BMW3D6 -OEChem-04012118132D 26 25 0 1 0 0 0 0 0999 V2000 4.5981 1.6340 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 4.5981 3.3660 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 3.7320 0.1340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.1340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0981 2.5000 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5.0981 0.7679 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.6340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.1340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.1340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 0.2166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -0.4737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.5560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.5560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.1760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.1760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.9860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0841 3.1340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.7540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8441 3.1340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 5 1 0 0 0 0 1 6 2 0 0 0 0 1 12 1 0 0 0 0 3 9 1 0 0 0 0 3 12 1 0 0 0 0 4 16 1 0 0 0 0 7 12 2 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 9 17 1 0 0 0 0 9 18 1 0 0 0 0 10 13 1 0 0 0 0 10 19 1 0 0 0 0 11 14 2 0 0 0 0 11 20 1 0 0 0 0 13 15 2 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 23 1 0 0 0 0 16 24 1 0 0 0 0 16 25 1 0 0 0 0 16 26 1 0 0 0 0 M CHG 2 2 1 5 -1 M END $$$$