BHO85F -OEChem-04042106083D 43 46 0 0 0 0 0 0 0999 V2000 -1.7451 -2.8700 0.0039 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7119 -1.8467 -0.0012 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8190 2.0747 -0.0026 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9986 0.5593 -0.0083 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9963 -0.4253 -0.0019 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9664 -1.7689 0.0025 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0687 5.6646 0.0492 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6408 -0.4565 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6265 0.6748 0.0015 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0410 0.2083 -0.3749 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4203 -1.0899 0.3506 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4717 -2.2416 -0.0146 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0486 -1.7778 0.0039 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2100 -0.3428 -0.0095 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6123 -1.5976 -0.0031 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3375 0.7521 -0.0105 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4365 -0.7144 -0.0042 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0428 3.2180 -0.0034 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8607 -0.8838 -0.0018 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7940 4.4899 0.0412 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7611 0.1534 -0.0046 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6592 -2.0431 0.0024 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2646 0.2633 -0.0037 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6416 1.1292 0.9991 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3487 1.4401 -0.7297 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7624 0.9974 -0.1343 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0984 0.0417 -1.4585 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4497 -1.3718 0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3884 -0.9169 1.4341 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7131 -2.6040 -1.0216 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6249 -3.0735 0.6823 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8049 2.2286 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6674 3.2165 -0.9054 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7104 3.1844 0.8667 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4284 4.4988 0.9353 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4584 4.5373 -0.8291 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6399 1.2289 -0.0084 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3499 -3.0790 0.0053 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6667 5.6466 0.8744 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5036 6.5040 0.1297 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0945 1.3428 -0.0075 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8145 -0.0311 -0.9011 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8137 -0.0249 0.8961 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 15 1 0 0 0 0 2 15 2 0 0 0 0 2 17 1 0 0 0 0 3 16 1 0 0 0 0 3 18 1 0 0 0 0 3 32 1 0 0 0 0 4 16 1 0 0 0 0 4 17 2 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 5 23 1 0 0 0 0 6 22 2 0 0 0 0 7 20 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 M END $$$$