BJ3M4S -OEChem-04022101492D 47 48 0 1 0 0 0 0 0999 V2000 5.9641 0.4371 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.1969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.3031 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6722 2.7428 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.3031 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.8031 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6587 6.1084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.1969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -6.1969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.3031 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9641 2.1691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.8031 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1377 3.1539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.8031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.3031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3717 3.7967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0774 3.4960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5454 4.7815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2511 4.4808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4850 5.1236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.6969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.6969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.1969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.1969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.6969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.6969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.6969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.6969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.1969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4100 2.4474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5386 1.7182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.4931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5841 0.4371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7891 3.5847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5524 3.0974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0704 5.1801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8337 4.6928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.6131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 2.6131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.0069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.8869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1838 6.5069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.3869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.3869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -5.0069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -5.0069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -6.5069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10 1 1 1 0 0 0 1 33 1 0 0 0 0 12 2 1 6 0 0 0 2 21 1 0 0 0 0 3 14 1 0 0 0 0 3 38 1 0 0 0 0 4 14 2 0 0 0 0 5 15 1 0 0 0 0 5 39 1 0 0 0 0 6 15 2 0 0 0 0 7 20 1 0 0 0 0 7 42 1 0 0 0 0 8 21 2 0 0 0 0 9 29 1 0 0 0 0 9 47 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 14 1 0 0 0 0 11 13 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 15 1 0 0 0 0 12 32 1 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 16 18 1 0 0 0 0 16 34 1 0 0 0 0 17 19 2 0 0 0 0 17 35 1 0 0 0 0 18 20 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 25 27 1 0 0 0 0 25 43 1 0 0 0 0 26 28 2 0 0 0 0 26 44 1 0 0 0 0 27 29 2 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 M END $$$$