B1HR4N -OEChem-04012114282D 40 42 0 0 0 0 0 0 0999 V2000 6.3397 0.7054 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.4699 -0.8221 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8431 1.5734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8364 -0.1625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7378 -0.8221 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2077 1.2021 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.7779 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8718 -0.3221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8718 0.6779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0718 0.6987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9778 1.2126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7378 1.1779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6038 0.6779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9778 -0.8567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6038 -0.3221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0718 -0.3429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7378 -1.8221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4718 0.2088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4699 1.1779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6077 0.7121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4679 -0.7912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7398 0.2154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 -1.2879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7359 -0.7846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 -1.2812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9850 1.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7378 1.7979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9850 -1.4767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5360 -0.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2101 1.8221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1178 -1.8221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7378 -2.4421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3578 -1.8221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7799 0.6410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0068 1.4879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1599 1.7149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6101 1.3321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0037 -1.1033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2040 0.5275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5976 -1.9079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 6 1 0 0 0 0 1 18 1 0 0 0 0 2 15 2 0 0 0 0 5 8 1 0 0 0 0 5 15 1 0 0 0 0 5 17 1 0 0 0 0 6 10 1 0 0 0 0 6 30 1 0 0 0 0 7 25 3 0 0 0 0 8 9 2 0 0 0 0 8 14 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 11 26 1 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 14 16 2 0 0 0 0 14 28 1 0 0 0 0 16 29 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 22 1 0 0 0 0 20 37 1 0 0 0 0 21 23 2 0 0 0 0 21 38 1 0 0 0 0 22 24 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 M END $$$$