BP1JD4 -OEChem-04022100552D 54 57 0 1 0 0 0 0 0999 V2000 7.9128 -2.3100 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.1464 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.7788 3.1900 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.7788 3.1900 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.9128 -2.3100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9128 -2.3100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 4.6900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 4.6900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -1.3100 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.4782 -3.8045 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -4.0124 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -3.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -3.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -3.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 3.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -4.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -4.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -5.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 -2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 4.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 -2.4033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9909 -1.3926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3894 -0.7023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4453 -0.3351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6482 -0.3351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3759 0.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1818 0.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -0.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7177 -2.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3759 2.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1818 2.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5098 -3.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3158 -3.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9118 -1.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -3.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5098 -5.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3158 -5.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -5.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5402 -1.7968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 5.3100 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 9 1 0 0 0 0 1 16 1 0 0 0 0 2 11 1 0 0 0 0 2 35 1 0 0 0 0 3 29 1 0 0 0 0 4 29 1 0 0 0 0 7 34 1 0 0 0 0 7 54 1 0 0 0 0 8 34 2 0 0 0 0 9 12 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 12 14 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 15 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 17 2 0 0 0 0 14 18 1 0 0 0 0 15 19 2 0 0 0 0 15 20 1 0 0 0 0 16 24 2 0 0 0 0 16 25 1 0 0 0 0 17 22 1 0 0 0 0 17 40 1 0 0 0 0 18 23 2 0 0 0 0 18 41 1 0 0 0 0 19 27 1 0 0 0 0 19 42 1 0 0 0 0 20 28 2 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 21 29 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 24 30 1 0 0 0 0 24 46 1 0 0 0 0 25 31 2 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 26 33 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 29 34 1 0 0 0 0 30 32 2 0 0 0 0 30 50 1 0 0 0 0 31 32 1 0 0 0 0 31 51 1 0 0 0 0 32 52 1 0 0 0 0 33 35 2 0 0 0 0 35 53 1 0 0 0 0 M END $$$$