BA8KI4 -OEChem-04012117192D 41 43 0 1 0 0 0 0 0999 V2000 7.8301 5.1830 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 2.8170 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -4.1830 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.4641 2.8170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.8170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 -1.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -3.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -4.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 4.3170 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.3301 4.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 3.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 0.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 0.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 -0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -2.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -1.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -2.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -3.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -5.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8917 4.7554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4378 3.7064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9127 4.5290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2520 4.3996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8535 3.7093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0611 1.6270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8671 1.6270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0611 0.0070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8671 0.0070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1350 -2.9930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -0.5630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -3.8030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3291 -1.3730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 -5.1830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -5.8030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -5.1830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 11 1 0 0 0 0 2 4 2 0 0 0 0 2 5 2 0 0 0 0 2 12 1 0 0 0 0 2 13 1 0 0 0 0 3 7 1 0 0 0 0 3 8 2 0 0 0 0 3 9 2 0 0 0 0 3 25 1 0 0 0 0 6 18 1 0 0 0 0 6 19 1 0 0 0 0 7 22 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 26 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 14 16 1 0 0 0 0 14 31 1 0 0 0 0 15 17 2 0 0 0 0 15 32 1 0 0 0 0 16 18 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 23 1 0 0 0 0 20 35 1 0 0 0 0 21 24 2 0 0 0 0 21 36 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 M END $$$$