B3VB8R -OEChem-04022103142D 55 58 0 0 0 0 0 0 0999 V2000 11.4580 -2.1879 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.6879 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5779 4.1505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0764 3.2870 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9056 -0.8969 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8744 -2.9927 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5719 0.6864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1636 -0.2265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8744 -1.3832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.6879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0734 1.5533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5662 0.5801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.6879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1851 -0.4327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4580 -2.1879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7725 -0.3984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -3.1879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.6879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.1879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5749 2.4184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.6879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2367 1.3221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.1879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.6879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0764 3.2853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.1879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.1879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.6879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.1879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.1879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.6879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5991 1.9526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5978 1.1556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7710 0.0288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8397 -1.5134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3384 -0.6515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0670 -3.5820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -3.8079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.5679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0492 2.0191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0505 2.8161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 -1.3779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6967 0.9065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6523 1.7821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7766 1.7378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.0679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -4.4979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -5.3079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -4.4979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2688 4.6879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 -3.6629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 -3.6629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -2.1510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.3779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -3.2249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 2 0 0 0 0 2 27 1 0 0 0 0 2 30 1 0 0 0 0 3 25 1 0 0 0 0 3 50 1 0 0 0 0 4 25 2 0 0 0 0 5 8 1 0 0 0 0 5 16 1 0 0 0 0 5 35 1 0 0 0 0 6 13 1 0 0 0 0 6 15 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 7 12 1 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 9 15 1 0 0 0 0 10 13 2 0 0 0 0 10 19 1 0 0 0 0 11 20 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 16 2 0 0 0 0 12 22 1 0 0 0 0 13 17 1 0 0 0 0 14 34 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 21 1 0 0 0 0 18 23 1 0 0 0 0 19 21 2 0 0 0 0 19 39 1 0 0 0 0 20 25 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 27 1 0 0 0 0 24 46 1 0 0 0 0 26 28 2 0 0 0 0 26 47 1 0 0 0 0 27 29 2 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 M END $$$$