@MOLECULE 3-(2-aminoethyl)-1h-indole-5,6-diol 26 27 0 0 0 SMALL GASTEIGER @ATOM 1 O 2.4737 2.3140 -0.1949 O.3 1 UNL1111111111 -0.4960 2 O 3.9107 0.1031 0.3323 O.3 1 UNL1111111111 -0.4476 3 N -0.1959 -2.4693 0.0813 N.ar 1 UNL1111111111 -0.3628 4 N -4.4659 1.5522 0.3557 N.3 1 UNL1111111111 -0.6525 5 C -1.5318 -0.6825 -0.3703 C.ar 1 UNL1111111111 -0.0892 6 C -0.1832 -0.2076 -0.2315 C.ar 1 UNL1111111111 -0.0891 7 C 0.6314 -1.3516 0.0499 C.ar 1 UNL1111111111 0.1132 8 C -2.7156 0.1519 -0.6527 C.3 1 UNL1111111111 -0.2640 9 C -1.5081 -2.0552 -0.1765 C.ar 1 UNL1111111111 -0.0604 10 C 0.4054 1.0624 -0.3190 C.ar 1 UNL1111111111 -0.2026 11 C -3.2722 0.7335 0.6652 C.3 1 UNL1111111111 -0.0906 12 C 2.0199 -1.2623 0.2431 C.ar 1 UNL1111111111 -0.2843 13 C 1.7654 1.1460 -0.1276 C.ar 1 UNL1111111111 0.1162 14 C 2.5716 -0.0001 0.1495 C.ar 1 UNL1111111111 0.2492 15 H -2.4623 0.9717 -1.3555 H 1 UNL1111111111 0.1491 16 H -3.5147 -0.4283 -1.1621 H 1 UNL1111111111 0.1628 17 H -2.3162 -2.7596 -0.2031 H 1 UNL1111111111 0.1645 18 H 0.0972 -3.4010 0.2495 H 1 UNL1111111111 0.3127 19 H -0.2049 1.9327 -0.5342 H 1 UNL1111111111 0.1629 20 H -2.4775 1.3004 1.1946 H 1 UNL1111111111 0.1135 21 H -3.5846 -0.0953 1.3380 H 1 UNL1111111111 0.1417 22 H 2.6336 -2.1302 0.4540 H 1 UNL1111111111 0.1829 23 H -4.2396 2.3415 -0.2252 H 1 UNL1111111111 0.2442 24 H -4.9209 1.8814 1.1896 H 1 UNL1111111111 0.2460 25 H 1.8760 3.0935 -0.2778 H 1 UNL1111111111 0.3370 26 H 4.2072 1.0499 0.2549 H 1 UNL1111111111 0.3432 @BOND 1 1 13 1 2 1 25 1 3 2 14 1 4 2 26 1 5 3 7 ar 6 3 9 ar 7 3 18 1 8 4 11 1 9 4 23 1 10 4 24 1 11 5 6 ar 12 5 8 1 13 5 9 ar 14 6 7 ar 15 6 10 ar 16 7 12 ar 17 8 11 1 18 8 15 1 19 8 16 1 20 9 17 1 21 10 13 ar 22 10 19 1 23 11 20 1 24 11 21 1 25 12 14 ar 26 12 22 1 27 13 14 ar