B01IUE -OEChem-04022107213D 40 42 0 1 0 0 0 0 0999 V2000 -6.1493 -0.5730 -0.2436 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.9274 -1.9972 -0.1235 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.2729 2.6867 0.2915 F 0 0 0 0 0 0 0 0 0 0 0 0 4.5691 -1.2226 0.3082 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5663 -0.0823 -0.2832 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7817 -2.5933 0.0838 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3246 -0.1289 -1.2525 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5329 -0.2495 0.2708 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1918 1.9429 -0.2604 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1383 0.5664 0.0154 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8549 -0.1011 1.2062 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7130 0.1031 -1.3381 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3523 0.1770 1.2072 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2036 0.3903 -1.4604 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6357 0.3502 0.0818 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1127 -0.9408 0.0072 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7793 1.4426 0.2187 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1228 -0.0468 0.2062 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4649 0.8426 0.3579 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2665 -1.1394 0.0695 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5999 1.2442 0.2807 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7975 0.1633 0.5570 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2183 -1.4582 0.2133 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8356 0.6239 -0.4137 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3326 1.6454 0.0911 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4283 0.2793 2.1433 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6900 -1.1852 1.2099 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5388 -0.9680 -1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1891 0.6241 -2.1499 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8167 -0.2634 2.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5608 1.2518 1.2121 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4203 1.4540 -1.3181 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5632 0.0999 -2.4525 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2352 1.4837 1.2158 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4155 1.4341 -0.5634 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6041 -2.1649 0.0069 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2294 2.1226 0.3833 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1737 0.2765 1.5798 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7772 2.5384 0.4493 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8916 2.3678 -0.8597 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 2 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 16 1 0 0 0 0 3 17 1 0 0 0 0 4 22 1 0 0 0 0 4 23 1 0 0 0 0 6 23 2 0 0 0 0 7 24 2 0 0 0 0 8 18 1 0 0 0 0 8 19 1 0 0 0 0 8 23 1 0 0 0 0 9 24 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 10 25 1 0 0 0 0 11 13 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 14 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 20 1 0 0 0 0 17 21 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 19 22 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 22 24 1 0 0 0 0 22 38 1 0 0 0 0 M END $$$$