B13FAL -OEChem-04022103483D 50 54 0 1 0 0 0 0 0999 V2000 -5.2352 -0.2854 2.4744 F 0 0 0 0 0 0 0 0 0 0 0 0 -6.3293 0.1095 -2.8700 F 0 0 0 0 0 0 0 0 0 0 0 0 -8.3682 -0.1697 -1.0698 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.3603 -1.1583 0.1898 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5309 2.5087 -0.4540 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1913 -0.2363 0.6736 N 0 0 2 0 0 0 0 0 0 0 0 0 -2.8677 2.4781 0.9037 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2866 -0.8251 -0.1529 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3425 -1.8245 -0.0299 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4428 1.5801 -0.1853 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1763 -0.1034 0.1960 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7956 1.2001 0.7068 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2740 1.2850 0.2998 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0161 -1.2942 0.6511 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0674 0.9029 0.2424 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8141 -1.5445 0.2861 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0190 0.0003 0.7251 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3573 0.2285 0.0851 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2141 -1.1457 0.1097 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6892 0.4362 -0.0841 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4558 -0.0457 0.2449 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6702 -0.9521 -0.3257 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4961 -0.1880 1.1634 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7374 0.0545 -1.1176 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8136 1.5138 -0.3576 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4297 0.1525 -0.4271 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2573 -2.3303 -0.3922 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0590 0.0127 -1.5617 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8177 -0.2301 0.7193 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0993 -0.1297 -0.6432 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1954 -0.0751 -0.9031 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7092 1.2483 1.8018 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2685 2.0756 0.3077 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3025 1.3957 -0.7913 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 -2.2379 0.2329 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0202 -1.4014 1.7434 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0958 1.6789 1.0124 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7572 1.3282 -0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4282 -1.9281 -0.6655 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6886 -2.2839 1.0818 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9986 -0.0865 1.8201 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8243 2.5947 0.5728 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3580 3.3068 0.5998 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9747 2.4793 -0.1314 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9419 0.1543 -1.8506 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5046 0.1029 -0.5619 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0532 -2.8803 0.5327 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3438 -2.3059 -0.5287 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8317 -2.8896 -1.2322 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6275 -0.3409 1.4342 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 2 28 1 0 0 0 0 3 30 1 0 0 0 0 4 14 1 0 0 0 0 4 17 1 0 0 0 0 5 25 2 0 0 0 0 6 11 1 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 7 13 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 20 1 0 0 0 0 8 22 1 0 0 0 0 9 19 2 0 0 0 0 10 20 1 0 0 0 0 10 25 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 17 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 18 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 19 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 21 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 21 23 1 0 0 0 0 21 24 2 0 0 0 0 22 26 2 0 0 0 0 22 27 1 0 0 0 0 23 29 2 0 0 0 0 24 28 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 30 2 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 M END $$$$