B1YBP6 -OEChem-04012116322D 44 47 0 1 0 0 0 0 0999 V2000 2.0000 -2.0262 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.3104 -2.8430 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 0.5719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9088 -2.2836 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9339 -0.2592 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 -1.1602 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 -1.1602 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.6906 -0.6602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9088 -0.0367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6906 -1.6602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9339 -2.0611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1313 0.9383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5846 -0.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5846 -2.1948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4907 -0.6393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4907 -1.6810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0869 1.2330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3983 1.6184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -0.2941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -0.2941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3094 2.2079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6208 2.5934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5764 2.8881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -1.1602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 0.5719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -1.1602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 0.5719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.2941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1701 -0.6352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0468 -2.8881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1900 -1.6971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5774 0.4945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5774 -2.8148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0264 -0.3273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0264 -1.9930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5414 0.8113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8058 1.4357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9019 2.3907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1663 3.0151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7143 3.4926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8100 -1.6971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8100 1.1088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 1.1088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -0.2941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 2 11 2 0 0 0 0 3 19 2 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 4 30 1 0 0 0 0 5 7 1 0 0 0 0 5 9 2 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 6 31 1 0 0 0 0 7 11 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 2 0 0 0 0 9 12 1 0 0 0 0 10 14 2 0 0 0 0 12 17 2 0 0 0 0 12 18 1 0 0 0 0 13 15 1 0 0 0 0 13 32 1 0 0 0 0 14 16 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 17 21 1 0 0 0 0 17 36 1 0 0 0 0 18 22 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 20 24 2 0 0 0 0 20 25 1 0 0 0 0 21 23 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 24 26 1 0 0 0 0 24 41 1 0 0 0 0 25 27 2 0 0 0 0 25 42 1 0 0 0 0 26 28 2 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 28 44 1 0 0 0 0 M END $$$$