DR0539 -OEChem-05042004322D 44 45 0 0 0 0 0 0 0999 V2000 2.9747 0.0000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.9748 9.3559 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.7427 4.1652 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4747 7.1652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5738 7.5991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3757 7.5991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3513 8.5741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6087 5.6652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4747 6.1652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6087 4.6652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9747 9.3559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5982 8.5740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8212 6.8790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3608 8.8964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1283 6.8789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5887 8.8964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8235 7.1783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5917 8.1938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1259 7.1783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3578 8.1938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7427 3.1652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8766 4.6653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3966 6.2479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9981 5.5576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0117 5.8552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8207 4.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2193 4.7729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1127 9.9603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4162 9.6249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9662 6.2761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2298 9.5024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9833 6.2761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7197 9.5024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3707 6.7549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 8.3789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5788 6.7548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9495 8.3788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1227 3.1653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7426 2.5452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3627 3.1652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1866 5.2022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3397 4.9753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5666 4.1283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9748 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 44 1 0 0 0 0 2 11 1 0 0 0 0 2 12 1 0 0 0 0 3 10 1 0 0 0 0 3 21 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 9 2 0 0 0 0 5 7 1 0 0 0 0 5 13 2 0 0 0 0 6 12 1 0 0 0 0 6 15 2 0 0 0 0 7 11 1 0 0 0 0 7 14 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 25 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 16 2 0 0 0 0 13 17 1 0 0 0 0 13 30 1 0 0 0 0 14 18 1 0 0 0 0 14 31 1 0 0 0 0 15 19 1 0 0 0 0 15 32 1 0 0 0 0 16 20 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 M END $$$$