BL4MU5 -OEChem-04042106163D 40 42 0 1 0 0 0 0 0999 V2000 -1.9156 3.2066 -1.6166 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.1340 -2.3123 0.4561 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.3501 -3.4477 0.9986 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.0936 -1.8828 2.3267 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.6908 2.4415 1.9391 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 -1.6874 -1.0187 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0565 1.2126 -0.5314 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6869 0.4941 -1.9005 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4938 -1.4313 -3.2266 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9671 -0.8041 0.6185 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7970 -0.2902 -0.8630 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8668 1.1075 -0.5737 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.7210 0.1561 0.2872 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0580 -1.2129 0.3228 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5374 1.4854 0.0979 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6642 2.4043 -0.8259 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9273 -2.2355 1.0411 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6722 -0.7903 -2.0326 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6696 1.1743 -0.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5358 2.1385 1.3305 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8783 1.5160 0.0787 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6729 2.4804 1.9371 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8799 2.1692 1.3112 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6322 -0.0142 -0.2459 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5554 -1.9912 0.8734 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3291 -1.4931 -0.5628 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7476 -2.3933 0.3066 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7152 0.0610 -0.1719 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8778 0.5322 1.3034 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0837 -1.1747 0.8223 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5972 2.1987 -1.3626 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9176 2.9579 0.0817 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7073 0.6717 -1.4896 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6737 2.9889 2.8966 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8174 2.4396 1.7894 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3577 -0.9128 -4.0874 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4918 -2.4437 -3.2857 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0239 -2.6318 1.5691 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2675 -1.7213 -1.0569 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1969 -3.3517 0.5292 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 2 17 1 0 0 0 0 3 17 1 0 0 0 0 4 17 1 0 0 0 0 5 20 1 0 0 0 0 6 14 1 0 0 0 0 6 18 1 0 0 0 0 7 21 1 0 0 0 0 7 24 1 0 0 0 0 8 12 1 0 0 0 0 8 18 2 0 0 0 0 9 18 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 24 1 0 0 0 0 10 25 2 0 0 0 0 11 24 2 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 17 1 0 0 0 0 14 30 1 0 0 0 0 15 19 1 0 0 0 0 15 20 2 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 19 21 2 0 0 0 0 19 33 1 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 22 23 2 0 0 0 0 22 34 1 0 0 0 0 23 35 1 0 0 0 0 25 27 1 0 0 0 0 25 38 1 0 0 0 0 26 27 2 0 0 0 0 26 39 1 0 0 0 0 27 40 1 0 0 0 0 M END $$$$