@MOLECULE [(8s,8ar)-6-amino-8a-hydroxy-1,5-dimethyl-4,7-dioxo-1,1a,2,4,7,8,8a,8b-octahydroazireno[2',3':3,4]pyrrolo[1,2-a]indol-8-yl]methyl carbamate 42 45 0 0 0 SMALL GASTEIGER @ATOM 1 O 1.5399 0.8283 1.9056 O.3 1 UNL111111111 -0.5377 2 O 2.5139 -1.4727 -0.8162 O.3 1 UNL111111111 -0.4641 3 O -2.9142 2.3836 -0.2366 O.2 1 UNL111111111 -0.4375 4 O -1.6291 -2.8043 0.2497 O.2 1 UNL111111111 -0.4313 5 O 2.4355 -3.5861 0.0752 O.2 1 UNL111111111 -0.5247 6 N 2.4764 2.7545 0.1485 N.3 1 UNL111111111 -0.3174 7 N -0.2151 1.5989 0.4838 N.pl3 1 UNL111111111 -0.4256 8 N -4.1988 -2.2056 -0.0800 N.pl3 1 UNL111111111 -0.5531 9 N 4.4057 -2.4061 -0.0909 N.am 1 UNL111111111 -0.6744 10 C 2.0397 1.4263 -0.3447 C.3 1 UNL111111111 -0.1297 11 C 1.4060 2.7101 -0.8712 C.3 1 UNL111111111 -0.1212 12 C 1.0478 0.7553 0.6081 C.3 1 UNL111111111 0.4548 13 C 0.0169 2.8674 -0.2392 C.3 1 UNL111111111 -0.0589 14 C 0.5645 -0.7230 0.3835 C.3 1 UNL111111111 -0.1573 15 C -1.2717 0.7619 0.2144 C.2 1 UNL111111111 0.1692 16 C -0.9215 -0.5611 0.2708 C.2 1 UNL111111111 -0.3533 17 C 3.7970 3.2326 -0.2545 C.3 1 UNL111111111 -0.2900 18 C 1.0928 -1.4166 -0.8685 C.3 1 UNL111111111 -0.0046 19 C -2.6778 1.2100 -0.0682 C.2 1 UNL111111111 0.4679 20 C -1.8726 -1.6217 0.1867 C.2 1 UNL111111111 0.4666 21 C -3.6670 0.1524 -0.1412 C.2 1 UNL111111111 -0.3281 22 C -3.3247 -1.1664 -0.0228 C.2 1 UNL111111111 0.1811 23 C -5.0594 0.6339 -0.3457 C.3 1 UNL111111111 -0.3885 24 C 3.0507 -2.5925 -0.2300 C.2 1 UNL111111111 0.7323 25 H 2.6978 0.7785 -0.9149 H 1 UNL111111111 0.1828 26 H 1.5451 3.1026 -1.8712 H 1 UNL111111111 0.1614 27 H 0.0039 3.7075 0.4943 H 1 UNL111111111 0.1774 28 H -0.7728 3.0608 -0.9962 H 1 UNL111111111 0.1670 29 H 0.8444 -1.3262 1.2860 H 1 UNL111111111 0.2023 30 H 3.7673 4.3357 -0.3232 H 1 UNL111111111 0.1580 31 H 4.1954 2.8327 -1.1970 H 1 UNL111111111 0.1266 32 H 4.5038 2.9654 0.5581 H 1 UNL111111111 0.1676 33 H 0.8802 1.2055 2.5284 H 1 UNL111111111 0.3460 34 H 0.9098 -0.8491 -1.7979 H 1 UNL111111111 0.1426 35 H 0.6533 -2.4353 -0.9647 H 1 UNL111111111 0.1777 36 H -5.8011 -0.1646 -0.4231 H 1 UNL111111111 0.1285 37 H -5.1454 1.2433 -1.2615 H 1 UNL111111111 0.1604 38 H -5.3688 1.2938 0.4815 H 1 UNL111111111 0.1603 39 H -5.1769 -2.0678 -0.1979 H 1 UNL111111111 0.3044 40 H -3.8586 -3.1464 0.0097 H 1 UNL111111111 0.3254 41 H 4.8416 -1.5396 -0.3131 H 1 UNL111111111 0.3155 42 H 4.9614 -3.1251 0.3220 H 1 UNL111111111 0.3219 @BOND 1 1 12 1 2 1 33 1 3 2 18 1 4 2 24 1 5 3 19 2 6 4 20 2 7 5 24 2 8 6 10 1 9 6 11 1 10 6 17 1 11 7 12 1 12 7 13 1 13 7 15 1 14 8 22 1 15 8 39 1 16 8 40 1 17 9 24 am 18 9 41 1 19 9 42 1 20 10 11 1 21 10 12 1 22 10 25 1 23 11 13 1 24 11 26 1 25 12 14 1 26 13 27 1 27 13 28 1 28 14 16 1 29 14 18 1 30 14 29 1 31 15 16 2 32 15 19 1 33 16 20 1 34 17 30 1 35 17 31 1 36 17 32 1 37 18 34 1 38 18 35 1 39 19 21 1 40 20 22 1 41 21 22 2 42 21 23 1 43 23 36 1 44 23 37 1 45 23 38 1