BNJ4B7 -OEChem-04022117343D 50 53 0 1 0 0 0 0 0999 V2000 -3.1869 0.2617 1.8188 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8726 2.9018 1.0119 F 0 0 0 0 0 0 0 0 0 0 0 0 2.9678 4.4945 0.3003 F 0 0 0 0 0 0 0 0 0 0 0 0 -5.5334 0.0581 -3.5910 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.3973 1.4767 1.9009 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2671 0.0476 2.7641 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7303 -3.2789 -1.0369 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1947 -1.8505 0.6444 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1205 -0.0282 0.3114 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1360 -1.1034 1.8262 N 0 0 2 0 0 0 0 0 0 0 0 0 -1.0458 -1.1403 0.8218 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1517 0.0878 1.0077 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2359 -2.4264 0.9958 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6330 -1.2166 -0.1526 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8778 -2.4994 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8667 -0.9456 -0.7049 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0060 1.0032 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1153 0.4475 -0.5624 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7740 -1.9305 -1.3314 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7367 -2.4433 2.0385 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9322 2.3705 0.3898 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1878 1.2881 -0.9231 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8906 0.2007 0.1946 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0083 3.1837 0.0236 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1200 2.6526 -0.6244 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9541 -2.3256 -0.4568 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5437 1.1641 -0.7527 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7918 -0.8108 -0.1369 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0982 1.1159 -2.0315 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3464 -0.8590 -1.4158 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9996 0.1042 -2.3633 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4751 -1.1447 -0.1881 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0846 0.2747 2.0618 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6226 0.9693 0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2026 -2.4635 2.0025 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8269 -3.3381 0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5570 -3.3206 0.2075 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4453 -2.7300 -1.0307 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2297 -2.8468 -1.5871 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1769 -1.5164 -2.2635 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9656 -2.9433 1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0857 -3.0635 2.6621 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6724 -2.3638 2.6003 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0641 0.8892 -1.4264 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9452 3.3037 -0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8434 1.9615 -0.5228 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0836 -1.5635 0.5893 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8283 1.8653 -2.7697 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0502 -1.6449 -1.6737 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4893 -3.5279 -0.4676 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 10 1 0 0 0 0 1 23 1 0 0 0 0 2 21 1 0 0 0 0 3 24 1 0 0 0 0 4 31 1 0 0 0 0 7 26 1 0 0 0 0 7 50 1 0 0 0 0 8 26 2 0 0 0 0 9 12 1 0 0 0 0 9 14 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 15 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 22 1 0 0 0 0 19 26 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 24 2 0 0 0 0 22 25 2 0 0 0 0 22 44 1 0 0 0 0 23 27 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 25 45 1 0 0 0 0 27 29 1 0 0 0 0 27 46 1 0 0 0 0 28 30 2 0 0 0 0 28 47 1 0 0 0 0 29 31 2 0 0 0 0 29 48 1 0 0 0 0 30 31 1 0 0 0 0 30 49 1 0 0 0 0 M END $$$$