@MOLECULE n-[n-(4-acetamido-3,5-dichlorobenzyl)carbamimidoyl]-2-(1h-indol-1-yl)acetamide 48 50 0 0 0 SMALL GASTEIGER @ATOM 1 C -3.1619 3.8801 -0.5941 C.3 1 UNL1111 -0.5265 2 C -2.6733 2.4627 -0.5943 C.2 1 UNL1111 0.6277 3 O -2.2087 1.8979 -1.5575 O.2 1 UNL1111 -0.5069 4 N -2.7815 1.8053 0.6329 N.am 1 UNL1111 -0.5905 5 C -2.3661 0.4580 0.7648 C.ar 1 UNL1111 0.1334 6 C -1.3130 0.1077 1.6194 C.ar 1 UNL1111 -0.0308 7 C -0.8932 -1.2036 1.7705 C.ar 1 UNL1111 -0.1681 8 CL -0.4933 1.3322 2.4691 Cl 1 UNL1111 -0.0444 9 C -2.9894 -0.5769 0.0572 C.ar 1 UNL1111 0.0042 10 CL -4.3008 -0.2218 -0.9632 Cl 1 UNL1111 -0.0310 11 C -2.5666 -1.8957 0.1636 C.ar 1 UNL1111 -0.1576 12 C -1.5064 -2.2058 1.0148 C.ar 1 UNL1111 -0.0329 13 C -0.9240 -3.5977 1.0253 C.3 1 UNL1111 -0.0883 14 N 0.1259 -3.6974 -0.0133 N.pl3 1 UNL1111 -0.4977 15 C 1.2784 -2.9359 0.2867 C.2 1 UNL1111 0.5690 16 N 1.9508 -3.1448 1.3613 N.pl3 1 UNL1111 -0.6258 17 N 1.6871 -1.9329 -0.6735 N.am 1 UNL1111 -0.6750 18 C 0.9135 -1.4474 -1.7218 C.2 1 UNL1111 0.5747 19 O -0.0892 -2.0081 -2.1050 O.2 1 UNL1111 -0.5108 20 C 1.3797 -0.1424 -2.3895 C.3 1 UNL1111 -0.1614 21 N 1.8200 0.8483 -1.4374 N.ar 1 UNL1111 -0.2992 22 C 3.0793 0.8811 -0.8285 C.ar 1 UNL1111 0.0776 23 C 4.2635 0.2021 -1.1394 C.ar 1 UNL1111 -0.2388 24 C 5.3662 0.4553 -0.3425 C.ar 1 UNL1111 -0.1129 25 C 5.3054 1.3637 0.7334 C.ar 1 UNL1111 -0.1939 26 C 4.1409 2.0502 1.0324 C.ar 1 UNL1111 -0.1060 27 C 3.0053 1.8175 0.2531 C.ar 1 UNL1111 -0.0493 28 C 1.6621 2.3284 0.2781 C.ar 1 UNL1111 -0.2565 29 C 0.9601 1.7045 -0.7320 C.ar 1 UNL1111 0.0010 30 H -3.0410 4.3203 -1.5993 H 1 UNL1111 0.1916 31 H -4.2292 3.9470 -0.3410 H 1 UNL1111 0.1772 32 H -2.6011 4.5130 0.1068 H 1 UNL1111 0.1777 33 H -3.0719 2.2846 1.4735 H 1 UNL1111 0.3274 34 H -0.0715 -1.4549 2.4492 H 1 UNL1111 0.1941 35 H -3.0440 -2.6790 -0.4302 H 1 UNL1111 0.1845 36 H -0.4861 -3.8614 2.0197 H 1 UNL1111 0.1843 37 H -1.6886 -4.3773 0.8073 H 1 UNL1111 0.1605 38 H -0.2458 -3.5415 -0.9600 H 1 UNL1111 0.3229 39 H 2.7912 -2.6482 1.5839 H 1 UNL1111 0.2899 40 H 2.5507 -1.4338 -0.4413 H 1 UNL1111 0.3299 41 H 2.1856 -0.3672 -3.1299 H 1 UNL1111 0.1851 42 H 0.5123 0.2625 -2.9833 H 1 UNL1111 0.2105 43 H 4.3220 -0.4770 -1.9825 H 1 UNL1111 0.1579 44 H 6.3088 -0.0512 -0.5482 H 1 UNL1111 0.1510 45 H 6.1996 1.5263 1.3316 H 1 UNL1111 0.1532 46 H 4.0977 2.7582 1.8568 H 1 UNL1111 0.1556 47 H 1.2998 3.0667 0.9599 H 1 UNL1111 0.1711 48 H -0.0719 1.8084 -1.0294 H 1 UNL1111 0.1923 @BOND 1 1 2 1 2 1 30 1 3 1 31 1 4 1 32 1 5 2 3 2 6 2 4 am 7 4 5 1 8 4 33 1 9 5 6 ar 10 6 7 ar 11 6 8 1 12 7 34 1 13 9 5 ar 14 9 11 ar 15 10 9 1 16 11 12 ar 17 11 35 1 18 12 7 ar 19 12 13 1 20 13 36 1 21 13 37 1 22 14 13 1 23 14 15 1 24 14 38 1 25 15 16 2 26 16 39 1 27 17 15 1 28 17 40 1 29 18 20 1 30 18 17 am 31 19 18 2 32 20 41 1 33 20 42 1 34 21 20 1 35 22 23 ar 36 22 21 ar 37 23 43 1 38 24 23 ar 39 24 44 1 40 25 24 ar 41 25 45 1 42 26 25 ar 43 26 27 ar 44 26 46 1 45 27 28 ar 46 27 22 ar 47 28 29 ar 48 28 47 1 49 29 21 ar 50 29 48 1