111111111 0.2822 56 H -8.6303 0.8736 2.5671 H 1 UNL1111111111 0.2990 57 H -7.9000 -0.6148 2.2595 H 1 UNL1111111111 0.2878 58 H -4.6204 -0.6817 2.5271 H 1 UNL1111111111 0.1610 59 H -3.6824 0.5714 1.6588 H 1 UNL1111111111 0.1897 60 H -5.3240 0.9434 2.2784 H 1 UNL1111111111 0.1793 61 H -7.6132 -0.5872 -1.7437 H 1 UNL1111111111 0.1632 62 H -5.3242 -1.8408 -2.3459 H 1 UNL1111111111 0.1639 63 H -2.9381 -1.7250 0.7908 H 1 UNL1111111111 0.1819 64 H -3.0861 -2.4956 -0.8152 H 1 UNL1111111111 0.1614 65 H -2.3630 -0.3831 -1.8485 H 1 UNL1111111111 0.3208 @BOND 1 1 2 2 2 1 3 1 3 3 4 1 4 3 11 1 5 3 34 1 6 4 5 1 7 4 35 1 8 4 36 1 9 5 6 1 10 5 10 1 11 5 37 1 12 6 7 1 13 6 38 1 14 6 39 1 15 7 8 1 16 7 40 1 17 7 41 1 18 8 9 1 19 8 42 1 20 8 43 1 21 9 10 1 22 9 44 1 23 9 45 1 24 10 46 1 25 10 47 1 26 11 12 1 27 11 48 1 28 12 13 1 29 12 49 1 30 12 50 1 31 13 14 1 32 13 15 2 33 14 51 1 34 17 16 2 35 17 18 1 36 18 19 ar 37 18 22 ar 38 19 20 ar 39 19 52 1 40 20 21 ar 41 20 53 1 42 21 22 ar 43 21 54 1 44 22 1 am 45 23 24 2 46 23 55 1 47 24 25 1 48 24 26 1 49 25 56 1 50 25 57 1 51 26 27 ar 52 26 29 ar 53 27 28 1 54 27 31 ar 55 28 58 1 56 28 59 1 57 28 60 1 58 29 30 ar 59 29 61 1 60 30 31 ar 61 30 62 1 62 31 32 1 63 32 33 1 64 32 63 1 65 32 64 1 66 33 17 am 67 33 65 1