BI1R2Q -OEChem-04042101413D 38 39 0 0 0 0 0 0 0999 V2000 3.1007 3.1090 -0.0017 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.7035 0.4478 0.0014 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5380 2.4386 -0.0067 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8352 1.0993 0.0048 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 -0.7834 0.0056 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4678 0.9205 -0.0023 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7008 -2.6571 0.0052 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2452 -2.2772 -0.0035 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9708 -0.0559 -0.0033 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3703 0.3087 0.0087 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0778 0.1923 -0.0034 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9393 1.1698 -0.0059 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1122 0.5584 0.0039 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5731 1.2156 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6040 -0.2690 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6099 -0.2550 1.2058 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5956 -0.4212 -0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5014 -1.2581 0.0032 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2065 1.3953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6625 -1.1775 -1.2074 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6683 -1.1635 1.2085 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1946 -1.6248 0.0019 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9651 -0.9123 -0.0041 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4095 -0.3244 -0.8842 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 -0.3107 0.9112 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9904 1.8077 -0.8971 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9950 1.8178 0.8777 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7583 2.0896 -0.2043 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1966 0.0705 -2.1586 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2072 0.0955 2.1524 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0720 -1.5371 -2.1469 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0823 -1.5122 2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0185 -2.3324 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2989 -3.0027 -0.7393 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8505 -3.1988 0.1226 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6109 -2.9571 0.3975 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2086 -2.5891 -0.0784 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8480 -0.5883 -0.0036 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 12 1 0 0 0 0 2 14 1 0 0 0 0 3 14 2 0 0 0 0 4 10 1 0 0 0 0 4 13 1 0 0 0 0 4 28 1 0 0 0 0 5 13 2 0 0 0 0 5 18 1 0 0 0 0 6 17 1 0 0 0 0 6 19 2 0 0 0 0 7 18 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 23 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 23 2 0 0 0 0 9 38 1 0 0 0 0 10 14 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 11 16 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 13 19 1 0 0 0 0 15 20 1 0 0 0 0 15 29 1 0 0 0 0 16 21 2 0 0 0 0 16 30 1 0 0 0 0 17 18 2 0 0 0 0 17 23 1 0 0 0 0 20 22 2 0 0 0 0 20 31 1 0 0 0 0 21 22 1 0 0 0 0 21 32 1 0 0 0 0 22 33 1 0 0 0 0 M END $$$$