BAWI57 -OEChem-04022105493D 35 37 0 0 0 0 0 0 0999 V2000 -2.3865 -3.4402 -0.5893 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4566 0.1180 1.3181 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2557 0.1529 -2.5923 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6812 1.2362 -1.1919 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2252 -0.8097 0.3244 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1149 -1.3504 -0.8226 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0722 -0.4331 0.0333 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0515 0.3304 0.2584 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9392 -0.8049 0.9909 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2052 -0.0110 -0.4456 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8843 -1.8725 -0.3522 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8653 1.6034 0.7574 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2203 0.8887 -0.6851 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4145 -0.2943 0.3481 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8827 2.5357 0.5271 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0472 2.1822 -0.1863 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3531 0.0717 -0.6348 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8750 -0.5159 1.6593 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7042 0.2110 -0.3175 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2261 -0.3765 1.9766 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1408 -0.0131 0.9881 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6430 0.5913 -1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7448 -1.8141 1.3689 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9726 -0.1202 1.8451 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8204 -1.8540 -1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2151 -0.2662 -0.9242 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9750 1.8919 1.3029 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1138 0.6150 -1.2332 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7757 3.5505 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8197 2.9294 -0.3492 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9962 0.2564 -1.6465 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -0.8025 2.4597 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5602 -0.5529 2.9955 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9877 0.3251 0.5329 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8934 0.4132 -3.2907 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 2 0 0 0 0 2 21 1 0 0 0 0 2 34 1 0 0 0 0 3 22 1 0 0 0 0 3 35 1 0 0 0 0 4 22 2 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 5 11 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 6 25 1 0 0 0 0 7 9 1 0 0 0 0 7 14 1 0 0 0 0 7 26 1 0 0 0 0 8 10 1 0 0 0 0 8 12 2 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 13 2 0 0 0 0 12 15 1 0 0 0 0 12 27 1 0 0 0 0 13 16 1 0 0 0 0 13 28 1 0 0 0 0 14 17 2 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 29 1 0 0 0 0 16 30 1 0 0 0 0 17 19 1 0 0 0 0 17 31 1 0 0 0 0 18 20 2 0 0 0 0 18 32 1 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 M END $$$$