FJV Converted by convert_cif2sdf.py 2024/03/29 11:09:15 54 59 0 0 0 0 0 0 0 0999 V2000 3.5887 -1.9099 1.3943 C 0 0 0 0 0 4.9397 -2.6299 1.3674 C 0 0 0 0 0 4.9920 -3.4910 0.2267 O 0 0 0 0 0 4.8187 -2.8092 -1.0176 C 0 0 0 0 0 3.4666 -2.0903 -1.0157 C 0 0 0 0 0 3.4051 -1.1751 0.1337 N 0 0 0 0 0 2.2130 -0.4635 0.1407 C 0 0 0 0 0 1.0731 -1.1134 0.2430 N 0 0 0 0 0 2.2453 0.9337 0.0441 C 0 0 0 0 0 3.5863 1.6097 -0.0553 C 0 0 0 0 0 3.4291 3.0374 -0.5762 C 0 0 0 0 0 2.3592 3.7451 0.2629 C 0 0 0 0 0 1.0022 3.1202 -0.0599 C 0 0 0 0 0 1.0752 1.6212 0.0473 C 0 0 0 0 0 -0.1429 0.9060 0.1560 C 0 0 0 0 0 -0.1037 -0.4774 0.2615 C 0 0 0 0 0 -1.7292 -1.1348 0.3847 S 0 0 0 0 0 -2.4733 0.4487 0.2926 C 0 0 0 0 0 -1.5104 1.4418 0.1830 C 0 0 0 0 0 -1.9286 2.7199 0.1010 N 0 0 0 0 0 -3.1763 3.0139 0.1235 N 0 0 0 0 0 -4.1067 2.1363 0.2244 N 0 0 0 0 0 -3.8255 0.8425 0.3215 C 0 0 0 0 0 -4.8389 -0.0979 0.4297 N 0 0 0 0 0 -6.1596 0.5458 0.4181 C 0 0 0 0 0 -7.2432 -0.5162 0.6180 C 0 0 0 0 0 -7.1428 -1.5237 -0.4468 N 0 0 0 0 0 -5.8212 -2.1676 -0.4351 C 0 0 0 0 0 -4.7375 -1.1055 -0.6361 C 0 0 0 0 0 2.7880 -2.6404 1.5093 H 0 0 0 0 0 3.5654 -1.2099 2.2300 H 0 0 0 0 0 5.7427 -1.8962 1.3063 H 0 0 0 0 0 5.0543 -3.2210 2.2761 H 0 0 0 0 0 5.6184 -2.0797 -1.1487 H 0 0 0 0 0 4.8461 -3.5306 -1.8352 H 0 0 0 0 0 3.3550 -1.5226 -1.9393 H 0 0 0 0 0 2.6647 -2.8240 -0.9397 H 0 0 0 0 0 4.0505 1.6363 0.9308 H 0 0 0 0 0 4.2242 1.0462 -0.7365 H 0 0 0 0 0 4.3773 3.5682 -0.4849 H 0 0 0 0 0 3.1228 3.0134 -1.6222 H 0 0 0 0 0 2.5795 3.6173 1.3229 H 0 0 0 0 0 2.3425 4.8074 0.0174 H 0 0 0 0 0 0.2560 3.4957 0.6414 H 0 0 0 0 0 0.7124 3.3920 -1.0748 H 0 0 0 0 0 -6.2141 1.2775 1.2226 H 0 0 0 0 0 -6.3125 1.0447 -0.5391 H 0 0 0 0 0 -7.1067 -0.9965 1.5870 H 0 0 0 0 0 -8.2259 -0.0446 0.5816 H 0 0 0 0 0 -7.8792 -2.2081 -0.3690 H 0 0 0 0 0 -5.6683 -2.6665 0.5220 H 0 0 0 0 0 -5.7666 -2.8993 -1.2406 H 0 0 0 0 0 -4.8741 -0.6252 -1.6051 H 0 0 0 0 0 -3.7549 -1.5772 -0.5987 H 0 0 0 0 0 27 26 1 0 0 0 27 28 1 0 0 0 26 25 1 0 0 0 28 29 1 0 0 0 25 24 1 0 0 0 29 24 1 0 0 0 24 23 1 0 0 0 23 22 2 0 0 0 23 18 1 0 0 0 22 21 1 0 0 0 18 17 1 0 0 0 18 19 2 0 0 0 17 16 1 0 0 0 21 20 2 0 0 0 19 20 1 0 0 0 19 15 1 0 0 0 16 15 2 0 0 0 16 8 1 0 0 0 15 14 1 0 0 0 8 7 2 0 0 0 14 13 1 0 0 0 14 9 2 0 0 0 4 5 1 0 0 0 4 3 1 0 0 0 5 6 1 0 0 0 7 9 1 0 0 0 7 6 1 0 0 0 13 12 1 0 0 0 9 10 1 0 0 0 6 1 1 0 0 0 3 2 1 0 0 0 12 11 1 0 0 0 10 11 1 0 0 0 2 1 1 0 0 0 1 30 1 0 0 0 1 31 1 0 0 0 2 32 1 0 0 0 2 33 1 0 0 0 4 34 1 0 0 0 4 35 1 0 0 0 5 36 1 0 0 0 5 37 1 0 0 0 10 38 1 0 0 0 10 39 1 0 0 0 11 40 1 0 0 0 11 41 1 0 0 0 12 42 1 0 0 0 12 43 1 0 0 0 13 44 1 0 0 0 13 45 1 0 0 0 25 46 1 0 0 0 25 47 1 0 0 0 26 48 1 0 0 0 26 49 1 0 0 0 27 50 1 0 0 0 28 51 1 0 0 0 28 52 1 0 0 0 29 53 1 0 0 0 29 54 1 0 0 0 M END $$$$