@MOLECULE 2,6-bis(2-amino-1-(6-bromo-1h-indol-3-yl)ethyl)-3-(2-aminoethyl)-1h-indol-5-ol 69 74 0 0 0 SMALL USER_CHARGES @ATOM 1 BR 9.0466 -2.3873 0.1789 Br 1 UNL11 -0.0507 2 BR -9.8329 -2.0297 -0.2336 Br 1 UNL11 -0.0643 3 O -2.6456 -0.4338 2.0906 O.3 1 UNL11 -0.4868 4 N 1.1631 2.6104 -0.3875 N.ar 1 UNL11 -0.3727 5 N 4.8759 -0.2883 -2.4483 N.ar 1 UNL11 -0.3634 6 N 2.9921 4.8270 -0.5341 N.3 1 UNL11 -0.6610 7 N -4.8064 -0.9789 -1.7730 N.ar 1 UNL11 -0.3673 8 N -3.7801 4.1462 0.9475 N.3 1 UNL11 -0.6477 9 N 4.0790 -2.0958 1.4416 N.3 1 UNL11 -0.6497 10 C 3.6858 2.4382 -0.2195 C.3 1 UNL11 -0.1018 11 C 2.3041 1.9939 0.1390 C.ar 1 UNL11 0.0967 12 C 1.9325 0.9404 0.9681 C.ar 1 UNL11 -0.1411 13 C 0.4975 0.9126 0.9981 C.ar 1 UNL11 -0.0200 14 C 0.0427 1.9859 0.1654 C.ar 1 UNL11 0.0488 15 C -3.7236 1.7100 0.5567 C.3 1 UNL11 -0.1023 16 C 4.3800 1.3296 -0.9266 C.ar 1 UNL11 -0.1165 17 C -2.2406 1.4679 0.6283 C.ar 1 UNL11 -0.1024 18 C 2.8193 0.0033 1.6830 C.3 1 UNL11 -0.2502 19 C 3.7512 3.6983 -1.1233 C.3 1 UNL11 -0.1107 20 C -1.3155 2.2610 -0.0261 C.ar 1 UNL11 -0.1911 21 C -0.4403 0.0939 1.6286 C.ar 1 UNL11 -0.2071 22 C -4.3872 0.6484 -0.2398 C.ar 1 UNL11 -0.1434 23 C -1.7798 0.3853 1.4268 C.ar 1 UNL11 0.2251 24 C 5.5326 0.6150 -0.4528 C.ar 1 UNL11 -0.0785 25 C -4.1255 3.0885 -0.0281 C.3 1 UNL11 -0.0980 26 C 4.0058 0.7585 -2.1341 C.ar 1 UNL11 -0.0223 27 C 2.9447 -1.3179 0.8903 C.3 1 UNL11 -0.0933 28 C 5.8165 -0.3976 -1.4281 C.ar 1 UNL11 0.1008 29 C -5.7327 0.1839 -0.0372 C.ar 1 UNL11 -0.0885 30 C -3.8541 -0.0743 -1.2956 C.ar 1 UNL11 -0.0145 31 C -5.9642 -0.8412 -1.0115 C.ar 1 UNL11 0.1080 32 C 6.3309 0.7060 0.6924 C.ar 1 UNL11 -0.0936 33 C 6.8709 -1.3085 -1.2694 C.ar 1 UNL11 -0.2258 34 C -6.7512 0.5262 0.8578 C.ar 1 UNL11 -0.0887 35 C 7.3682 -0.1939 0.8600 C.ar 1 UNL11 -0.1991 36 C -7.1868 -1.5233 -1.0954 C.ar 1 UNL11 -0.2229 37 C 7.6142 -1.1760 -0.1166 C.ar 1 UNL11 0.0089 38 C -7.9600 -0.1430 0.7830 C.ar 1 UNL11 -0.2005 39 C -8.1497 -1.1462 -0.1844 C.ar 1 UNL11 0.0196 40 H -3.5216 -0.4951 1.6360 H 1 UNL11 0.3348 41 H 1.1846 3.5322 -0.7843 H 1 UNL11 