B4BJX5 -OEChem-04022100282D 39 41 0 0 0 0 0 0 0999 V2000 8.9282 -2.3512 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.3512 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.3512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.6488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.1488 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9757 0.7420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1667 2.1433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 1.4852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1448 2.3512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.6488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.3512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.8512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.8512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.8512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.8512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.3512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.8512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.3512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.8512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.8512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.3512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.8512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6657 0.2051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4773 0.3776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1019 2.7599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5467 2.1433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0597 1.0244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1464 1.8496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7112 2.6034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9533 2.9409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9841 1.2314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5856 0.5411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -0.5412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 -2.1612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.9712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.1612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -0.5412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.9712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 0.9588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 2 22 1 0 0 0 0 3 12 1 0 0 0 0 3 17 1 0 0 0 0 4 18 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 6 8 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 14 1 0 0 0 0 13 15 2 0 0 0 0 13 33 1 0 0 0 0 14 16 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 19 21 2 0 0 0 0 19 36 1 0 0 0 0 20 22 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 M END $$$$