BIR0W4 -OEChem-04022106512D 50 52 0 1 0 0 0 0 0999 V2000 4.5823 2.5231 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3222 1.2631 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1603 -1.3113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 0.9843 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8424 1.2631 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0503 0.2849 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 2.5231 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9945 3.3322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2733 1.5721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 4.2457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.2276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8913 1.5721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 -0.0157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2163 -0.5157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9483 -0.5157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2163 -1.5157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9483 -1.5157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 -2.0157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0014 -0.0241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2093 -1.0022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7445 0.6450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3682 -2.2894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6251 -2.9585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3193 -2.5984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8330 -3.9367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5272 -3.5766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7840 -4.2457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9467 2.0216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6111 3.3970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9677 3.9935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6534 4.8121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8349 4.4979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9352 3.8442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 3.1628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0648 2.6110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6794 -0.2057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4853 -0.2057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6794 -1.8257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4853 -1.8257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 -2.6357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5896 -1.0239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1230 -1.6162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1594 0.1843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2052 1.0599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3296 1.1058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0354 -2.7670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7800 -2.1836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3722 -4.3515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1169 -3.7682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9130 -4.8522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 12 1 0 0 0 0 2 9 2 0 0 0 0 3 20 1 0 0 0 0 3 22 1 0 0 0 0 4 9 1 0 0 0 0 4 12 1 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 12 2 0 0 0 0 6 19 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 28 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 8 29 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 14 16 1 0 0 0 0 14 36 1 0 0 0 0 15 17 2 0 0 0 0 15 37 1 0 0 0 0 16 18 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 23 25 1 0 0 0 0 23 46 1 0 0 0 0 24 26 2 0 0 0 0 24 47 1 0 0 0 0 25 27 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 50 1 0 0 0 0 M END $$$$