JPR Converted by convert_cif2sdf.py 2024/03/29 11:09:15 49 50 0 0 0 0 0 0 0 0999 V2000 -8.5192 3.1195 0.5612 CL 0 0 0 0 0 -10.8711 1.2427 0.4791 C 0 0 0 0 0 -5.7867 -1.0771 -0.5002 N 0 0 0 0 0 -4.8076 0.2766 0.9645 O 0 0 0 0 0 0.4336 -0.6007 0.7864 S 0 0 0 0 0 -9.5205 0.6272 0.2190 C 0 0 0 0 0 -3.4725 -1.0715 -0.1908 N 0 0 0 0 0 3.8840 -0.1258 0.1714 O 0 0 0 0 0 -9.4184 -0.7261 -0.0425 C 0 0 0 0 0 7.1258 0.3837 -0.0975 N 0 0 0 0 0 -8.3849 1.4187 0.2383 C 0 0 0 0 0 -8.1822 -1.2941 -0.2810 C 0 0 0 0 0 -7.1453 0.8565 0.0001 C 0 0 0 0 0 -7.0397 -0.5042 -0.2587 C 0 0 0 0 0 -4.6932 -0.5919 0.1212 C 0 0 0 0 0 -2.2836 -0.5446 0.4845 C 0 0 0 0 0 -1.0374 -1.2528 -0.0501 C 0 0 0 0 0 1.7848 -1.5469 0.0308 C 0 0 0 0 0 3.0977 -1.1130 0.6308 C 0 0 0 0 0 3.6821 -1.6503 1.7175 C 0 0 0 0 0 4.8893 -0.9458 1.9242 C 0 0 0 0 0 4.9714 -0.0193 0.9527 C 0 0 0 0 0 6.0938 0.9694 0.7700 C 0 0 0 0 0 6.6152 0.1789 -1.4591 C 0 0 0 0 0 8.3374 1.2147 -0.1085 C 0 0 0 0 0 -11.0888 1.2044 1.5467 H 0 0 0 0 0 -10.8674 2.2810 0.1459 H 0 0 0 0 0 -11.6342 0.6888 -0.0669 H 0 0 0 0 0 -5.7047 -1.8220 -1.1154 H 0 0 0 0 0 -3.3805 -1.7644 -0.8628 H 0 0 0 0 0 -10.3060 -1.3410 -0.0611 H 0 0 0 0 0 -8.1025 -2.3516 -0.4851 H 0 0 0 0 0 -6.2595 1.4737 0.0138 H 0 0 0 0 0 -2.2031 0.5256 0.2959 H 0 0 0 0 0 -2.3690 -0.7201 1.5570 H 0 0 0 0 0 -0.9531 -1.0783 -1.1226 H 0 0 0 0 0 -1.1190 -2.3240 0.1385 H 0 0 0 0 0 1.6336 -2.6094 0.2179 H 0 0 0 0 0 1.7995 -1.3648 -1.0433 H 0 0 0 0 0 3.3005 -2.4641 2.3176 H 0 0 0 0 0 5.6079 -1.1167 2.7120 H 0 0 0 0 0 6.5285 1.2092 1.7398 H 0 0 0 0 0 5.7065 1.8779 0.3102 H 0 0 0 0 0 7.3756 -0.3185 -2.0611 H 0 0 0 0 0 5.7188 -0.4389 -1.4219 H 0 0 0 0 0 6.3737 1.1437 -1.9056 H 0 0 0 0 0 8.0922 2.2096 -0.4798 H 0 0 0 0 0 8.7341 1.2926 0.9039 H 0 0 0 0 0 9.0851 0.7593 -0.7579 H 0 0 0 0 0 18 5 1 0 0 0 18 19 1 0 0 0 5 17 1 0 0 0 19 20 2 0 0 0 19 8 1 0 0 0 20 21 1 0 0 0 1 11 1 0 0 0 8 22 1 0 0 0 21 22 2 0 0 0 22 23 1 0 0 0 13 11 2 0 0 0 13 14 1 0 0 0 11 6 1 0 0 0 17 16 1 0 0 0 7 16 1 0 0 0 7 15 1 0 0 0 3 14 1 0 0 0 3 15 1 0 0 0 23 10 1 0 0 0 14 12 2 0 0 0 15 4 2 0 0 0 6 2 1 0 0 0 6 9 2 0 0 0 12 9 1 0 0 0 10 24 1 0 0 0 10 25 1 0 0 0 2 26 1 0 0 0 2 27 1 0 0 0 2 28 1 0 0 0 3 29 1 0 0 0 7 30 1 0 0 0 9 31 1 0 0 0 12 32 1 0 0 0 13 33 1 0 0 0 16 34 1 0 0 0 16 35 1 0 0 0 17 36 1 0 0 0 17 37 1 0 0 0 18 38 1 0 0 0 18 39 1 0 0 0 20 40 1 0 0 0 21 41 1 0 0 0 23 42 1 0 0 0 23 43 1 0 0 0 24 44 1 0 0 0 24 45 1 0 0 0 24 46 1 0 0 0 25 47 1 0 0 0 25 48 1 0 0 0 25 49 1 0 0 0 M END $$$$