BFP4I8 -OEChem-04022100282D 49 51 0 1 0 0 0 0 0999 V2000 3.4782 0.5481 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 3.0427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 0.5427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 2.0427 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 -1.4573 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 1.9494 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7166 -2.9573 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -2.9573 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 1.5427 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3147 0.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 0.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 2.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -0.9573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 1.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 2.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 1.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 2.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 1.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 3.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 3.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 3.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5388 1.5080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5388 3.5773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4449 2.0218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4449 3.0635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 -2.4573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 0.3402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 2.1627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5268 -0.0399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9253 0.6503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2366 0.6253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8381 -0.0650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 2.6627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6608 -1.5399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0593 -0.8497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 0.9227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3759 3.3527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 4.1627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5316 0.8880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5316 4.1973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9806 1.7098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9806 3.3756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2478 -0.2262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 1.2711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7166 -3.5773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1797 -2.6473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -3.5773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9856 -2.6473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 27 1 0 0 0 0 2 12 2 0 0 0 0 3 14 2 0 0 0 0 9 4 1 1 0 0 0 4 14 1 0 0 0 0 4 34 1 0 0 0 0 5 13 1 0 0 0 0 5 26 2 0 0 0 0 6 16 2 0 0 0 0 6 28 1 0 0 0 0 7 26 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 26 1 0 0 0 0 8 48 1 0 0 0 0 8 49 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 13 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 16 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 15 18 2 0 0 0 0 15 20 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 22 2 0 0 0 0 18 37 1 0 0 0 0 19 21 1 0 0 0 0 19 23 2 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 22 24 1 0 0 0 0 22 40 1 0 0 0 0 23 25 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 27 28 2 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 M END $$$$