BRTD90 -OEChem-04012115342D 63 64 0 0 0 0 0 0 0999 V2000 9.1636 2.4904 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5172 1.9523 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4641 6.9518 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 3.4518 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 6.9518 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 3.4518 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2080 10.6904 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8744 3.6471 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 5.4518 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 6.9518 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8061 10.1904 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8744 5.2566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9282 4.9518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4580 4.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9282 3.9518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0622 5.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 4.9518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0622 3.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3301 5.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 3.9518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1851 2.6966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4742 1.5398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4641 4.9518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 5.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7849 0.5893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4248 1.8505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5237 1.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 4.9518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 6.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 6.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 3.9518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9401 10.6904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0740 10.1904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4118 5.5658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6234 5.8235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9189 4.0371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9189 4.8666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0622 6.0718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0622 2.8318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7287 5.9268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9316 5.9268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6592 3.6418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0656 4.4769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8626 4.4769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1956 0.3967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9775 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3742 0.7819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6174 1.2612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0141 2.0431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2322 2.4398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3311 1.8185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9344 1.0366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7163 0.6399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3291 5.1418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 7.5718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 2.8318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3386 11.1654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5415 11.1654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6755 9.7155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4726 9.7155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3430 10.5004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8061 9.5704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6711 10.3804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 21 2 0 0 0 0 3 29 2 0 0 0 0 4 31 1 0 0 0 0 4 56 1 0 0 0 0 5 30 2 0 0 0 0 6 31 2 0 0 0 0 7 33 1 0 0 0 0 7 63 1 0 0 0 0 8 14 1 0 0 0 0 8 15 1 0 0 0 0 8 21 1 0 0 0 0 9 28 1 0 0 0 0 9 30 1 0 0 0 0 9 54 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 10 55 1 0 0 0 0 11 32 1 0 0 0 0 11 61 1 0 0 0 0 11 62 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 18 1 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 18 20 2 0 0 0 0 18 39 1 0 0 0 0 19 23 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 22 25 1 0 0 0 0 22 26 1 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 28 2 0 0 0 0 24 29 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 31 1 0 0 0 0 32 33 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 33 59 1 0 0 0 0 33 60 1 0 0 0 0 M END $$$$