D87IQS -OEChem-01102402182D 37 39 0 1 0 0 0 0 0999 V2000 2.0000 2.3450 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.6550 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.6550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.6550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2764 -2.4597 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.1550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.3450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.3450 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3301 -2.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2764 -0.8503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8600 -1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 0.2373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 0.9276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4690 -0.2609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4690 -3.0490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -2.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0201 1.3081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6401 2.3819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4800 -1.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 0.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 3.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 3.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 2 14 2 0 0 0 0 3 18 2 0 0 0 0 4 8 1 0 0 0 0 4 11 1 0 0 0 0 4 14 1 0 0 0 0 5 13 1 0 0 0 0 5 20 1 0 0 0 0 5 29 1 0 0 0 0 6 14 1 0 0 0 0 6 18 1 0 0 0 0 6 30 1 0 0 0 0 12 7 1 6 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 11 13 2 0 0 0 0 11 16 1 0 0 0 0 12 19 1 0 0 0 0 12 25 1 0 0 0 0 13 18 1 0 0 0 0 15 21 2 0 0 0 0 15 26 1 0 0 0 0 16 20 2 0 0 0 0 16 27 1 0 0 0 0 17 22 2 0 0 0 0 17 28 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 M END $$$$