CUE Converted by convert_cif2sdf.py 2024/03/29 11:09:15 28 31 0 0 0 0 0 0 0 0999 V2000 -0.2351 2.9996 0.0473 O 0 0 0 0 0 5.8478 -0.3791 0.1767 O 0 0 0 0 0 -5.5194 -1.4384 -0.1885 O 0 0 0 0 0 3.8244 -1.6267 0.0888 C 0 0 0 0 0 -4.2254 0.5567 -0.1171 C 0 0 0 0 0 2.4605 -1.6672 0.0472 C 0 0 0 0 0 -2.9980 1.1799 -0.0680 C 0 0 0 0 0 3.7805 0.7843 0.1234 C 0 0 0 0 0 -3.1536 -1.6005 -0.1207 C 0 0 0 0 0 1.6911 1.9146 0.0860 O 0 0 0 0 0 -0.6497 -1.4768 -0.0427 O 0 0 0 0 0 4.4915 -0.4052 0.1295 C 0 0 0 0 0 -4.3033 -0.8316 -0.1419 C 0 0 0 0 0 0.3489 1.9310 0.0459 C 0 0 0 0 0 2.3938 0.7608 0.0875 C 0 0 0 0 0 -1.9078 -0.9865 -0.0722 C 0 0 0 0 0 1.7283 -0.4767 0.0466 C 0 0 0 0 0 -1.8345 0.4155 -0.0463 C 0 0 0 0 0 0.2604 -0.4924 0.0017 C 0 0 0 0 0 -0.3983 0.7342 0.0035 C 0 0 0 0 0 6.2709 -0.3578 -0.6923 H 0 0 0 0 0 -5.8964 -1.6290 0.6810 H 0 0 0 0 0 4.3901 -2.5470 0.0933 H 0 0 0 0 0 -5.1295 1.1477 -0.1347 H 0 0 0 0 0 1.9471 -2.6171 0.0149 H 0 0 0 0 0 -2.9382 2.2582 -0.0476 H 0 0 0 0 0 4.3052 1.7277 0.1560 H 0 0 0 0 0 -3.2235 -2.6772 -0.1423 H 0 0 0 0 0 3 13 1 0 0 0 13 9 2 0 0 0 13 5 1 0 0 0 9 16 1 0 0 0 5 7 2 0 0 0 16 11 1 0 0 0 16 18 2 0 0 0 11 19 1 0 0 0 7 18 1 0 0 0 18 20 1 0 0 0 19 20 2 0 0 0 19 17 1 0 0 0 20 14 1 0 0 0 6 17 2 0 0 0 6 4 1 0 0 0 17 15 1 0 0 0 4 12 2 0 0 0 14 1 2 0 0 0 14 10 1 0 0 0 15 10 1 0 0 0 15 8 2 0 0 0 12 8 1 0 0 0 12 2 1 0 0 0 2 21 1 0 0 0 3 22 1 0 0 0 4 23 1 0 0 0 5 24 1 0 0 0 6 25 1 0 0 0 7 26 1 0 0 0 8 27 1 0 0 0 9 28 1 0 0 0 M END $$$$