@MOLECULE 4-[(1r,2s,6r,7s)-3,5-dioxo-4-azatricyclo[5.2.1.0~2,6~]dec-8-en-4-yl]-n-(8-quinolinyl)benzamide 50 55 0 0 0 SMALL GASTEIGER @ATOM 1 C 5.2794 -0.5413 0.1027 C.ar 1 UNL1111111111 0.0673 2 N 4.6641 -1.7608 -0.0608 N.ar 1 UNL1111111111 -0.3857 3 C 5.4087 -2.8462 -0.1534 C.ar 1 UNL1111111111 0.0602 4 C 6.8337 -2.8168 -0.0868 C.ar 1 UNL1111111111 -0.2311 5 C 7.4604 -1.6109 0.0827 C.ar 1 UNL1111111111 -0.0949 6 C 6.6862 -0.4198 0.1830 C.ar 1 UNL1111111111 -0.0385 7 C 7.2718 0.8593 0.3529 C.ar 1 UNL1111111111 -0.2053 8 C 6.4715 1.9712 0.4339 C.ar 1 UNL1111111111 -0.0904 9 C 5.0651 1.8738 0.3510 C.ar 1 UNL1111111111 -0.2289 10 C 4.4551 0.6461 0.1869 C.ar 1 UNL1111111111 0.2164 11 N 3.0679 0.4508 0.1057 N.am 1 UNL1111111111 -0.5433 12 C 2.1224 1.4614 -0.0677 C.2 1 UNL1111111111 0.5971 13 O 2.4329 2.6323 -0.0967 O.2 1 UNL1111111111 -0.5035 14 C 0.7107 1.0074 -0.1890 C.ar 1 UNL1111111111 -0.1591 15 C -0.2757 1.8765 0.2840 C.ar 1 UNL1111111111 -0.0548 16 C -1.6195 1.5371 0.1772 C.ar 1 UNL1111111111 -0.2115 17 C 0.3528 -0.2033 -0.7833 C.ar 1 UNL1111111111 -0.0820 18 C -0.9870 -0.5571 -0.8939 C.ar 1 UNL1111111111 -0.2041 19 C -1.9736 0.3169 -0.4151 C.ar 1 UNL1111111111 0.2346 20 N -3.3426 -0.0382 -0.5465 N.am 1 UNL1111111111 -0.5652 21 C -4.3801 0.8982 -0.8201 C.2 1 UNL1111111111 0.5779 22 O -4.1859 2.0669 -0.9961 O.2 1 UNL1111111111 -0.4292 23 C -5.6964 0.1501 -0.8709 C.3 1 UNL1111111111 -0.2144 24 C -6.6727 0.5439 0.2819 C.3 1 UNL1111111111 -0.0858 25 C -7.4479 -0.8095 0.4449 C.3 1 UNL1111111111 -0.2802 26 C -5.8571 0.5283 1.5713 C.2 1 UNL1111111111 -0.1701 27 C -5.5479 -0.7510 1.8509 C.2 1 UNL1111111111 -0.1659 28 C -6.1473 -1.6294 0.7571 C.3 1 UNL1111111111 -0.0861 29 C -5.3386 -1.3421 -0.5471 C.3 1 UNL1111111111 -0.2144 30 C -3.8365 -1.3588 -0.3503 C.2 1 UNL1111111111 0.5783 31 O -3.1340 -2.2953 -0.0951 O.2 1 UNL1111111111 -0.4359 32 H 4.8782 -3.7972 -0.2860 H 1 UNL1111111111 0.1718 33 H 7.3893 -3.7462 -0.1707 H 1 UNL1111111111 0.1665 34 H 8.5463 -1.5385 0.1419 H 1 UNL1111111111 0.1613 35 H 8.3541 0.9404 0.4164 H 1 UNL1111111111 0.1595 36 H 6.9126 2.9611 0.5653 H 1 UNL1111111111 0.1579 37 H 4.4741 2.7927 0.4183 H 1 UNL1111111111 0.2062 38 H 2.7664 -0.5293 0.1128 H 1 UNL1111111111 0.3426 39 H 0.0137 2.8328 0.7315 H 1 UNL1111111111 0.1762 40 H -2.3865 2.2225 0.5380 H 1 UNL1111111111 0.1809 41 H 1.1122 -0.8788 -1.1832 H 1 UNL1111111111 0.1638 42 H -1.2651 -1.5084 -1.3482 H 1 UNL1111111111 0.1800 43 H -6.1769 0.2767 -1.8595 H 1 UNL1111111111 0.1785 44 H -7.2666 1.4386 0.0916 H 1 UNL1111111111 0.1539 45 H -8.1621 -0.8005 1.2750 H 1 UNL1111111111 0.1510 46 H -7.9839 -1.1345 -0.4497 H 1 UNL1111111111 0.1425 47 H -5.6074 1.4268 2.0950 H 1 UNL1111111111 0.1618 48 H -4.9808 -1.1609 2.6601 H 1 UNL1111111111 0.1625 49 H -6.2709 -2.6866 0.9949 H 1 UNL1111111111 0.1536 50 H -5.6290 -2.0432 -1.3527 H 1 UNL1111111111 0.1778 @BOND 1 1 2 ar 2 1 6 ar 3 2 3 ar 4 3 4 ar 5 3 32 1 6 4 33 1 7 5 4 ar 8 5 34 1 9 6 5 ar 10 7 6 ar 11 7 35 1 12 8 7 ar 13 8 36 1 14 9 10 ar 15 9 8 ar 16 9 37 1 17 10 1 ar 18 11 10 1 19 11 38 1 20 12 11 am 21 13 12 2 22 14 12 1 23 15 14 ar 24 15 39 1 25 16 15 ar 26 16 40 1 27 17 14 ar 28 17 41 1 29 18 17 ar 30 18 42 1 31 19 18 ar 32 19 16 ar 33 20 19 1 34 20 30 am 35 21 23 1 36 21 20 am 37 22 21 2 38 23 29 1 39 23 43 1 40 24 23 1 41 24 26 1 42 24 25 1 43 24 44 1 44 25 28 1 45 25 45 1 46 25 46 1 47 26 27 2 48 26 47 1 49 27 28 1 50 27 48 1 51 28 49 1 52 29 28 1 53 29 30 1 54 29 50 1 55 30 31 2