BO8AD4 -OEChem-04022106342D 46 48 0 0 0 0 0 0 0999 V2000 5.2623 -1.4571 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0714 3.1307 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.7469 -4.0262 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.9682 -2.6294 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.3501 -3.8049 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.3903 -4.1307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0714 3.1307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0714 3.1307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4733 1.6307 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.3393 3.1307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 -3.1126 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8804 -1.4571 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3393 2.1307 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0000 -2.9036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 -2.0946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4067 -3.8171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 -2.1991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 -3.9216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9836 -3.2172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5714 -2.4081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5714 -2.4081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0714 -0.8693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0714 0.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0714 2.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2053 1.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2053 0.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1591 -3.2172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9374 0.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9374 1.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0714 4.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5693 -2.4576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 -3.2503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7587 -1.4986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0305 -1.8228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8052 -3.9671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 -4.4356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1839 -2.0491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5391 -1.5806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2304 -4.5176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9585 -4.1934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6684 0.3207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4743 0.3207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4743 1.9407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6914 4.1307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0714 4.7507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4514 4.1307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 1 22 1 0 0 0 0 2 7 2 0 0 0 0 2 8 2 0 0 0 0 2 24 1 0 0 0 0 2 30 1 0 0 0 0 3 27 1 0 0 0 0 4 27 1 0 0 0 0 5 27 1 0 0 0 0 6 19 2 0 0 0 0 9 13 1 0 0 0 0 10 13 2 0 0 0 0 11 17 1 0 0 0 0 11 18 1 0 0 0 0 11 19 1 0 0 0 0 12 21 1 0 0 0 0 12 22 2 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 17 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 18 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 27 1 0 0 0 0 22 23 1 0 0 0 0 23 26 2 0 0 0 0 23 28 1 0 0 0 0 24 25 2 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 26 41 1 0 0 0 0 28 29 2 0 0 0 0 28 42 1 0 0 0 0 29 43 1 0 0 0 0 30 44 1 0 0 0 0 30 45 1 0 0 0 0 30 46 1 0 0 0 0 M CHG 2 9 -1 13 1 M END $$$$