B8FWA5 -OEChem-04022118553D 37 39 0 0 0 0 0 0 0999 V2000 -4.3663 1.2711 0.1916 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.5617 0.4562 0.0229 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2345 2.1273 1.3618 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6511 3.3442 0.1755 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3988 -2.2438 -0.0417 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2811 -3.5775 -0.1029 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4327 -2.9936 -0.1054 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5281 -4.0308 -0.1421 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7188 -1.4191 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9618 0.2360 0.1224 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7123 -1.8974 -0.0434 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6495 -0.1932 0.6749 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9098 -1.8172 -0.5944 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7709 0.6344 0.7297 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0313 -0.9897 -0.5397 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2114 -0.5454 0.0138 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2311 2.2974 -1.2547 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0338 -0.1495 1.0686 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8722 0.3661 -0.9862 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5169 1.1579 1.1235 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3552 1.6735 -0.9312 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1775 2.0694 0.1236 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2647 4.2238 -0.8795 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2064 0.1287 1.2551 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9909 -2.7617 -1.1268 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6990 1.5778 1.2637 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9462 -1.3154 -1.0266 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0852 2.9779 -1.2684 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3019 2.8678 -1.1996 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2457 1.6634 -2.1432 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3066 -0.8473 1.8567 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2452 0.0740 -1.8257 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1572 1.4606 1.9476 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0553 2.3284 -1.7421 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6462 3.8825 -1.8479 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1813 4.3843 -0.8932 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7290 5.1946 -0.6773 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 10 1 0 0 0 0 1 17 1 0 0 0 0 4 22 1 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 11 1 0 0 0 0 6 8 2 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 10 14 2 0 0 0 0 10 15 1 0 0 0 0 11 16 1 0 0 0 0 12 14 1 0 0 0 0 12 24 1 0 0 0 0 13 15 2 0 0 0 0 13 25 1 0 0 0 0 14 26 1 0 0 0 0 15 27 1 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 17 28 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 18 20 1 0 0 0 0 18 31 1 0 0 0 0 19 21 2 0 0 0 0 19 32 1 0 0 0 0 20 22 2 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 M END $$$$