0.3372 42 H 4.8383 -0.8525 -3.2654 H 1 UNL11 0.3183 43 H 3.1872 5.6925 -1.0116 H 1 UNL11 0.2530 44 H 3.1940 4.9460 0.4469 H 1 UNL11 0.2560 45 H -4.6682 -1.6399 -2.5014 H 1 UNL11 0.3164 46 H -3.9796 5.0638 0.5886 H 1 UNL11 0.2444 47 H -2.8081 4.1009 1.2137 H 1 UNL11 0.2547 48 H 4.9571 -1.6279 1.2749 H 1 UNL11 0.2461 49 H 4.1288 -3.0160 1.0383 H 1 UNL11 0.2418 50 H 4.2243 2.6690 0.7429 H 1 UNL11 0.1664 51 H -4.1221 1.6940 1.6174 H 1 UNL11 0.1851 52 H 2.4345 -0.2149 2.7024 H 1 UNL11 0.1646 53 H 3.8248 0.4428 1.8432 H 1 UNL11 0.1454 54 H 4.8195 3.9465 -1.3068 H 1 UNL11 0.1272 55 H 3.2980 3.4775 -2.1162 H 1 UNL11 0.1478 56 H -1.6132 3.0787 -0.6737 H 1 UNL11 0.1550 57 H -0.1361 -0.7398 2.2559 H 1 UNL11 0.1813 58 H -3.6700 3.2352 -1.0281 H 1 UNL11 0.1117 59 H -5.2306 3.1123 -0.1735 H 1 UNL11 0.1494 60 H 3.1793 1.0073 -2.7760 H 1 UNL11 0.1749 61 H 2.0151 -1.9144 1.0079 H 1 UNL11 0.1416 62 H 3.0598 -1.0968 -0.1920 H 1 UNL11 0.1108 63 H -2.8727 -0.0129 -1.7332 H 1 UNL11 0.1774 64 H 6.1292 1.4715 1.4401 H 1 UNL11 0.1617 65 H 7.0729 -2.0653 -2.0216 H 1 UNL11 0.1764 66 H -6.5857 1.3104 1.5972 H 1 UNL11 0.1688 67 H 7.9932 -0.1390 1.7520 H 1 UNL11 0.1749 68 H -7.3449 -2.2973 -1.8397 H 1 UNL11 0.1733 69 H -8.7621 0.1098 1.4758 H 1 UNL11 0.1714 @BOND 1 42 5 1 2 60 26 1 3 45 7 1 4 5 26 ar 5 5 28 ar 6 26 16 ar 7 55 19 1 8 65 33 1 9 68 36 1 10 7 30 ar 11 7 31 ar 12 63 30 1 13 28 33 ar 14 28 24 ar 15 54 19 1 16 30 22 ar 17 33 37 ar 18 19 6 1 19 19 10 1 20 36 31 ar 21 36 39 ar 22 58 25 1 23 43 6 1 24 31 29 ar 25 16 24 ar 26 16 10 1 27 41 4 1 28 56 20 1 29 6 44 1 30 24 32 ar 31 4 11 ar 32 4 14 ar 33 22 29 ar 34 22 15 1 35 2 39 1 36 10 11 1 37 10 50 1 38 62 27 1 39 39 38 ar 40 59 25 1 41 37 1 1 42 37 35 ar 43 29 34 ar 44 25 15 1 45 25 8 1 46 20 14 ar 47 20 17 ar 48 11 12 ar 49 14 13 ar 50 15 17 1 51 15 51 1 52 46 8 1 53 17 23 ar 54 32 35 ar 55 32 64 1 56 38 34 ar 57 38 69 1 58 34 66 1 59 35 67 1 60 27 61 1 61 27 9 1 62 27 18 1 63 8 47 1 64 12 13 ar 65 12 18 1 66 13 21 ar 67 49 9 1 68 48 9 1 69 23 21 ar 70 23 3 1 71 21 57 1 72 40 3 1 73 18 53 1 74 18 52 1