BURI07 -OEChem-04022101262D 42 44 0 0 0 0 0 0 0999 V2000 5.4641 -0.2500 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.7500 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -0.6160 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 1.1160 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 0.6160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 -1.1160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6065 0.0547 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6065 -1.5547 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.1901 -0.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 -1.1160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 0.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.2500 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 8.0622 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1901 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6951 -0.8060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 -1.6530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7690 -1.4260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7690 0.3060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5420 1.1530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6951 0.9260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3913 -1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -2.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5001 -1.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5001 -0.2131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 7 1 0 0 0 0 1 17 1 0 0 0 0 2 14 1 0 0 0 0 3 14 1 0 0 0 0 4 14 1 0 0 0 0 7 13 1 0 0 0 0 7 28 1 0 0 0 0 8 11 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 21 1 0 0 0 0 9 22 2 0 0 0 0 10 25 2 0 0 0 0 10 27 1 0 0 0 0 11 27 2 0 0 0 0 12 27 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 21 2 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 23 2 0 0 0 0 20 24 1 0 0 0 0 21 36 1 0 0 0 0 22 37 1 0 0 0 0 23 25 1 0 0 0 0 23 38 1 0 0 0 0 24 26 2 0 0 0 0 24 39 1 0 0 0 0 26 40 1 0 0 0 0 M END $$$$