BA3FX7 -OEChem-04012115162D 42 44 0 0 0 0 0 0 0999 V2000 2.0000 -1.5116 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.4884 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.8744 -0.8163 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9580 -0.8776 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 1.3544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 -0.3776 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9580 0.8544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.9884 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.4884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8744 0.7931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.5116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.4884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.9884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4580 -0.0116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.0116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.5116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1851 1.7436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.0116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4580 -0.0116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.0116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.4884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.5116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.0116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9580 -0.8776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4580 -1.7436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.6084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.6316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 -0.8216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.6084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7744 1.5510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3777 2.3330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5958 1.9363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.3216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.1084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.1316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 0.2984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5406 -0.6656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8504 -0.2670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9211 -2.0537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7680 -2.2806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9950 -1.4336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 5 2 0 0 0 0 2 6 2 0 0 0 0 2 8 1 0 0 0 0 2 18 1 0 0 0 0 3 11 1 0 0 0 0 3 14 1 0 0 0 0 4 19 1 0 0 0 0 4 25 1 0 0 0 0 7 19 2 0 0 0 0 8 12 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 9 13 1 0 0 0 0 10 14 2 0 0 0 0 10 17 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 27 1 0 0 0 0 14 19 1 0 0 0 0 15 16 2 0 0 0 0 15 28 1 0 0 0 0 16 29 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 20 22 1 0 0 0 0 20 34 1 0 0 0 0 21 23 2 0 0 0 0 21 35 1 0 0 0 0 22 24 2 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 25 26 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 M END $$$$