BJE40I -OEChem-04022106212D 42 44 0 0 0 0 0 0 0999 V2000 6.3301 -0.3343 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.8343 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -3.2003 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -1.4683 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.8301 -1.2003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8301 0.5317 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.6657 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.1657 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.6657 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9561 1.1310 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.8343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.3343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.1657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.8343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.8343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.8343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.6657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.3343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.6657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.6657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.1657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.3343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.6657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9561 3.2003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.1657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 2.6865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 1.6449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.1657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -0.1443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.1443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -0.5243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.9543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 1.3557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.9757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.7857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 2.9757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9490 3.8203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3979 2.9986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3979 1.3328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3520 2.1657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.7857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 2.1657 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 8 1 0 0 0 0 1 11 1 0 0 0 0 2 22 1 0 0 0 0 3 22 1 0 0 0 0 4 22 1 0 0 0 0 7 25 2 0 0 0 0 8 13 1 0 0 0 0 8 29 1 0 0 0 0 9 12 1 0 0 0 0 9 25 1 0 0 0 0 9 34 1 0 0 0 0 10 17 1 0 0 0 0 10 27 2 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 16 1 0 0 0 0 13 17 1 0 0 0 0 13 20 2 0 0 0 0 14 18 2 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 15 22 1 0 0 0 0 16 31 1 0 0 0 0 17 19 2 0 0 0 0 18 32 1 0 0 0 0 19 21 1 0 0 0 0 19 24 1 0 0 0 0 20 23 1 0 0 0 0 20 33 1 0 0 0 0 21 23 2 0 0 0 0 21 35 1 0 0 0 0 23 36 1 0 0 0 0 24 26 2 0 0 0 0 24 37 1 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 38 1 0 0 0 0 27 39 1 0 0 0 0 28 40 1 0 0 0 0 28 41 1 0 0 0 0 28 42 1 0 0 0 0 M END $$$$