BE0RB9 -OEChem-04022100182D 39 41 0 1 0 0 0 0 0999 V2000 4.9836 3.0717 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.8804 1.3116 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2623 1.3116 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5714 2.2627 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5714 2.2627 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0714 0.7238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1591 3.0717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 2.9672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0714 -0.2762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2053 -0.7762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2053 -1.7762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 3.7762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 2.0536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1537 2.9672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4067 3.6716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 1.9491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3393 -2.2762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0714 -2.2762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.7581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3393 -3.2762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0714 -3.2762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2053 -3.7762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1837 2.1657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8528 2.8151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9070 3.6381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6083 -0.5862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6684 -0.4662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6534 4.3426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9467 1.5520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4058 2.4008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5181 3.4688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0423 4.1732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3356 1.3827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8024 -1.9662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6083 -1.9662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 2.6933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8024 -3.5862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6083 -3.5862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2053 -4.3962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5 1 1 1 0 0 0 1 8 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 3 5 1 0 0 0 0 3 6 2 0 0 0 0 4 5 1 0 0 0 0 4 7 1 6 0 0 0 4 23 1 0 0 0 0 5 24 1 0 0 0 0 6 9 1 0 0 0 0 7 14 2 0 0 0 0 7 25 1 0 0 0 0 8 12 2 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 11 17 2 0 0 0 0 11 18 1 0 0 0 0 12 15 1 0 0 0 0 12 28 1 0 0 0 0 13 16 2 0 0 0 0 13 29 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 19 2 0 0 0 0 15 32 1 0 0 0 0 16 19 1 0 0 0 0 16 33 1 0 0 0 0 17 20 1 0 0 0 0 17 34 1 0 0 0 0 18 21 2 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 20 22 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 M END $$$$