BRB43O -OEChem-04012118372D 57 60 0 0 0 0 0 0 0999 V2000 10.5309 -3.9752 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.8792 3.1452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5436 4.6338 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.5111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3969 -3.4752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6648 -4.4752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9473 0.2937 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9473 -1.3158 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5309 -0.5111 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.0111 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.0309 -4.8412 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2579 1.2442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.0111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5309 -0.5111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.0111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5901 1.9885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.4889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.5111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9007 2.9390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.0111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.0111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6116 1.7823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0309 -1.3771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2329 3.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9437 2.5266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0309 -1.3771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5309 -2.2431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2544 3.4771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0309 -3.1091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.5111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5309 -2.2431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0309 -3.1091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1899 4.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8757 5.3781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8048 0.9522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6405 1.7321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.1089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.1311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8409 0.0259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.2989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4190 1.1930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3370 2.3987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3409 -0.8402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9109 -2.2431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8403 3.9386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1509 -2.2431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7209 -3.6461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7792 3.9031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3825 4.6851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6006 4.2884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.3211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -0.3911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3372 5.7922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4616 5.8396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4142 4.9641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6509 -4.8412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7209 -5.3781 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 11 1 0 0 0 0 1 29 1 0 0 0 0 2 19 1 0 0 0 0 2 33 1 0 0 0 0 3 24 1 0 0 0 0 3 34 1 0 0 0 0 4 30 2 0 0 0 0 7 12 1 0 0 0 0 7 13 1 0 0 0 0 7 14 1 0 0 0 0 8 14 2 0 0 0 0 8 15 1 0 0 0 0 9 14 1 0 0 0 0 9 23 1 0 0 0 0 9 39 1 0 0 0 0 10 30 1 0 0 0 0 10 51 1 0 0 0 0 10 52 1 0 0 0 0 11 56 1 0 0 0 0 11 57 1 0 0 0 0 12 16 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 15 2 0 0 0 0 13 17 1 0 0 0 0 15 18 1 0 0 0 0 16 19 2 0 0 0 0 16 22 1 0 0 0 0 17 21 2 0 0 0 0 17 37 1 0 0 0 0 18 20 2 0 0 0 0 18 38 1 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 30 1 0 0 0 0 21 40 1 0 0 0 0 22 25 2 0 0 0 0 22 41 1 0 0 0 0 23 26 2 0 0 0 0 23 27 1 0 0 0 0 24 28 2 0 0 0 0 25 28 1 0 0 0 0 25 42 1 0 0 0 0 26 31 1 0 0 0 0 26 43 1 0 0 0 0 27 32 2 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 29 31 2 0 0 0 0 29 32 1 0 0 0 0 31 46 1 0 0 0 0 32 47 1 0 0 0 0 33 48 1 0 0 0 0 33 49 1 0 0 0 0 33 50 1 0 0 0 0 34 53 1 0 0 0 0 34 54 1 0 0 0 0 34 55 1 0 0 0 0 M END $$$$