B4PTX6 -OEChem-04012114092D 38 40 0 1 0 0 0 0 0999 V2000 3.7320 -0.7500 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.7500 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8301 3.2888 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.2500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3301 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1391 2.3378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5211 2.3378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8301 3.2888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5422 0.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9407 0.8577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 1.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 2.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -0.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7288 2.1462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9315 2.1462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -2.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -2.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1946 3.7904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 3.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 3.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 2 18 1 0 0 0 0 3 7 1 0 0 0 0 3 10 1 0 0 0 0 4 8 1 0 0 0 0 4 13 1 0 0 0 0 4 14 1 0 0 0 0 5 14 2 0 0 0 0 5 19 1 0 0 0 0 6 21 1 0 0 0 0 6 23 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 10 15 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 16 1 0 0 0 0 12 17 2 0 0 0 0 12 29 1 0 0 0 0 13 19 2 0 0 0 0 13 30 1 0 0 0 0 14 31 1 0 0 0 0 15 20 1 0 0 0 0 15 21 2 0 0 0 0 16 18 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 19 34 1 0 0 0 0 20 22 2 0 0 0 0 20 35 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 M END $$$$