B1WUN8 -OEChem-04022113403D 45 45 0 1 0 0 0 0 0999 V2000 5.5989 0.5878 -1.5950 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6622 2.9620 -0.3172 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4301 1.0145 0.4871 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3754 1.7750 0.3697 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7445 -0.7673 -0.2984 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7477 -1.2669 -0.0116 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0754 -0.6227 0.4449 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5100 -0.3811 0.1807 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2038 -1.0724 -0.2281 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2386 -1.6293 0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0426 -0.2216 0.0363 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3716 0.6280 -0.3875 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3387 -0.9515 -0.3149 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5411 -1.0217 0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5613 -0.1125 0.0173 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0657 -0.2903 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1488 -1.0857 -0.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2848 0.9753 0.4179 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4511 -0.6155 -0.3304 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5870 1.4456 0.5876 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6701 0.6502 0.2135 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8225 -1.5455 -1.0707 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5978 -2.1993 0.5475 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9390 -0.3198 1.4926 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6175 0.5407 -0.4029 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4447 -0.0847 1.2348 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2487 -1.3290 -1.2936 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1138 -2.0173 0.3222 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9853 -2.4961 1.0448 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3955 -1.9990 -0.5975 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0261 0.7096 -0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0595 0.0657 1.0954 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4051 -1.8916 0.2452 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3586 -1.1895 -1.3847 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8923 -0.2168 0.2783 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3230 -1.7871 0.9636 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4188 -0.6201 1.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0755 1.8643 1.3336 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6700 -1.7006 -0.6976 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6169 3.0325 -0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9920 -2.0738 -0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4994 1.6478 0.7325 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2945 -1.2347 -0.6216 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7591 2.4309 1.0113 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6841 1.0163 0.3457 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 2 4 1 0 0 0 0 2 40 1 0 0 0 0 3 15 2 0 0 0 0 4 12 1 0 0 0 0 4 38 1 0 0 0 0 5 15 1 0 0 0 0 5 16 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 10 1 0 0 0 0 7 12 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 14 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 13 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 13 15 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 17 19 1 0 0 0 0 17 41 1 0 0 0 0 18 20 2 0 0 0 0 18 42 1 0 0 0 0 19 21 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 45 1 0 0 0 0 M END $$$$