B2UXL3 -OEChem-04022102242D 41 44 0 0 0 0 0 0 0999 V2000 5.4641 -0.7080 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2764 -3.5127 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.7080 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8600 -2.7080 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.7920 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.2920 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.2920 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.7920 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.7080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.2080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.2080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.2080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.7920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.2080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.7080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.2920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2764 -1.9032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.7920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.2080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.2920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.2080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.2920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.2920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.7920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.7920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.3980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -1.8980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.3280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.9120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4690 -1.3139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -3.5180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4690 -4.1020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -0.5180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 1.8290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.6020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 0.7551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7522 0.2551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 0.4820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3722 1.3290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 4.1020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 4.1020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 12 1 0 0 0 0 1 26 1 0 0 0 0 2 4 1 0 0 0 0 2 11 1 0 0 0 0 2 32 1 0 0 0 0 3 12 1 0 0 0 0 3 21 2 0 0 0 0 4 17 2 0 0 0 0 5 20 1 0 0 0 0 5 23 2 0 0 0 0 6 20 2 0 0 0 0 6 24 1 0 0 0 0 7 23 1 0 0 0 0 7 24 2 0 0 0 0 8 24 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 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 13 16 1 0 0 0 0 13 20 1 0 0 0 0 14 19 1 0 0 0 0 14 27 1 0 0 0 0 15 19 2 0 0 0 0 15 28 1 0 0 0 0 16 18 2 0 0 0 0 16 29 1 0 0 0 0 17 30 1 0 0 0 0 18 21 1 0 0 0 0 18 22 1 0 0 0 0 19 31 1 0 0 0 0 21 33 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 23 25 1 0 0 0 0 25 37 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 M END $$$$