JXS Converted by convert_cif2sdf.py 2024/03/01 05:07:52 39 42 0 0 0 0 0 0 0 0999 V2000 1.7879 -0.6249 0.5917 C 0 0 0 0 0 -3.1595 0.2055 1.1042 C 0 0 0 0 0 2.0761 -3.3540 0.1994 C 0 0 0 0 0 -4.5660 0.9422 -1.1319 C 0 0 0 0 0 -0.6681 -0.8782 0.9831 C 0 0 0 0 0 6.0184 2.8608 0.4493 C 0 0 0 0 0 -2.5669 0.0130 -0.1336 C 0 0 0 0 0 3.1819 -2.5330 0.1143 C 0 0 0 0 0 0.8314 -2.8162 0.4730 C 0 0 0 0 0 5.5305 -0.6622 -0.1517 C 0 0 0 0 0 4.2295 -0.2719 0.2204 C 0 0 0 0 0 6.3201 0.4334 -0.1052 C 0 0 0 0 0 3.0434 -1.1600 0.3105 C 0 0 0 0 0 0.6887 -1.4549 0.6741 C 0 0 0 0 0 -3.2834 0.3881 -1.2740 C 0 0 0 0 0 -4.4390 0.7559 1.1724 C 0 0 0 0 0 -3.0458 0.3568 -2.6252 N 0 0 0 0 0 4.2507 1.0190 0.4748 N 0 0 0 0 0 -5.0984 1.0977 0.0803 N 0 0 0 0 0 -4.0792 0.8423 -3.2231 N 0 0 0 0 0 -4.9900 1.1956 -2.3863 N 0 0 0 0 0 5.5572 1.4813 0.2752 N 0 0 0 0 0 -5.0377 0.9365 2.4141 N 0 0 0 0 0 -1.3250 -0.5255 -0.2360 O 0 0 0 0 0 1.6767 0.4377 0.7496 H 0 0 0 0 0 -2.6365 -0.0723 2.0068 H 0 0 0 0 0 2.1811 -4.4178 0.0427 H 0 0 0 0 0 -1.2649 -1.6184 1.5158 H 0 0 0 0 0 -0.5518 0.0105 1.6047 H 0 0 0 0 0 6.3520 3.0051 1.4776 H 0 0 0 0 0 6.8460 3.0564 -0.2321 H 0 0 0 0 0 5.1996 3.5472 0.2337 H 0 0 0 0 0 4.1529 -2.9530 -0.1033 H 0 0 0 0 0 -0.0320 -3.4630 0.5382 H 0 0 0 0 0 5.8427 -1.6597 -0.4220 H 0 0 0 0 0 7.3755 0.4648 -0.3316 H 0 0 0 0 0 -2.2407 0.0284 -3.0557 H 0 0 0 0 0 -5.9306 1.3109 2.4732 H 0 0 0 0 0 -4.5610 0.6887 3.2224 H 0 0 0 0 0 6 22 1 0 0 0 22 18 1 0 0 0 22 12 1 0 0 0 18 11 2 0 0 0 12 10 2 0 0 0 11 10 1 0 0 0 11 13 1 0 0 0 8 13 2 0 0 0 8 3 1 0 0 0 13 1 1 0 0 0 3 9 2 0 0 0 1 14 2 0 0 0 23 16 1 0 0 0 9 14 1 0 0 0 16 19 2 0 0 0 16 2 1 0 0 0 14 5 1 0 0 0 19 4 1 0 0 0 2 7 2 0 0 0 4 21 1 0 0 0 4 15 2 0 0 0 21 20 2 0 0 0 7 15 1 0 0 0 7 24 1 0 0 0 15 17 1 0 0 0 5 24 1 0 0 0 20 17 1 0 0 0 1 25 1 0 0 0 2 26 1 0 0 0 3 27 1 0 0 0 5 28 1 0 0 0 5 29 1 0 0 0 6 30 1 0 0 0 6 31 1 0 0 0 6 32 1 0 0 0 8 33 1 0 0 0 9 34 1 0 0 0 10 35 1 0 0 0 12 36 1 0 0 0 17 37 1 0 0 0 23 38 1 0 0 0 23 39 1 0 0 0 M END $$$$