994 Converted by convert_cif2sdf.py 2026/01/30 11:05:38 54 57 0 0 0 0 0 0 0 0999 V2000 8.0426 0.8737 7.8057 C 0 0 0 0 0 6.6500 0.9387 7.7522 C 0 0 0 0 0 5.8810 0.0164 8.4612 C 0 0 0 0 0 6.5021 -0.9743 9.2242 C 0 0 0 0 0 7.8964 -1.0371 9.2765 C 0 0 0 0 0 8.6654 -0.1148 8.5675 C 0 0 0 0 0 5.7261 -1.9053 9.9401 N 0 0 0 0 0 4.4485 -2.4609 9.7094 C 0 0 0 0 0 3.8044 -2.0544 8.6044 N 0 0 0 0 0 2.6020 -2.6260 8.4584 C 0 0 0 0 0 2.0225 -3.5153 9.2737 N 0 0 0 0 0 2.7820 -3.8270 10.3355 C 0 0 0 0 0 4.0014 -3.3414 10.6196 N 0 0 0 0 0 10.0244 -0.1897 8.6289 O 0 0 0 0 0 10.6726 -1.0000 7.6507 C 0 0 0 0 0 8.7945 1.7756 7.1128 O 0 0 0 0 0 9.1490 2.9788 7.7912 C 0 0 0 0 0 6.0291 1.8994 7.0115 O 0 0 0 0 0 4.6027 1.8964 7.0112 C 0 0 0 0 0 1.8455 -2.2389 7.2854 C 0 0 0 0 0 1.9945 -2.9604 6.1074 C 0 0 0 0 0 1.2718 -2.5933 4.9775 C 0 0 0 0 0 0.4199 -1.5056 5.0779 C 0 0 0 0 0 0.2485 -0.7802 6.2048 N 0 0 0 0 0 0.9666 -1.1610 7.2914 C 0 0 0 0 0 0.8051 -0.4190 8.4762 N 0 0 0 0 0 0.4878 0.9339 8.7208 C 0 0 0 0 0 -0.2037 1.2899 9.8785 C 0 0 0 0 0 -0.5170 2.6272 10.1206 C 0 0 0 0 0 -0.1383 3.6093 9.2047 C 0 0 0 0 0 0.5532 3.2533 8.0470 C 0 0 0 0 0 0.8665 1.9160 7.8049 C 0 0 0 0 0 4.7958 0.0711 8.4160 H 0 0 0 0 0 8.3858 -1.8062 9.8697 H 0 0 0 0 0 6.1693 -2.2445 10.7875 H 0 0 0 0 0 2.3684 -4.5423 11.0363 H 0 0 0 0 0 11.0703 -1.8993 8.1277 H 0 0 0 0 0 11.4835 -0.4327 7.1858 H 0 0 0 0 0 9.9463 -1.2853 6.8871 H 0 0 0 0 0 9.6623 2.7337 8.7244 H 0 0 0 0 0 8.2466 3.5594 8.0002 H 0 0 0 0 0 9.8164 3.5625 7.1535 H 0 0 0 0 0 4.2372 2.0006 8.0358 H 0 0 0 0 0 4.2401 0.9608 6.5773 H 0 0 0 0 0 4.2461 2.7371 6.4121 H 0 0 0 0 0 2.6713 -3.8101 6.0502 H 0 0 0 0 0 1.3732 -3.1404 4.0468 H 0 0 0 0 0 -0.1669 -1.1793 4.2253 H 0 0 0 0 0 0.9430 -0.9627 9.3230 H 0 0 0 0 0 -0.5031 0.5336 10.5987 H 0 0 0 0 0 -1.0553 2.9035 11.0223 H 0 0 0 0 0 -0.3819 4.6508 9.3928 H 0 0 0 0 0 0.8491 4.0178 7.3337 H 0 0 0 0 0 1.4065 1.6491 6.9000 H 0 0 0 0 0 15 14 1 0 0 0 14 6 1 0 0 0 16 1 1 0 0 0 16 17 1 0 0 0 6 1 2 0 0 0 6 5 1 0 0 0 1 2 1 0 0 0 5 4 2 0 0 0 2 18 1 0 0 0 2 3 2 0 0 0 4 7 1 0 0 0 4 3 1 0 0 0 18 19 1 0 0 0 7 8 1 0 0 0 8 13 2 0 0 0 8 9 1 0 0 0 13 12 1 0 0 0 9 10 2 0 0 0 12 11 2 0 0 0 10 11 1 0 0 0 10 20 1 0 0 0 21 20 2 0 0 0 21 22 1 0 0 0 20 25 1 0 0 0 22 23 2 0 0 0 25 26 1 0 0 0 25 24 2 0 0 0 26 27 1 0 0 0 23 24 1 0 0 0 27 28 2 0 0 0 27 32 1 0 0 0 28 29 1 0 0 0 32 31 2 0 0 0 29 30 2 0 0 0 31 30 1 0 0 0 3 33 1 0 0 0 5 34 1 0 0 0 7 35 1 0 0 0 12 36 1 0 0 0 15 37 1 0 0 0 15 38 1 0 0 0 15 39 1 0 0 0 17 40 1 0 0 0 17 41 1 0 0 0 17 42 1 0 0 0 19 43 1 0 0 0 19 44 1 0 0 0 19 45 1 0 0 0 21 46 1 0 0 0 22 47 1 0 0 0 23 48 1 0 0 0 26 49 1 0 0 0 28 50 1 0 0 0 29 51 1 0 0 0 30 52 1 0 0 0 31 53 1 0 0 0 32 54 1 0 0 0 M END $$$$