CBA Converted by convert_cif2sdf.py 2026/01/30 11:05:38 43 43 0 0 0 0 0 0 0 0999 V2000 -3.3684 1.7101 -0.4511 N 0 0 0 0 0 -2.4959 2.6779 -0.2489 C 0 0 0 0 0 -2.9155 4.1124 -0.4416 C 0 0 0 0 0 -1.1949 2.3883 0.1315 C 0 0 0 0 0 -0.2989 3.3889 0.3376 O 0 0 0 0 0 -0.8219 1.0602 0.3111 C 0 0 0 0 0 0.5793 0.7006 0.7310 C 0 0 0 0 0 -1.7704 0.0746 0.0887 C 0 0 0 0 0 -1.4146 -1.3786 0.2628 C 0 0 0 0 0 -3.0468 0.4409 -0.2956 C 0 0 0 0 0 -2.1080 -3.7188 0.1806 P 0 0 0 0 0 -1.6616 -3.9188 1.5775 O 0 0 0 0 0 -3.3549 -4.6897 -0.1276 O 0 0 0 0 0 -0.8985 -4.0617 -0.8237 O 0 0 0 0 0 -2.5578 -2.1859 -0.0242 O 0 0 0 0 0 1.4160 0.5178 -0.4614 N 0 0 0 0 0 2.7243 0.0470 0.0082 C 0 0 0 0 0 2.5758 -1.2330 0.6276 O 0 0 0 0 0 3.6828 -0.0689 -1.1777 C 0 0 0 0 0 3.8789 1.2200 -1.7601 O 0 0 0 0 0 3.2822 1.0260 1.0091 C 0 0 0 0 0 3.6571 0.6387 2.0894 O 0 0 0 0 0 3.3597 2.3298 0.6986 O 0 0 0 0 0 5.0060 -0.6140 -0.7051 C 0 0 0 0 0 6.0137 0.0372 -0.8510 O 0 0 0 0 0 5.0654 -1.8212 -0.1217 O 0 0 0 0 0 -3.3001 4.5079 0.4978 H 0 0 0 0 0 -2.0559 4.7024 -0.7598 H 0 0 0 0 0 -3.6942 4.1647 -1.2025 H 0 0 0 0 0 0.1421 3.5475 -0.5075 H 0 0 0 0 0 0.9913 1.5022 1.3436 H 0 0 0 0 0 0.5602 -0.2247 1.3068 H 0 0 0 0 0 -0.6047 -1.6386 -0.4176 H 0 0 0 0 0 -1.0954 -1.5538 1.2904 H 0 0 0 0 0 -3.7909 -0.3225 -0.4696 H 0 0 0 0 0 -3.0434 -5.5954 0.0067 H 0 0 0 0 0 -1.2304 -3.9194 -1.7205 H 0 0 0 0 0 1.0072 -0.2392 -0.9888 H 0 0 0 0 0 2.2185 -1.8288 -0.0446 H 0 0 0 0 0 3.2581 -0.7427 -1.9233 H 0 0 0 0 0 4.2555 1.7836 -1.0697 H 0 0 0 0 0 3.7173 2.9583 1.3413 H 0 0 0 0 0 5.9140 -2.1701 0.1810 H 0 0 0 0 0 1 2 2 0 0 0 1 10 1 0 0 0 2 3 1 0 0 0 2 4 1 0 0 0 3 27 1 0 0 0 3 28 1 0 0 0 3 29 1 0 0 0 4 5 1 0 0 0 4 6 2 0 0 0 5 30 1 0 0 0 6 7 1 0 0 0 6 8 1 0 0 0 7 16 1 0 0 0 7 31 1 0 0 0 7 32 1 0 0 0 8 9 1 0 0 0 8 10 2 0 0 0 9 15 1 0 0 0 9 33 1 0 0 0 9 34 1 0 0 0 10 35 1 0 0 0 11 12 2 0 0 0 11 13 1 0 0 0 11 14 1 0 0 0 11 15 1 0 0 0 13 36 1 0 0 0 14 37 1 0 0 0 16 17 1 0 0 0 16 38 1 0 0 0 17 18 1 0 0 0 17 19 1 0 0 0 17 21 1 0 0 0 18 39 1 0 0 0 19 20 1 0 0 0 19 24 1 0 0 0 19 40 1 0 0 0 20 41 1 0 0 0 21 22 2 0 0 0 21 23 1 0 0 0 23 42 1 0 0 0 24 25 2 0 0 0 24 26 1 0 0 0 26 43 1 0 0 0 M END $$$$