B61VFC -OEChem-04012115242D 29 27 0 0 0 0 0 0 0999 V2000 3.5000 -3.0000 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 2.6340 -4.5000 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 2.0000 -3.8660 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 5.2320 3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 -1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6340 -1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -4.0000 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.5000 -3.0000 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.5000 -3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0981 4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7690 1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9631 1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7690 -0.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9631 -0.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0200 4.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6215 3.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4081 3.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6350 4.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7881 5.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 9 1 0 0 0 0 1 10 2 0 0 0 0 1 20 1 0 0 0 0 4 17 1 0 0 0 0 4 18 1 0 0 0 0 5 12 1 0 0 0 0 5 20 1 0 0 0 0 6 17 2 0 0 0 0 7 20 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 11 17 1 0 0 0 0 12 15 2 0 0 0 0 12 16 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 14 16 2 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 18 19 1 0 0 0 0 18 25 1 0 0 0 0 18 26 1 0 0 0 0 19 27 1 0 0 0 0 19 28 1 0 0 0 0 19 29 1 0 0 0 0 M CHG 4 2 1 3 1 8 -1 9 -1 M END $$$$