@MOLECULE (5z)-5-ethylidene-6-(2-hydroxyethyl)-3-methyl-1,2,3,4,5,6,7,9-octahydro-8h-azecino[5,4-b]indol-8-one 50 52 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.4482 -1.6146 2.5087 O.2 1 UNL1111111111 -0.4350 2 O 3.7903 3.5848 -1.0433 O.3 1 UNL1111111111 -0.5511 3 N 0.4799 -1.1014 -1.4128 N.3 1 UNL1111111111 -0.4093 4 N -1.6880 0.9676 1.4635 N.ar 1 UNL1111111111 -0.3732 5 C 1.7619 0.7774 0.4594 C.3 1 UNL1111111111 -0.0901 6 C 1.3377 0.5073 1.9188 C.3 1 UNL1111111111 -0.3840 7 C 2.4644 -0.4115 -0.1487 C.2 1 UNL1111111111 -0.0497 8 C 1.9414 -0.8491 -1.4958 C.3 1 UNL1111111111 -0.1293 9 C -1.6773 -1.0307 0.3539 C.ar 1 UNL1111111111 0.0242 10 C 2.6701 2.0196 0.4220 C.3 1 UNL1111111111 -0.3325 11 C -1.2699 -2.3528 -0.1655 C.3 1 UNL1111111111 -0.2702 12 C 0.1941 -2.3504 -0.6693 C.3 1 UNL1111111111 -0.1122 13 C -1.0096 -0.2512 1.2882 C.ar 1 UNL1111111111 -0.0689 14 C 0.2633 -0.5541 1.9634 C.2 1 UNL1111111111 0.4914 15 C -2.8311 -0.2832 -0.0698 C.ar 1 UNL1111111111 -0.1125 16 C -2.8148 0.9536 0.6526 C.ar 1 UNL1111111111 0.1353 17 C 2.9809 2.4258 -1.0216 C.3 1 UNL1111111111 0.0079 18 C 3.5053 -1.0030 0.4508 C.2 1 UNL1111111111 -0.1514 19 C -0.1278 -1.1193 -2.7583 C.3 1 UNL1111111111 -0.2747 20 C -3.8611 -0.5268 -0.9849 C.ar 1 UNL1111111111 -0.0860 21 C -3.8110 1.9275 0.4787 C.ar 1 UNL1111111111 -0.2280 22 C 4.2420 -2.1801 -0.0858 C.3 1 UNL1111111111 -0.4425 23 C -4.8362 0.4371 -1.1578 C.ar 1 UNL1111111111 -0.2106 24 C -4.8108 1.6493 -0.4317 C.ar 1 UNL1111111111 -0.1008 25 H 0.8295 0.9917 -0.1358 H 1 UNL1111111111 0.1809 26 H 0.9745 1.4380 2.3916 H 1 UNL1111111111 0.1549 27 H 2.2098 0.1816 2.5226 H 1 UNL1111111111 0.1748 28 H 2.1144 -0.0236 -2.2268 H 1 UNL1111111111 0.1448 29 H 2.5003 -1.7264 -1.8866 H 1 UNL1111111111 0.1237 30 H 3.6169 1.8249 0.9618 H 1 UNL1111111111 0.1568 31 H 2.1872 2.8608 0.9513 H 1 UNL1111111111 0.1384 32 H -1.3660 -3.1194 0.6375 H 1 UNL1111111111 0.1666 33 H -1.9479 -2.6791 -0.9791 H 1 UNL1111111111 0.1461 34 H 0.8771 -2.3998 0.2117 H 1 UNL1111111111 0.1586 35 H 0.3825 -3.2648 -1.2683 H 1 UNL1111111111 0.1125 36 H -1.4513 1.6668 2.1245 H 1 UNL1111111111 0.3125 37 H 3.6150 1.6800 -1.5374 H 1 UNL1111111111 0.1428 38 H 2.0667 2.6093 -1.6127 H 1 UNL1111111111 0.1166 39 H 3.8803 -0.6367 1.4074 H 1 UNL1111111111 0.1480 40 H -1.2209 -1.2309 -2.6485 H 1 UNL1111111111 0.1516 41 H 0.2430 -1.9160 -3.4182 H 1 UNL1111111111 0.1152 42 H 0.0418 -0.1450 -3.2453 H 1 UNL1111111111 0.1434 43 H -3.8840 -1.4594 -1.5430 H 1 UNL1111111111 0.1484 44 H -3.7889 2.8555 1.0365 H 1 UNL1111111111 0.1544 45 H 4.7603 -1.9405 -1.0255 H 1 UNL1111111111 0.1542 46 H 3.5666 -3.0253 -0.2849 H 1 UNL1111111111 0.1545 47 H 5.0042 -2.5441 0.6165 H 1 UNL1111111111 0.1513 48 H -5.6464 0.2704 -1.8634 H 1 UNL1111111111 0.1496 49 H -5.6051 2.3749 -0.6028 H 1 UNL1111111111 0.1453 50 H 3.3382 4.3338 -0.6131 H 1 UNL1111111111 0.3073 @BOND 1 1 14 2 2 2 17 1 3 2 50 1 4 3 8 1 5 3 12 1 6 3 19 1 7 4 13 ar 8 4 16 ar 9 4 36 1 10 5 6 1 11 5 7 1 12 5 10 1 13 5 25 1 14 6 14 1 15 6 26 1 16 6 27 1 17 7 8 1 18 7 18 2 19 8 28 1 20 8 29 1 21 9 11 1 22 9 13 ar 23 9 15 ar 24 10 17 1 25 10 30 1 26 10 31 1 27 11 12 1 28 11 32 1 29 11 33 1 30 12 34 1 31 12 35 1 32 13 14 1 33 15 16 ar 34 15 20 ar 35 16 21 ar 36 17 37 1 37 17 38 1 38 18 22 1 39 18 39 1 40 19 40 1 41 19 41 1 42 19 42 1 43 20 23 ar 44 20 43 1 45 21 24 ar 46 21 44 1 47 22 45 1 48 22 46 1 49 22 47 1 50 23 24 ar 51 23 48 1 52 24 49 1