BK3MR2 -OEChem-04012118002D 39 41 0 1 0 0 0 0 0999 V2000 4.6660 3.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9340 -2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 2.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 1.2500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8000 2.2500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9061 0.7153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 2.7847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9340 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8048 0.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8048 2.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5124 0.2363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3107 0.2456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3107 3.2544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5124 3.2637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 0.9171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 2.5829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 2.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2631 -0.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 -0.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 -2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 -3.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9340 -3.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5540 -3.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2221 -4.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 -4.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8421 -3.2131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 2 0 0 0 0 2 17 1 0 0 0 0 2 20 1 0 0 0 0 3 19 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 4 30 1 0 0 0 0 5 10 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 6 22 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 7 23 1 0 0 0 0 8 12 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 13 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 14 1 0 0 0 0 12 13 2 0 0 0 0 12 28 1 0 0 0 0 13 29 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 15 31 1 0 0 0 0 16 18 2 0 0 0 0 16 32 1 0 0 0 0 17 19 2 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 M END $$$$