B9TNO4 -OEChem-04022105453D 43 46 0 1 0 0 0 0 0999 V2000 -1.0069 0.7067 -1.1290 S 0 0 1 0 0 0 0 0 0 0 0 0 7.8733 -1.1135 -0.2251 F 0 0 0 0 0 0 0 0 0 0 0 0 7.6889 0.1769 1.5325 F 0 0 0 0 0 0 0 0 0 0 0 0 6.5344 0.7118 -0.3435 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9729 -1.2077 1.0068 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0608 -1.9235 -0.4189 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2655 2.1887 -1.1018 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2220 0.3704 0.6397 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7256 1.2793 -1.2625 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2022 -0.4877 -0.0198 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6920 1.1965 0.9763 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9217 0.8034 -0.7873 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5666 -0.3049 -0.0111 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7314 0.4767 -0.7777 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6591 0.0275 0.4206 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1902 0.4778 -0.3115 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8700 -0.6192 0.4603 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2383 1.2386 -0.9692 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5659 -1.0526 0.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1592 0.0712 0.4574 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8946 -0.9966 -0.0209 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2806 -0.9032 0.0374 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0041 -0.3562 0.4899 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2355 -2.2110 -0.5828 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8734 0.2390 0.5645 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0422 1.2514 1.0165 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9634 -1.6231 -1.4809 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7302 1.5832 1.1981 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2622 0.6342 1.2438 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 -0.9875 0.5725 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 2.0825 -1.8649 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4879 2.0998 -1.5755 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3277 -1.9166 1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9488 -2.9067 -1.0364 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5276 -1.9470 -1.3744 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7124 -2.7612 0.2062 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3948 2.1823 1.4445 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9510 -1.3823 -1.0776 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0612 -2.5179 -2.1027 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5996 -0.8060 -2.1137 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4326 1.6977 2.2459 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8227 1.5150 1.1793 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4512 2.4513 0.5915 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 2 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 23 1 0 0 0 0 3 23 1 0 0 0 0 4 16 1 0 0 0 0 4 23 1 0 0 0 0 5 17 1 0 0 0 0 5 23 1 0 0 0 0 6 22 1 0 0 0 0 6 27 1 0 0 0 0 8 25 1 0 0 0 0 8 28 1 0 0 0 0 9 12 1 0 0 0 0 9 14 1 0 0 0 0 9 31 1 0 0 0 0 10 13 1 0 0 0 0 10 14 2 0 0 0 0 11 20 2 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 18 2 0 0 0 0 13 19 2 0 0 0 0 15 20 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 17 19 1 0 0 0 0 18 32 1 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 25 1 0 0 0 0 24 34 1 0 0 0 0 24 35 1 0 0 0 0 24 36 1 0 0 0 0 25 26 2 0 0 0 0 26 37 1 0 0 0 0 27 38 1 0 0 0 0 27 39 1 0 0 0 0 27 40 1 0 0 0 0 28 41 1 0 0 0 0 28 42 1 0 0 0 0 28 43 1 0 0 0 0 M END $$$$