BRA9H0 -OEChem-04022103362D 43 47 0 1 0 0 0 0 0999 V2000 4.6038 2.4352 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4679 0.8902 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3740 0.3764 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3319 -0.6638 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7370 0.2439 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2679 1.9110 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.1340 2.4110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2679 0.9110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 1.9110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3740 2.4457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1340 0.4110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 0.9110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3432 -0.5608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4679 1.9318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6038 0.3869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7224 -1.3896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7684 -1.6028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7359 0.8835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1371 -2.3384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1670 -2.4457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.8835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8718 0.3802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 2.3802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0038 0.8769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.8769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2727 2.5310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5325 2.8860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7354 2.8860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6106 1.8034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2120 2.4936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7786 2.9155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9804 2.9247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2071 -0.0896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0042 -0.0865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1065 -1.3182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3858 -1.6599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7712 -2.8388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4218 -3.0109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2678 2.1956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8742 -0.2398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8617 3.0002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4681 0.5648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4619 2.1848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 2 0 0 0 0 2 3 1 0 0 0 0 2 14 1 0 0 0 0 2 15 1 0 0 0 0 3 8 2 0 0 0 0 4 5 1 0 0 0 0 4 13 1 0 0 0 0 4 17 1 0 0 0 0 5 12 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 26 1 0 0 0 0 7 9 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 11 1 0 0 0 0 9 12 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 14 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 13 16 1 0 0 0 0 15 18 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 19 2 0 0 0 0 16 35 1 0 0 0 0 17 20 2 0 0 0 0 17 36 1 0 0 0 0 18 21 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 21 23 1 0 0 0 0 21 39 1 0 0 0 0 22 24 2 0 0 0 0 22 40 1 0 0 0 0 23 25 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 M END $$$$