@MOLECULE 2-{5-[ammonio(imino)methyl]-6-chloro-1h-indol-2-yl}-6-(cyclopentyloxy)phenolate 46 49 0 0 0 SMALL GASTEIGER @ATOM 1 CL 5.1450 2.3570 -0.0649 Cl 1 UNL11 -0.0911 2 O -4.6596 -0.1343 -0.8205 O.3 1 UNL11 -0.3945 3 O -2.1142 0.6641 -0.6561 O.3 1 UNL11 -0.4955 4 N 0.4191 0.2377 0.0745 N.ar 1 UNL11 -0.3480 5 N 6.6722 -0.1794 1.1242 N.pl3 1 UNL11 -0.6950 6 N 6.5305 -0.9920 -1.1213 N.2 1 UNL11 -0.6101 7 C -5.6612 0.3151 0.1060 C.3 1 UNL11 0.1352 8 C -6.4973 1.2816 -0.7496 C.3 1 UNL11 -0.2979 9 C -5.0373 1.1264 1.2499 C.3 1 UNL11 -0.3274 10 C -6.3068 2.6864 -0.1539 C.3 1 UNL11 -0.2617 11 C -5.1133 2.5966 0.8139 C.3 1 UNL11 -0.2531 12 C -3.7635 -1.0399 -0.3221 C.ar 1 UNL11 0.0815 13 C -2.4222 -0.6110 -0.3070 C.ar 1 UNL11 0.2201 14 C -1.3916 -1.4827 0.0619 C.ar 1 UNL11 -0.0926 15 C 0.0075 -1.1058 0.0547 C.ar 1 UNL11 0.1335 16 C -4.1017 -2.3336 0.0437 C.ar 1 UNL11 -0.1610 17 C 2.2834 -1.0812 0.0192 C.ar 1 UNL11 -0.0786 18 C 1.8037 0.2739 0.0325 C.ar 1 UNL11 0.1274 19 C 1.1306 -1.9270 0.0349 C.ar 1 UNL11 -0.2445 20 C -1.7548 -2.7870 0.4377 C.ar 1 UNL11 -0.1088 21 C -3.0802 -3.2055 0.4282 C.ar 1 UNL11 -0.1720 22 C 3.6592 -1.3284 -0.0169 C.ar 1 UNL11 -0.0358 23 C 2.6791 1.3715 0.0103 C.ar 1 UNL11 -0.2383 24 C 4.5272 -0.2485 -0.0244 C.ar 1 UNL11 -0.1312 25 C 4.0198 1.0653 -0.0194 C.ar 1 UNL11 0.0619 26 C 5.9927 -0.4815 -0.0717 C.2 1 UNL11 0.4297 27 H -6.2252 -0.5681 0.4573 H 1 UNL11 0.1197 28 H -7.5574 0.9863 -0.7662 H 1 UNL11 0.1449 29 H -6.1571 1.2446 -1.8041 H 1 UNL11 0.1650 30 H -4.0014 0.8125 1.4613 H 1 UNL11 0.1554 31 H -5.5994 0.9646 2.1860 H 1 UNL11 0.1486 32 H -7.2166 3.0090 0.3805 H 1 UNL11 0.1370 33 H -6.1304 3.4383 -0.9392 H 1 UNL11 0.1385 34 H -4.1800 2.9049 0.3122 H 1 UNL11 0.1346 35 H -5.2355 3.2721 1.6749 H 1 UNL11 0.1373 36 H -5.1381 -2.6613 0.0200 H 1 UNL11 0.1648 37 H 1.1510 -2.9943 0.0194 H 1 UNL11 0.1689 38 H -0.1990 1.0172 -0.0006 H 1 UNL11 0.3329 39 H -0.9735 -3.4852 0.7440 H 1 UNL11 0.1647 40 H -3.3274 -4.2251 0.7189 H 1 UNL11 0.1584 41 H 4.0381 -2.3508 -0.0493 H 1 UNL11 0.1744 42 H 2.3066 2.3914 0.0085 H 1 UNL11 0.1807 43 H -2.9438 1.1598 -0.9201 H 1 UNL11 0.3635 44 H 7.6607 -0.0412 1.0981 H 1 UNL11 0.2893 45 H 6.2005 0.3480 1.8313 H 1 UNL11 0.2984 46 H 7.5165 -1.1589 -1.1839 H 1 UNL11 0.2710 @BOND 1 1 25 1 2 2 7 1 3 2 12 1 4 3 13 1 5 3 43 1 6 4 15 ar 7 4 18 ar 8 4 38 1 9 5 26 1 10 5 44 1 11 5 45 1 12 6 26 2 13 6 46 1 14 7 8 1 15 7 9 1 16 7 27 1 17 8 10 1 18 8 28 1 19 8 29 1 20 9 11 1 21 9 30 1 22 9 31 1 23 10 11 1 24 10 32 1 25 10 33 1 26 11 34 1 27 11 35 1 28 12 13 ar 29 12 16 ar 30 13 14 ar 31 14 15 1 32 14 20 ar 33 15 19 ar 34 16 21 ar 35 16 36 1 36 17 18 ar 37 17 19 ar 38 17 22 ar 39 18 23 ar 40 19 37 1 41 20 21 ar 42 20 39 1 43 21 40 1 44 22 24 ar 45 22 41 1 46 23 25 ar 47 23 42 1 48 24 25 ar 49 24 26 1