BAFT60 -OEChem-04012118512D 46 49 0 0 0 0 0 0 0999 V2000 9.7128 -0.8791 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -3.2155 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -3.2155 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9989 2.3366 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.6880 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8718 -0.1914 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2346 -0.2210 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 -1.1914 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 11.0208 1.9185 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4440 2.5185 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5320 -1.7155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -1.7155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5320 -2.7155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -1.2155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6381 -1.1809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -1.2155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6381 -3.2502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -2.7155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.6947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.7363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0437 -1.6223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2128 -0.0131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6195 0.9005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0153 2.0231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6141 1.0050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4221 2.9366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6031 1.2140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0044 2.2321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4166 3.0411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5976 1.3186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0318 1.7095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4056 3.2502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -0.5955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6453 -0.5609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6453 -3.8702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1963 -3.0484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1726 -2.2287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6564 2.4201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9785 0.5034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0576 3.4382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3509 0.6476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6688 3.6075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9620 0.8170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9720 2.9980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6578 3.8166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8392 3.5024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 13 1 0 0 0 0 2 18 1 0 0 0 0 3 18 2 0 0 0 0 4 28 1 0 0 0 0 4 32 1 0 0 0 0 5 8 1 0 0 0 0 6 8 2 0 0 0 0 7 16 1 0 0 0 0 7 22 2 0 0 0 0 8 19 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 9 38 1 0 0 0 0 10 31 3 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 11 15 1 0 0 0 0 12 14 2 0 0 0 0 12 16 1 0 0 0 0 12 18 1 0 0 0 0 13 17 1 0 0 0 0 14 33 1 0 0 0 0 15 19 2 0 0 0 0 15 34 1 0 0 0 0 16 21 2 0 0 0 0 17 20 2 0 0 0 0 17 35 1 0 0 0 0 19 20 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 23 25 2 0 0 0 0 23 31 1 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 25 39 1 0 0 0 0 26 29 1 0 0 0 0 26 40 1 0 0 0 0 27 30 2 0 0 0 0 27 41 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 29 42 1 0 0 0 0 30 43 1 0 0 0 0 32 44 1 0 0 0 0 32 45 1 0 0 0 0 32 46 1 0 0 0 0 M CHG 2 5 -1 8 1 M END $$$$