BTU6N4 -OEChem-04022103362D 54 57 0 1 0 0 0 0 0999 V2000 12.4698 2.8423 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.9589 -1.2303 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.6188 0.2641 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2395 -0.4081 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3755 1.6650 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1781 2.8625 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2638 1.0230 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9163 2.1496 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8094 0.7641 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3755 -0.1369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4006 -0.3594 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7104 0.3302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7104 1.1980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1781 -1.3343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6188 1.2641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4006 1.8876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5366 0.8935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7851 -0.6670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4376 0.4596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2225 -1.6291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9112 -2.0145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6861 -1.1009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5123 -0.5376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.6040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6886 -2.9894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7330 -3.2842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1648 0.5891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9910 1.1524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8920 0.7185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7183 1.2818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7426 2.7129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6435 2.2790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3755 -0.7569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9800 -0.2749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8390 -0.7978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9794 0.6394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2690 1.4670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4414 1.7566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3498 1.8227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0143 1.1261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4903 1.5118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7680 -1.2074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5036 -1.8318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7324 -1.7192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0709 -0.8066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5856 3.0452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6326 3.2842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4075 -2.7868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1431 -3.4112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2175 1.6412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5951 -3.8886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9384 0.1002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2769 1.0128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6962 3.3312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 32 1 0 0 0 0 2 18 1 0 0 0 0 3 11 1 0 0 0 0 3 15 1 0 0 0 0 4 27 2 0 0 0 0 5 9 1 0 0 0 0 5 16 2 0 0 0 0 6 16 1 0 0 0 0 6 46 1 0 0 0 0 6 47 1 0 0 0 0 7 19 1 0 0 0 0 7 27 1 0 0 0 0 7 50 1 0 0 0 0 8 28 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 13 1 1 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 14 1 1 0 0 0 11 35 1 0 0 0 0 12 17 1 0 0 0 0 12 18 2 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 20 2 0 0 0 0 14 21 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 17 19 2 0 0 0 0 17 41 1 0 0 0 0 18 22 1 0 0 0 0 19 23 1 0 0 0 0 20 24 1 0 0 0 0 20 42 1 0 0 0 0 21 25 2 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 24 26 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 52 1 0 0 0 0 30 32 1 0 0 0 0 30 53 1 0 0 0 0 31 32 2 0 0 0 0 31 54 1 0 0 0 0 M END $$$$