@MOLECULE (11s)-n-[(3s)-1-azabicyclo[2.2.2]oct-3-yl]-6-oxo-6,11-dihydro-5h-dibenzo[b,e]azepine-11-carboxamide 50 54 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.1772 -1.9445 0.3768 O.2 1 UNL1111111111 -0.4880 2 O 0.9567 1.2434 2.7647 O.2 1 UNL1111111111 -0.5101 3 N -4.7978 -0.6217 -0.8475 N.3 1 UNL1111111111 -0.3881 4 N -1.2002 -0.5857 -0.8154 N.am 1 UNL1111111111 -0.6224 5 N 2.3507 -0.1338 1.7381 N.am 1 UNL1111111111 -0.5471 6 C -2.9523 -0.5035 0.9723 C.3 1 UNL1111111111 -0.1218 7 C -2.4170 -1.2156 -0.3017 C.3 1 UNL1111111111 0.0494 8 C -3.4379 0.9108 0.6102 C.3 1 UNL1111111111 -0.3192 9 C -4.1490 -1.3300 1.4788 C.3 1 UNL1111111111 -0.3183 10 C -3.5306 -1.1610 -1.3948 C.3 1 UNL1111111111 -0.1513 11 C -4.5846 0.7864 -0.4241 C.3 1 UNL1111111111 -0.1182 12 C -5.1925 -1.4285 0.3370 C.3 1 UNL1111111111 -0.1200 13 C 0.0407 -1.0085 -0.3737 C.2 1 UNL1111111111 0.5773 14 C 1.1976 -0.2567 -1.0548 C.3 1 UNL1111111111 -0.2180 15 C 2.5210 -0.8185 -0.6417 C.ar 1 UNL1111111111 -0.0717 16 C 1.1045 1.2172 -0.7983 C.ar 1 UNL1111111111 0.0375 17 C 3.0198 -0.7586 0.6678 C.ar 1 UNL1111111111 0.2306 18 C 1.2460 1.7524 0.4816 C.ar 1 UNL1111111111 -0.1389 19 C 3.2597 -1.5058 -1.6121 C.ar 1 UNL1111111111 -0.1073 20 C 0.8442 2.0695 -1.8773 C.ar 1 UNL1111111111 -0.1973 21 C 1.4766 0.9454 1.7037 C.2 1 UNL1111111111 0.5851 22 C 4.2354 -1.3979 0.9890 C.ar 1 UNL1111111111 -0.2309 23 C 1.1013 3.1309 0.6791 C.ar 1 UNL1111111111 -0.0691 24 C 4.4516 -2.1430 -1.2917 C.ar 1 UNL1111111111 -0.1904 25 C 0.7184 3.4403 -1.6798 C.ar 1 UNL1111111111 -0.1001 26 C 4.9356 -2.0938 0.0161 C.ar 1 UNL1111111111 -0.0923 27 C 0.8471 3.9741 -0.3979 C.ar 1 UNL1111111111 -0.1737 28 H -2.1526 -0.4576 1.7431 H 1 UNL1111111111 0.1592 29 H -2.1808 -2.2831 -0.0513 H 1 UNL1111111111 0.1666 30 H -2.6097 1.5175 0.2107 H 1 UNL1111111111 0.1370 31 H -3.7839 1.4393 1.5148 H 1 UNL1111111111 0.1471 32 H -4.5921 -0.8534 2.3691 H 1 UNL1111111111 0.1457 33 H -3.8208 -2.3309 1.8027 H 1 UNL1111111111 0.1454 34 H -3.2269 -0.5414 -2.2632 H 1 UNL1111111111 0.1432 35 H -3.7248 -2.1746 -1.7991 H 1 UNL1111111111 0.1461 36 H -5.5371 1.1683 -0.0039 H 1 UNL1111111111 0.1391 37 H -4.3773 1.3915 -1.3290 H 1 UNL1111111111 0.1321 38 H -5.3301 -2.4806 0.0115 H 1 UNL1111111111 0.1379 39 H -6.1864 -1.0714 0.6745 H 1 UNL1111111111 0.1390 40 H -1.3101 0.2934 -1.2982 H 1 UNL1111111111 0.3111 41 H 1.0662 -0.4510 -2.1632 H 1 UNL1111111111 0.1821 42 H 2.8837 -1.5657 -2.6338 H 1 UNL1111111111 0.1490 43 H 0.7443 1.6611 -2.8801 H 1 UNL1111111111 0.1564 44 H 2.4630 -0.5781 2.6554 H 1 UNL1111111111 0.3329 45 H 4.6197 -1.3525 2.0074 H 1 UNL1111111111 0.1627 46 H 1.1771 3.5328 1.6944 H 1 UNL1111111111 0.1759 47 H 5.0006 -2.6867 -2.0556 H 1 UNL1111111111 0.1511 48 H 0.5168 4.0978 -2.5273 H 1 UNL1111111111 0.1494 49 H 5.8649 -2.6011 0.2711 H 1 UNL1111111111 0.1491 50 H 0.7471 5.0463 -0.2400 H 1 UNL1111111111 0.1562 @BOND 1 1 13 2 2 2 21 2 3 3 10 1 4 3 11 1 5 3 12 1 6 4 7 1 7 4 13 am 8 4 40 1 9 5 17 1 10 5 21 am 11 5 44 1 12 6 7 1 13 6 8 1 14 6 9 1 15 6 28 1 16 7 10 1 17 7 29 1 18 8 11 1 19 8 30 1 20 8 31 1 21 9 12 1 22 9 32 1 23 9 33 1 24 10 34 1 25 10 35 1 26 11 36 1 27 11 37 1 28 12 38 1 29 12 39 1 30 13 14 1 31 14 15 1 32 14 16 1 33 14 41 1 34 15 17 ar 35 15 19 ar 36 16 18 ar 37 16 20 ar 38 17 22 ar 39 18 21 1 40 18 23 ar 41 19 24 ar 42 19 42 1 43 20 25 ar 44 20 43 1 45 22 26 ar 46 22 45 1 47 23 27 ar 48 23 46 1 49 24 26 ar 50 24 47 1 51 25 27 ar 52 25 48 1 53 26 49 1 54 27 50 1