BWJC90 -OEChem-04022112383D 32 32 0 1 0 0 0 0 0999 V2000 3.2226 0.5472 1.0807 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7450 2.5121 -0.4467 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6412 -2.1316 0.2068 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5772 -0.3796 -0.3697 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2490 0.2302 0.0845 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1715 1.3139 0.0741 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6448 -1.1325 0.4188 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0220 0.9103 -0.7948 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4324 -1.4402 -0.4635 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7528 -0.7198 -1.1707 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9726 0.0578 -0.6794 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2951 -0.2821 0.7762 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4867 0.5142 1.2837 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7857 0.1995 -0.8711 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8433 1.5322 1.0981 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3664 -1.1747 1.4793 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7666 1.7106 -0.7183 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2827 0.8852 -1.8507 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7543 -1.5932 -1.5032 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0087 -2.3979 -0.1341 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -1.7886 -1.0737 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5855 -0.5355 -2.2395 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8313 -0.2117 -1.3075 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8376 1.1381 -0.7979 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4412 -0.0648 1.4273 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5109 -1.3528 0.8706 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7716 0.5915 1.9411 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 3.1952 -0.4397 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2453 -2.9916 0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3805 0.3055 0.6871 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7038 0.2510 2.3237 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2872 1.5897 1.2399 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 27 1 0 0 0 0 2 6 1 0 0 0 0 2 28 1 0 0 0 0 3 7 1 0 0 0 0 3 29 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 6 8 1 0 0 0 0 6 15 1 0 0 0 0 7 9 1 0 0 0 0 7 16 1 0 0 0 0 8 17 1 0 0 0 0 8 18 1 0 0 0 0 9 19 1 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 M END $$$$