JD5 Converted by convert_cif2sdf.py 2024/03/29 11:09:15 44 46 0 0 0 0 0 0 0 0999 V2000 2.9059 2.1973 1.1917 O 0 0 0 0 0 3.8530 1.0601 1.1428 P 0 0 0 0 0 5.3461 1.6154 0.9113 O 0 0 0 0 0 3.7904 0.2509 2.5341 O 0 0 0 0 0 3.3978 -0.0518 -0.2278 C 0 0 0 0 0 4.5636 -1.4525 -0.2870 P 0 0 0 0 0 4.5062 -2.1953 0.9913 O 0 0 0 0 0 4.1609 -2.4346 -1.4975 O 0 0 0 0 0 6.0568 -0.8972 -0.5185 O 0 0 0 0 0 2.0381 -0.5562 -0.0163 N 0 0 0 0 0 0.9403 0.2763 -0.2448 C 0 0 0 0 0 -0.3531 -0.1935 -0.0469 C 0 0 0 0 0 1.1269 1.5880 -0.6669 C 0 0 0 0 0 0.0978 2.3827 -0.8860 N 0 0 0 0 0 -1.1440 1.9761 -0.7167 C 0 0 0 0 0 -1.4176 0.6786 -0.2889 C 0 0 0 0 0 -2.8179 0.2275 -0.1011 C 0 0 0 0 0 -3.8732 1.1038 -0.3503 C 0 0 0 0 0 -5.1742 0.6810 -0.1746 C 0 0 0 0 0 -3.0814 -1.0743 0.3212 C 0 0 0 0 0 -4.3844 -1.4907 0.4949 C 0 0 0 0 0 -5.4338 -0.6142 0.2508 C 0 0 0 0 0 -6.7167 -1.0273 0.4234 O 0 0 0 0 0 -7.7399 -0.0389 0.2916 C 0 0 0 0 0 -8.9630 -0.3981 -0.5539 C 0 0 0 0 0 -9.0833 -0.3170 0.9693 C 0 0 0 0 0 6.0208 0.9232 0.8689 H 0 0 0 0 0 4.0219 0.7823 3.3082 H 0 0 0 0 0 3.4391 0.4961 -1.1685 H 0 0 0 0 0 4.1768 -2.0133 -2.3675 H 0 0 0 0 0 6.7315 -1.5893 -0.5608 H 0 0 0 0 0 1.9013 -1.4689 0.2821 H 0 0 0 0 0 -0.5306 -1.2056 0.2847 H 0 0 0 0 0 2.1293 1.9611 -0.8183 H 0 0 0 0 0 -1.9587 2.6590 -0.9061 H 0 0 0 0 0 -3.6717 2.1117 -0.6812 H 0 0 0 0 0 -5.9928 1.3594 -0.3677 H 0 0 0 0 0 -2.2668 -1.7563 0.5117 H 0 0 0 0 0 -4.5898 -2.4999 0.8214 H 0 0 0 0 0 -7.3946 0.9943 0.2639 H 0 0 0 0 0 -9.4236 0.3999 -1.1381 H 0 0 0 0 0 -8.9878 -1.3873 -1.0098 H 0 0 0 0 0 -9.1864 -1.2544 1.5155 H 0 0 0 0 0 -9.6212 0.5338 1.3873 H 0 0 0 0 0 1 2 2 0 0 0 4 2 1 0 0 0 2 3 1 0 0 0 2 5 1 0 0 0 14 13 2 0 0 0 14 15 1 0 0 0 13 11 1 0 0 0 15 16 2 0 0 0 5 10 1 0 0 0 5 6 1 0 0 0 7 6 2 0 0 0 11 10 1 0 0 0 11 12 2 0 0 0 16 12 1 0 0 0 16 17 1 0 0 0 6 8 1 0 0 0 6 9 1 0 0 0 17 18 2 0 0 0 17 20 1 0 0 0 18 19 1 0 0 0 20 21 2 0 0 0 19 22 2 0 0 0 21 22 1 0 0 0 22 23 1 0 0 0 23 24 1 0 0 0 25 24 1 0 0 0 25 26 1 0 0 0 24 26 1 0 0 0 3 27 1 0 0 0 4 28 1 0 0 0 5 29 1 0 0 0 8 30 1 0 0 0 9 31 1 0 0 0 10 32 1 0 0 0 12 33 1 0 0 0 13 34 1 0 0 0 15 35 1 0 0 0 18 36 1 0 0 0 19 37 1 0 0 0 20 38 1 0 0 0 21 39 1 0 0 0 24 40 1 0 0 0 25 41 1 0 0 0 25 42 1 0 0 0 26 43 1 0 0 0 26 44 1 0 0 0 M END $$$$