JK3 Converted by convert_cif2sdf.py 2024/03/29 11:09:15 42 44 0 0 0 0 0 0 0 0999 V2000 1.0861 3.2136 -0.2026 CL 0 0 0 0 0 -6.2491 -1.5673 0.5577 C 0 0 0 0 0 -6.4609 -2.8998 0.1709 C 0 0 0 0 0 -5.3571 -3.2988 -0.5039 C 0 0 0 0 0 -4.4875 -2.2801 -0.5471 O 0 0 0 0 0 -5.0131 -1.2158 0.0941 C 0 0 0 0 0 -4.3718 0.0916 0.2597 C 0 0 0 0 0 -4.9502 0.9820 0.8557 O 0 0 0 0 0 -3.1430 0.3089 -0.2488 N 0 0 0 0 0 -2.5778 1.5893 -0.1919 C 0 0 0 0 0 -3.3941 2.7065 -0.1055 C 0 0 0 0 0 -2.8349 3.9699 -0.0495 C 0 0 0 0 0 -1.4612 4.1236 -0.0792 C 0 0 0 0 0 -0.6388 3.0149 -0.1655 C 0 0 0 0 0 -1.1914 1.7434 -0.2150 C 0 0 0 0 0 -0.3613 0.6187 -0.2956 N 0 0 0 0 0 0.4872 0.5048 0.8982 C 0 0 0 0 0 1.3198 -0.7771 0.8080 C 0 0 0 0 0 0.4555 0.6537 -1.5172 C 0 0 0 0 0 1.2875 -0.6274 -1.6074 C 0 0 0 0 0 2.1366 -0.7422 -0.4126 N 0 0 0 0 0 3.0070 -1.9215 -0.4974 C 0 0 0 0 0 4.0024 -1.8762 0.5864 C 0 0 0 0 0 4.7950 -1.8389 1.4508 C 0 0 0 0 0 -5.0868 -5.0107 -1.2594 BR 0 0 0 0 0 -6.9334 -0.9404 1.1098 H 0 0 0 0 0 -7.3385 -3.4951 0.3740 H 0 0 0 0 0 -2.6492 -0.4213 -0.6533 H 0 0 0 0 0 -4.4675 2.5904 -0.0818 H 0 0 0 0 0 -3.4725 4.8392 0.0175 H 0 0 0 0 0 -1.0285 5.1129 -0.0356 H 0 0 0 0 0 1.1510 1.3667 0.9575 H 0 0 0 0 0 -0.1407 0.4677 1.7887 H 0 0 0 0 0 1.9713 -0.8488 1.6791 H 0 0 0 0 0 0.6560 -1.6399 0.7778 H 0 0 0 0 0 -0.1958 0.7268 -2.3881 H 0 0 0 0 0 1.1195 1.5178 -1.4858 H 0 0 0 0 0 0.6236 -1.4894 -1.6656 H 0 0 0 0 0 1.9160 -0.5911 -2.4979 H 0 0 0 0 0 2.4059 -2.8257 -0.4000 H 0 0 0 0 0 3.5188 -1.9270 -1.4601 H 0 0 0 0 0 5.5050 -1.8059 2.2247 H 0 0 0 0 0 2 6 2 0 0 0 3 2 1 0 0 0 3 4 2 0 0 0 4 25 1 0 0 0 4 5 1 0 0 0 6 5 1 0 0 0 6 7 1 0 0 0 7 9 1 0 0 0 8 7 2 0 0 0 9 10 1 0 0 0 10 15 1 0 0 0 11 10 2 0 0 0 11 12 1 0 0 0 12 13 2 0 0 0 13 14 1 0 0 0 14 1 1 0 0 0 15 14 2 0 0 0 15 16 1 0 0 0 16 17 1 0 0 0 17 18 1 0 0 0 19 16 1 0 0 0 19 20 1 0 0 0 20 21 1 0 0 0 21 18 1 0 0 0 21 22 1 0 0 0 23 22 1 0 0 0 24 23 3 0 0 0 2 26 1 0 0 0 3 27 1 0 0 0 9 28 1 0 0 0 11 29 1 0 0 0 12 30 1 0 0 0 13 31 1 0 0 0 17 32 1 0 0 0 17 33 1 0 0 0 18 34 1 0 0 0 18 35 1 0 0 0 19 36 1 0 0 0 19 37 1 0 0 0 20 38 1 0 0 0 20 39 1 0 0 0 22 40 1 0 0 0 22 41 1 0 0 0 24 42 1 0 0 0 M END $$$$