@MOLECULE (3s)-n-[2-(1h-indol-3-yl)ethyl]-3-methyl-2-oxopentanamide 40 41 0 0 0 SMALL GASTEIGER @ATOM 1 O -3.3515 0.1492 1.3633 O.2 1 UNL111111111 -0.3803 2 O -2.6665 -1.7321 -1.0805 O.2 1 UNL111111111 -0.5026 3 N 3.0692 -0.6077 1.3080 N.ar 1 UNL111111111 -0.3766 4 N -1.0397 -1.7795 0.5142 N.am 1 UNL111111111 -0.5695 5 C 1.6956 -1.6282 -0.1932 C.ar 1 UNL111111111 -0.0980 6 C 0.8480 -2.6255 -0.8766 C.3 1 UNL111111111 -0.2901 7 C -1.9808 1.3394 -0.2184 C.3 1 UNL111111111 -0.1893 8 C 1.8166 -0.2443 -0.5666 C.ar 1 UNL111111111 -0.0921 9 C -0.3967 -2.9798 -0.0271 C.3 1 UNL111111111 -0.0538 10 C 2.6848 0.3690 0.3919 C.ar 1 UNL111111111 0.1004 11 C -1.6249 2.3907 0.8438 C.3 1 UNL111111111 -0.2422 12 C 2.4743 -1.8189 0.9373 C.ar 1 UNL111111111 -0.0573 13 C -2.5743 0.1231 0.4511 C.2 1 UNL111111111 0.3790 14 C -3.0163 1.8705 -1.2110 C.3 1 UNL111111111 -0.4361 15 C 1.2838 0.5322 -1.6014 C.ar 1 UNL111111111 -0.1117 16 C -2.1110 -1.2142 -0.1366 C.2 1 UNL111111111 0.4768 17 C 3.0096 1.7319 0.3326 C.ar 1 UNL111111111 -0.2176 18 C -0.4705 1.9202 1.7265 C.3 1 UNL111111111 -0.4556 19 C 1.6007 1.8761 -1.6528 C.ar 1 UNL111111111 -0.1927 20 C 2.4555 2.4681 -0.6962 C.ar 1 UNL111111111 -0.1075 21 H 0.5190 -2.2425 -1.8673 H 1 UNL111111111 0.1643 22 H 1.4187 -3.5509 -1.0976 H 1 UNL111111111 0.1549 23 H -1.0495 1.0619 -0.7757 H 1 UNL111111111 0.1627 24 H -1.1288 -3.5497 -0.6479 H 1 UNL111111111 0.1685 25 H -0.1079 -3.6323 0.8271 H 1 UNL111111111 0.1380 26 H -2.5149 2.6138 1.4671 H 1 UNL111111111 0.1557 27 H -1.3543 3.3415 0.3456 H 1 UNL111111111 0.1414 28 H 2.6462 -2.7150 1.5028 H 1 UNL111111111 0.1677 29 H 3.7015 -0.4784 2.0620 H 1 UNL111111111 0.3149 30 H -0.4847 -1.2480 1.1702 H 1 UNL111111111 0.3134 31 H -3.9437 2.1710 -0.7063 H 1 UNL111111111 0.1578 32 H -3.2820 1.1086 -1.9580 H 1 UNL111111111 0.1611 33 H -2.6348 2.7435 -1.7521 H 1 UNL111111111 0.1503 34 H 0.6367 0.0738 -2.3474 H 1 UNL111111111 0.1593 35 H 3.6709 2.1818 1.0648 H 1 UNL111111111 0.1584 36 H 0.4174 1.6688 1.1311 H 1 UNL111111111 0.1529 37 H -0.1716 2.7010 2.4353 H 1 UNL111111111 0.1481 38 H -0.7440 1.0388 2.3160 H 1 UNL111111111 0.1416 39 H 1.1942 2.5013 -2.4459 H 1 UNL111111111 0.1553 40 H 2.6782 3.5312 -0.7830 H 1 UNL111111111 0.1507 @BOND 1 1 13 2 2 2 16 2 3 3 10 ar 4 3 12 ar 5 3 29 1 6 4 9 1 7 4 16 am 8 4 30 1 9 5 6 1 10 5 8 ar 11 5 12 ar 12 6 9 1 13 6 21 1 14 6 22 1 15 7 11 1 16 7 13 1 17 7 14 1 18 7 23 1 19 8 10 ar 20 8 15 ar 21 9 24 1 22 9 25 1 23 10 17 ar 24 11 18 1 25 11 26 1 26 11 27 1 27 12 28 1 28 13 16 1 29 14 31 1 30 14 32 1 31 14 33 1 32 15 19 ar 33 15 34 1 34 17 20 ar 35 17 35 1 36 18 36 1 37 18 37 1 38 18 38 1 39 19 20 ar 40 19 39 1 41 20 40 1