@MOLECULE 8-ethyl-3,10,10-trimethyl-4,5,6,8,10,12-hexahydropyrazolo[4',3':6,7]cyclohepta[1,2-b]pyrrolo[2,3-f]indol-9(2h)-one 50 54 0 0 0 SMALL GASTEIGER @ATOM 1 C 0.1637 1.0403 0.0656 C.ar 1 UNL1111111111 0.0744 2 C 0.0893 -0.3648 -0.1920 C.ar 1 UNL1111111111 -0.0414 3 C 1.2638 -1.1214 -0.3430 C.ar 1 UNL1111111111 -0.2067 4 C -1.8482 -2.0584 -0.4767 C.3 1 UNL1111111111 -0.2476 5 C -2.0275 0.4633 -0.0258 C.ar 1 UNL1111111111 0.0724 6 C -1.3017 -0.7074 -0.2420 C.ar 1 UNL1111111111 -0.0638 7 C -3.4524 0.6192 0.0001 C.ar 1 UNL1111111111 0.0287 8 C -4.4592 -0.3577 -0.0009 C.ar 1 UNL1111111111 -0.1180 9 C -4.3525 -1.8278 -0.0480 C.3 1 UNL1111111111 -0.2470 10 C -5.6960 0.3725 0.0236 C.ar 1 UNL1111111111 0.0711 11 O 5.9030 -0.1264 -0.1436 O.2 1 UNL1111111111 -0.4921 12 C 4.7166 0.0670 -0.1404 C.2 1 UNL1111111111 0.5591 13 N 3.7646 -0.9414 -0.3775 N.am 1 UNL1111111111 -0.4807 14 C 4.0846 -2.3646 -0.3884 C.3 1 UNL1111111111 -0.0313 15 C 3.8735 -3.0084 0.9864 C.3 1 UNL1111111111 -0.4740 16 C 3.9637 1.4067 0.0678 C.3 1 UNL1111111111 0.0150 17 C 4.3492 1.9796 1.4256 C.3 1 UNL1111111111 -0.4421 18 C 4.3123 2.3484 -1.0785 C.3 1 UNL1111111111 -0.4398 19 C 2.5173 0.9791 0.0196 C.ar 1 UNL1111111111 -0.0778 20 C 1.3865 1.7322 0.1745 C.ar 1 UNL1111111111 -0.1583 21 C 2.4534 -0.4374 -0.2343 C.ar 1 UNL1111111111 0.1545 22 N -1.1358 1.5357 0.1513 N.ar 1 UNL1111111111 -0.3799 23 C -3.0157 -2.3706 0.4743 C.3 1 UNL1111111111 -0.2561 24 C -7.0671 -0.1716 0.0293 C.3 1 UNL1111111111 -0.4218 25 N -5.4471 1.7063 0.0353 N.ar 1 UNL1111111111 -0.2525 26 N -4.1024 1.8543 0.0309 N.ar 1 UNL1111111111 -0.2189 27 H 1.2152 -2.1860 -0.5384 H 1 UNL1111111111 0.1682 28 H -2.1785 -2.1548 -1.5344 H 1 UNL1111111111 0.1568 29 H -1.0524 -2.8229 -0.3480 H 1 UNL1111111111 0.1483 30 H -5.1816 -2.2819 0.5405 H 1 UNL1111111111 0.1472 31 H -4.5162 -2.1756 -1.0936 H 1 UNL1111111111 0.1533 32 H 3.4580 -2.8691 -1.1594 H 1 UNL1111111111 0.1406 33 H 5.1509 -2.4760 -0.7065 H 1 UNL1111111111 0.1618 34 H 4.5343 -2.5609 1.7396 H 1 UNL1111111111 0.1585 35 H 2.8434 -2.8786 1.3399 H 1 UNL1111111111 0.1569 36 H 4.0874 -4.0816 0.9552 H 1 UNL1111111111 0.1504 37 H 5.4379 2.1139 1.5024 H 1 UNL1111111111 0.1660 38 H 3.8791 2.9551 1.5952 H 1 UNL1111111111 0.1549 39 H 4.0416 1.3193 2.2466 H 1 UNL1111111111 0.1556 40 H 3.9901 1.9431 -2.0471 H 1 UNL1111111111 0.1585 41 H 3.8277 3.3236 -0.9543 H 1 UNL1111111111 0.1542 42 H 5.3969 2.5159 -1.1373 H 1 UNL1111111111 0.1646 43 H 1.4193 2.7985 0.3669 H 1 UNL1111111111 0.1639 44 H -1.3780 2.4537 0.4313 H 1 UNL1111111111 0.3085 45 H -3.0957 -3.4650 0.6137 H 1 UNL1111111111 0.1349 46 H -2.8051 -1.9521 1.4782 H 1 UNL1111111111 0.1528 47 H -7.2200 -0.8683 0.8677 H 1 UNL1111111111 0.1600 48 H -7.8243 0.6247 0.1243 H 1 UNL1111111111 0.1715 49 H -7.2838 -0.7155 -0.9034 H 1 UNL1111111111 0.1617 50 H -3.7217 2.7728 -0.0278 H 1 UNL1111111111 0.3253 @BOND 1 1 2 ar 2 1 20 ar 3 1 22 ar 4 2 3 ar 5 2 6 ar 6 3 21 ar 7 3 27 1 8 4 6 1 9 4 23 1 10 4 28 1 11 4 29 1 12 5 6 ar 13 5 7 1 14 5 22 ar 15 7 8 ar 16 7 26 ar 17 8 9 1 18 8 10 ar 19 9 23 1 20 9 30 1 21 9 31 1 22 10 24 1 23 10 25 ar 24 11 12 2 25 12 13 am 26 12 16 1 27 13 14 1 28 13 21 1 29 14 15 1 30 14 32 1 31 14 33 1 32 15 34 1 33 15 35 1 34 15 36 1 35 16 17 1 36 16 18 1 37 16 19 1 38 17 37 1 39 17 38 1 40 17 39 1 41 18 40 1 42 18 41 1 43 18 42 1 44 19 20 ar 45 19 21 ar 46 20 43 1 47 22 44 1 48 23 45 1 49 23 46 1 50 24 47 1 51 24 48 1 52 24 49 1 53 25 26 ar 54 26 50 1