BD2UB8 -OEChem-04022106213D 43 44 0 0 0 0 0 0 0999 V2000 2.2880 1.7268 1.5260 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1352 -1.0900 -0.2491 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5968 -2.3248 -0.0035 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6915 2.8095 0.4321 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0986 1.1040 -0.9290 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7425 -0.0376 1.3518 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4187 0.6474 -0.6021 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4126 1.6310 -1.1258 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0014 -0.3533 -1.2973 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7995 0.8380 0.8469 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9853 -1.2159 -0.6615 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3285 -1.0439 0.6224 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7243 -0.7000 -2.7341 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1762 1.0533 -0.0257 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8671 1.7440 -0.1531 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2604 -0.3382 -0.0775 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3312 -1.8940 1.3344 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3310 1.8159 0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4996 -0.9668 0.0452 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5700 1.1873 0.2717 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6544 -0.2040 0.2199 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4475 -1.5024 0.9292 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9010 -2.8865 0.1301 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5394 1.7993 -2.1998 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5221 2.6143 -0.6565 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4377 -2.0050 -1.2544 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1392 0.2458 -1.4175 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0218 0.0651 2.3234 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9074 -0.1160 -3.1658 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6155 -0.5275 -3.3474 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4396 -1.7543 -2.8266 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8690 -2.3941 2.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7474 -2.6686 0.6816 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1634 -1.2817 1.6975 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2871 2.9012 0.1872 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4687 1.7822 0.4064 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6496 -0.6226 0.3221 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1854 -0.6437 1.5554 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0610 -2.2059 1.5007 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4739 -2.0087 0.6285 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7910 -3.9743 0.0683 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5563 -2.5862 -0.6945 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3366 -2.6668 1.1108 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 2 0 0 0 0 2 16 1 0 0 0 0 2 22 1 0 0 0 0 3 19 1 0 0 0 0 3 23 1 0 0 0 0 4 15 2 0 0 0 0 5 8 1 0 0 0 0 5 15 1 0 0 0 0 5 27 1 0 0 0 0 6 10 1 0 0 0 0 6 12 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 11 12 2 0 0 0 0 11 26 1 0 0 0 0 12 17 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 14 18 1 0 0 0 0 16 19 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 20 2 0 0 0 0 18 35 1 0 0 0 0 19 21 2 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 M END $$$$