LD1Q3P -OEChem-05022322292D 40 41 0 0 0 0 0 0 0999 V2000 6.3301 -2.6550 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.3450 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.3450 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 1.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3301 1.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.1550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.6550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.3450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 0.8199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 0.8199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -1.7376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -1.0473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 0.4276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 -0.2627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 -2.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 -2.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 -1.0473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -1.7376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -1.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 0.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 2.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 2.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4842 -2.1919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -1.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1042 -1.1181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 9 1 0 0 0 0 2 15 1 0 0 0 0 3 4 2 0 0 0 0 3 5 2 0 0 0 0 3 8 1 0 0 0 0 3 16 1 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 7 21 2 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 23 1 0 0 0 0 10 12 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 13 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 14 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 17 20 2 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 M END $$$$