B3A5KU -OEChem-04042102593D 37 39 0 0 0 0 0 0 0999 V2000 0.9880 3.7418 0.2412 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0583 -2.4399 -0.3201 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.6256 -2.2643 -0.1959 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5026 -1.0505 -0.6835 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3007 -2.7075 0.3044 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2671 2.3338 0.1544 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7892 1.1726 0.0372 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1440 0.4739 -0.0461 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1331 1.4891 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8995 -0.8028 0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8818 -1.7888 0.3694 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 1.3395 0.0876 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0915 2.2825 0.1344 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3707 0.7644 -0.6428 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1086 -1.4985 -0.2275 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4373 2.8295 0.1511 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9581 0.0113 -0.0232 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3531 -0.2219 -0.7336 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6255 1.7522 0.1367 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3056 -0.5593 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9673 -0.9494 -0.0877 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6348 0.7916 0.0721 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6176 -3.1527 0.9116 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3745 -1.5462 -0.1066 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9479 -1.0369 0.9328 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5925 1.7412 -1.0647 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6671 3.2674 0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3971 3.3257 0.1925 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9349 -0.3382 -0.0634 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8909 2.8014 0.2268 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3070 0.0023 -1.2019 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6676 1.1261 0.1244 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9360 -3.9198 0.1977 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1596 -3.2950 1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5514 -3.3138 1.1034 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4177 -2.8185 -0.2793 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2173 -1.7212 -0.7235 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 16 1 0 0 0 0 2 15 1 0 0 0 0 3 21 1 0 0 0 0 3 36 1 0 0 0 0 4 24 1 0 0 0 0 4 37 1 0 0 0 0 5 24 2 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 6 27 1 0 0 0 0 7 9 1 0 0 0 0 7 13 2 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 8 14 1 0 0 0 0 9 16 2 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 15 2 0 0 0 0 11 23 1 0 0 0 0 12 17 2 0 0 0 0 12 19 1 0 0 0 0 14 18 2 0 0 0 0 14 26 1 0 0 0 0 15 18 1 0 0 0 0 16 28 1 0 0 0 0 17 21 1 0 0 0 0 17 29 1 0 0 0 0 18 31 1 0 0 0 0 19 22 2 0 0 0 0 19 30 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 20 24 1 0 0 0 0 22 32 1 0 0 0 0 23 33 1 0 0 0 0 23 34 1 0 0 0 0 23 35 1 0 0 0 0 M END $$$$