BB0ME5 -OEChem-04012113113D 42 44 0 0 0 0 0 0 0999 V2000 6.3992 1.9078 -1.3901 F 0 0 0 0 0 0 0 0 0 0 0 0 7.3432 0.0227 -0.8593 F 0 0 0 0 0 0 0 0 0 0 0 0 6.8980 1.4902 0.6909 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.2267 3.5648 0.8470 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9642 -2.1810 -1.0444 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4092 3.8890 0.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0307 -0.1509 -1.0383 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1493 -1.2352 0.3959 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2594 -1.4214 0.3877 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3461 -0.4481 0.1921 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -0.6618 0.1924 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5621 -0.8282 0.1761 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2509 -2.5681 0.7944 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1579 -2.7542 0.7863 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5248 -1.0666 -0.2249 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3217 0.9292 0.4122 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6788 -0.3081 -0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0972 -3.3276 0.9898 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4757 1.6878 0.2151 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6289 -1.6205 -0.2478 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7510 0.5361 0.3967 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0738 0.3160 -0.2305 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6543 1.0692 -0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8848 -1.0484 -0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0068 1.1083 0.1934 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4162 0.9280 -0.4482 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9078 -0.9529 -0.8565 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4500 3.1238 0.4441 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1848 0.3528 -0.1881 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2041 -3.0483 0.9979 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0279 -3.3749 0.9819 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5571 -2.1327 -0.4344 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4163 1.4072 0.7742 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1760 -4.3612 1.3142 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5222 -2.6804 -0.4618 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9589 1.1865 0.7578 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5231 1.7010 -0.3404 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7014 -1.6811 -0.7877 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1464 2.1709 0.3744 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0777 0.8508 -0.9058 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9021 -0.5796 -1.3345 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2201 4.5339 0.9992 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 2 26 1 0 0 0 0 3 26 1 0 0 0 0 4 28 1 0 0 0 0 4 42 1 0 0 0 0 5 27 2 0 0 0 0 6 28 2 0 0 0 0 7 27 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 8 13 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 9 14 1 0 0 0 0 10 15 2 0 0 0 0 10 16 1 0 0 0 0 11 29 1 0 0 0 0 12 20 2 0 0 0 0 12 21 1 0 0 0 0 13 18 1 0 0 0 0 13 30 1 0 0 0 0 14 18 2 0 0 0 0 14 31 1 0 0 0 0 15 17 1 0 0 0 0 15 32 1 0 0 0 0 16 19 2 0 0 0 0 16 33 1 0 0 0 0 17 23 2 0 0 0 0 17 27 1 0 0 0 0 18 34 1 0 0 0 0 19 23 1 0 0 0 0 19 28 1 0 0 0 0 20 24 1 0 0 0 0 20 35 1 0 0 0 0 21 25 2 0 0 0 0 21 36 1 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 22 26 1 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 M END $$$$