9K1 Converted by convert_cif2sdf.py 2024/03/29 11:09:15 48 51 0 0 0 0 0 0 0 0999 V2000 -0.1618 -0.3597 -0.5734 C 0 0 0 0 0 1.0778 -1.2116 1.2526 C 0 0 0 0 0 -3.7708 -1.2711 0.0442 C 0 0 0 0 0 -3.9293 -2.7423 -0.3446 C 0 0 0 0 0 -4.9928 -0.4831 -0.4314 C 0 0 0 0 0 3.9146 -0.0233 0.8739 C 0 0 0 0 0 5.2693 0.0406 1.1297 C 0 0 0 0 0 6.1612 0.2630 0.0966 C 0 0 0 0 0 5.7042 0.4225 -1.1992 C 0 0 0 0 0 4.3521 0.3600 -1.4700 C 0 0 0 0 0 7.6391 0.3333 0.3841 C 0 0 0 0 0 -4.8952 0.9382 0.0573 C 0 0 0 0 0 -5.4268 1.2957 1.2822 C 0 0 0 0 0 -4.7586 3.4832 1.0092 C 0 0 0 0 0 -4.1990 3.1998 -0.2227 C 0 0 0 0 0 -4.2656 1.9042 -0.7128 C 0 0 0 0 0 1.0406 -0.5343 0.0620 N 0 0 0 0 0 -0.0612 -1.6973 1.7849 C 0 0 0 0 0 -1.2399 -1.5237 1.1794 N 0 0 0 0 0 -1.3319 -0.8845 0.0298 C 0 0 0 0 0 0.0497 0.3146 -1.6922 N 0 0 0 0 0 1.3455 0.5868 -1.8098 C 0 0 0 0 0 1.9974 0.0619 -0.7144 C 0 0 0 0 0 3.4461 0.1303 -0.4319 C 0 0 0 0 0 -2.5645 -0.7275 -0.5838 N 0 0 0 0 0 -4.1581 -2.8410 -1.7520 O 0 0 0 0 0 -5.3457 2.5380 1.7173 N 0 0 0 0 0 2.0184 -1.3555 1.7634 H 0 0 0 0 0 -3.6842 -1.1891 1.1272 H 0 0 0 0 0 -3.0206 -3.2865 -0.0863 H 0 0 0 0 0 -4.7756 -3.1716 0.1918 H 0 0 0 0 0 -5.0286 -0.4912 -1.5209 H 0 0 0 0 0 -5.8976 -0.9430 -0.0343 H 0 0 0 0 0 3.2188 -0.1976 1.6808 H 0 0 0 0 0 5.6333 -0.0822 2.1390 H 0 0 0 0 0 6.4060 0.5957 -2.0013 H 0 0 0 0 0 3.9970 0.4808 -2.4818 H 0 0 0 0 0 8.0733 -0.6639 0.3014 H 0 0 0 0 0 8.1184 0.9978 -0.3348 H 0 0 0 0 0 7.7963 0.7153 1.3925 H 0 0 0 0 0 -5.9151 0.5478 1.8905 H 0 0 0 0 0 -4.7110 4.4891 1.3984 H 0 0 0 0 0 -3.7168 3.9776 -0.7964 H 0 0 0 0 0 -3.8368 1.6534 -1.6723 H 0 0 0 0 0 -0.0217 -2.2302 2.7231 H 0 0 0 0 0 1.8086 1.1249 -2.6230 H 0 0 0 0 0 -2.6275 -0.2569 -1.4298 H 0 0 0 0 0 -4.2681 -3.7476 -2.0704 H 0 0 0 0 0 26 4 1 0 0 0 4 3 1 0 0 0 3 5 1 0 0 0 3 25 1 0 0 0 19 18 1 0 0 0 19 20 2 0 0 0 5 12 1 0 0 0 13 12 2 0 0 0 13 27 1 0 0 0 18 2 2 0 0 0 25 20 1 0 0 0 20 1 1 0 0 0 12 16 1 0 0 0 27 14 2 0 0 0 2 17 1 0 0 0 1 17 1 0 0 0 1 21 2 0 0 0 16 15 2 0 0 0 14 15 1 0 0 0 17 23 1 0 0 0 21 22 1 0 0 0 23 22 2 0 0 0 23 24 1 0 0 0 10 24 2 0 0 0 10 9 1 0 0 0 24 6 1 0 0 0 9 8 2 0 0 0 6 7 2 0 0 0 8 7 1 0 0 0 8 11 1 0 0 0 2 28 1 0 0 0 3 29 1 0 0 0 4 30 1 0 0 0 4 31 1 0 0 0 5 32 1 0 0 0 5 33 1 0 0 0 6 34 1 0 0 0 7 35 1 0 0 0 9 36 1 0 0 0 10 37 1 0 0 0 11 38 1 0 0 0 11 39 1 0 0 0 11 40 1 0 0 0 13 41 1 0 0 0 14 42 1 0 0 0 15 43 1 0 0 0 16 44 1 0 0 0 18 45 1 0 0 0 22 46 1 0 0 0 25 47 1 0 0 0 26 48 1 0 0 0 M END $$$$