BBJI57 -OEChem-04022107542D 44 46 0 0 0 0 0 0 0999 V2000 2.8680 1.7911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0525 -1.2289 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4544 -1.7564 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9243 0.2677 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.4544 1.2436 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5884 -0.2564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5884 -1.2564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4544 0.2436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6945 0.2782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7884 -0.2356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6945 -1.7911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3204 -1.2564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7884 -1.2772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3204 -0.2564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1865 -1.7564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0564 -0.2289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4602 0.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1923 0.2744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3243 -0.2223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5923 -0.2156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.2878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7282 0.2878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 1.7844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.2944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7016 0.8982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7016 -2.4110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2526 -1.5893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8574 0.0536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9267 0.8877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8765 -2.2934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7234 -2.0664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4965 -1.2195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9914 1.5536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9175 1.5536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1946 0.8944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3219 -0.8422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5899 -0.8356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0022 1.5890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1901 -0.0202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6024 2.4044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6921 1.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4619 0.9865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3079 0.7563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 25 1 0 0 0 0 2 16 2 0 0 0 0 3 7 2 0 0 0 0 3 12 1 0 0 0 0 4 10 1 0 0 0 0 4 16 1 0 0 0 0 4 30 1 0 0 0 0 5 8 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 7 11 1 0 0 0 0 8 14 1 0 0 0 0 9 10 2 0 0 0 0 9 26 1 0 0 0 0 10 13 1 0 0 0 0 11 13 2 0 0 0 0 11 27 1 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 13 28 1 0 0 0 0 14 29 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 2 0 0 0 0 17 21 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 20 23 1 0 0 0 0 20 38 1 0 0 0 0 21 24 2 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M END $$$$