@MOLECULE (1r,3s)-3-[4-(2-heptanyloxy)-1h-indol-7-yl]cyclohexanol 55 57 0 0 0 SMALL GASTEIGER @ATOM 1 O -5.5044 1.9567 -0.8478 O.3 1 UNL1111111111 -0.5702 2 O 2.2274 -0.8754 0.6146 O.3 1 UNL1111111111 -0.3424 3 N -1.4658 1.4436 1.9631 N.ar 1 UNL1111111111 -0.3708 4 C -3.3471 0.0577 -0.0597 C.3 1 UNL1111111111 -0.0724 5 C -3.6322 0.5391 -1.4949 C.3 1 UNL1111111111 -0.3398 6 C -4.2067 -1.1807 0.2581 C.3 1 UNL1111111111 -0.2706 7 C -5.1203 0.8643 -1.6707 C.3 1 UNL1111111111 0.1677 8 C -5.6898 -0.8075 0.1553 C.3 1 UNL1111111111 -0.2536 9 C -6.0313 -0.2975 -1.2495 C.3 1 UNL1111111111 -0.2945 10 C -1.8887 -0.2408 0.1063 C.ar 1 UNL1111111111 -0.1565 11 C -1.1076 0.4558 1.0523 C.ar 1 UNL1111111111 0.1388 12 C -1.2375 -1.1909 -0.6577 C.ar 1 UNL1111111111 -0.0612 13 C 0.2907 0.2166 1.2103 C.ar 1 UNL1111111111 -0.1615 14 C 0.9017 -0.7557 0.3924 C.ar 1 UNL1111111111 0.3010 15 C 0.1412 -1.4581 -0.5283 C.ar 1 UNL1111111111 -0.3688 16 C 0.7624 1.0896 2.2422 C.ar 1 UNL1111111111 -0.1951 17 C 2.9668 -1.8600 -0.1256 C.3 1 UNL1111111111 0.1352 18 C -0.3232 1.8214 2.6858 C.ar 1 UNL1111111111 -0.0524 19 C 4.4121 -1.3626 0.0216 C.3 1 UNL1111111111 -0.3038 20 C 4.6242 -0.0784 -0.7871 C.3 1 UNL1111111111 -0.2687 21 C 6.0473 0.4575 -0.5925 C.3 1 UNL1111111111 -0.2719 22 C 2.7570 -3.2198 0.5311 C.3 1 UNL1111111111 -0.4972 23 C 6.2506 1.7531 -1.3897 C.3 1 UNL1111111111 -0.2496 24 C 7.6675 2.2945 -1.1998 C.3 1 UNL1111111111 -0.4420 25 H -3.6614 0.8732 0.6392 H 1 UNL1111111111 0.1348 26 H -3.3336 -0.2344 -2.2244 H 1 UNL1111111111 0.1521 27 H -3.0095 1.4231 -1.7234 H 1 UNL1111111111 0.1436 28 H -3.9660 -2.0073 -0.4339 H 1 UNL1111111111 0.1388 29 H -3.9702 -1.5552 1.2711 H 1 UNL1111111111 0.1395 30 H -5.3346 1.1713 -2.7210 H 1 UNL1111111111 0.1051 31 H -5.9335 -0.0209 0.8976 H 1 UNL1111111111 0.1490 32 H -6.3229 -1.6761 0.4084 H 1 UNL1111111111 0.1276 33 H -7.0842 0.0452 -1.2747 H 1 UNL1111111111 0.1482 34 H -5.9464 -1.1156 -1.9868 H 1 UNL1111111111 0.1369 35 H -1.7993 -1.7655 -1.3960 H 1 UNL1111111111 0.1470 36 H -4.8323 2.6610 -0.8698 H 1 UNL1111111111 0.3105 37 H 0.5823 -2.2154 -1.1642 H 1 UNL1111111111 0.1627 38 H -2.3821 1.8002 2.0966 H 1 UNL1111111111 0.3118 39 H 1.7743 1.1402 2.5844 H 1 UNL1111111111 0.1699 40 H 2.6429 -1.8543 -1.1879 H 1 UNL1111111111 0.1267 41 H -0.3806 2.5748 3.4466 H 1 UNL1111111111 0.1626 42 H 4.6317 -1.1753 1.0921 H 1 UNL1111111111 0.1582 43 H 5.1139 -2.1504 -0.3051 H 1 UNL1111111111 0.1439 44 H 3.8843 0.6854 -0.4707 H 1 UNL1111111111 0.1566 45 H 4.4299 -0.2620 -1.8595 H 1 UNL1111111111 0.1335 46 H 6.2394 0.6428 0.4809 H 1 UNL1111111111 0.1381 47 H 6.7877 -0.3002 -0.9070 H 1 UNL1111111111 0.1325 48 H 1.6993 -3.5124 0.5115 H 1 UNL1111111111 0.1632 49 H 3.0569 -3.1999 1.5867 H 1 UNL1111111111 0.1633 50 H 3.3327 -4.0037 0.0303 H 1 UNL1111111111 0.1509 51 H 6.0559 1.5721 -2.4633 H 1 UNL1111111111 0.1324 52 H 5.5101 2.5119 -1.0713 H 1 UNL1111111111 0.1375 53 H 8.4205 1.5747 -1.5395 H 1 UNL1111111111 0.1407 54 H 7.8739 2.5158 -0.1467 H 1 UNL1111111111 0.1426 55 H 7.8182 3.2201 -1.7661 H 1 UNL1111111111 0.1399 @BOND 1 1 7 1 2 1 36 1 3 2 14 1 4 2 17 1 5 3 11 ar 6 3 18 ar 7 3 38 1 8 4 5 1 9 4 6 1 10 4 10 1 11 4 25 1 12 5 7 1 13 5 26 1 14 5 27 1 15 6 8 1 16 6 28 1 17 6 29 1 18 7 9 1 19 7 30 1 20 8 9 1 21 8 31 1 22 8 32 1 23 9 33 1 24 9 34 1 25 10 11 ar 26 10 12 ar 27 11 13 ar 28 12 15 ar 29 12 35 1 30 13 14 ar 31 13 16 ar 32 14 15 ar 33 15 37 1 34 16 18 ar 35 16 39 1 36 17 19 1 37 17 22 1 38 17 40 1 39 18 41 1 40 19 20 1 41 19 42 1 42 19 43 1 43 20 21 1 44 20 44 1 45 20 45 1 46 21 23 1 47 21 46 1 48 21 47 1 49 22 48 1 50 22 49 1 51 22 50 1 52 23 24 1 53 23 51 1 54 23 52 1 55 24 53 1 56 24 54 1 57 24 55 1