BC84HW -OEChem-04022105463D 22 23 0 0 0 0 0 0 0999 V2000 -0.2230 1.1378 -0.0017 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0386 1.7838 -1.2762 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0323 1.8284 1.2607 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6160 -2.2106 0.0061 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8645 -1.8632 0.0070 O 0 5 0 0 0 0 0 0 0 0 0 0 2.7352 -1.3242 0.0053 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4684 -1.4260 0.0038 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8014 2.0314 -0.0003 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8208 0.4338 -0.0018 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9155 -0.1939 0.0018 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4601 0.1547 1.2062 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4580 0.1500 -1.2098 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2832 -0.0709 0.0026 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7364 -0.4082 1.2064 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7343 -0.4128 -1.2097 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3734 -0.6919 -0.0016 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1155 1.0818 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9806 0.3607 2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9763 0.3541 -2.1619 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2335 -0.6273 2.1468 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2301 -0.6353 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3668 -1.1309 -0.0016 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 9 1 0 0 0 0 1 10 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 6 13 2 0 0 0 0 7 10 2 0 0 0 0 8 17 3 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 10 13 1 0 0 0 0 11 14 1 0 0 0 0 11 18 1 0 0 0 0 12 15 2 0 0 0 0 12 19 1 0 0 0 0 13 17 1 0 0 0 0 14 16 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 16 22 1 0 0 0 0 M CHG 2 5 -1 6 1 M END $$$$