BU3IQ4 -OEChem-04012112533D 33 35 0 0 0 0 0 0 0999 V2000 -1.0957 1.4545 -2.0612 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.5970 2.9259 0.2928 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4332 0.6978 -0.3695 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0152 1.3615 1.3436 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5818 -0.8218 0.3621 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8583 -0.6089 -0.1986 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3431 0.2998 0.7041 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4037 1.4737 1.7376 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7691 0.2153 0.2746 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1839 1.7790 0.4837 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0994 -2.1280 0.5625 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 -1.7424 -0.6176 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3853 0.8926 -1.4628 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8522 -3.2293 0.1671 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0881 -3.0361 -0.4341 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1930 0.7095 -0.9549 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6755 -0.3801 1.1469 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5364 0.6073 -1.3161 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0189 -0.4820 0.7856 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4494 0.0117 -0.4457 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7910 0.5929 2.2615 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5121 2.3162 2.4295 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8637 -2.3224 1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5699 -1.6494 -1.0642 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0357 0.3822 -2.3658 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3643 0.5114 -1.1564 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4971 1.9548 -1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 -4.2343 0.3204 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6781 -3.8912 -0.7513 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3580 -0.7574 2.1155 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8883 0.9871 -2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7304 -0.9430 1.4645 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4956 -0.0671 -0.7265 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 2 10 2 0 0 0 0 3 6 1 0 0 0 0 3 10 1 0 0 0 0 3 13 1 0 0 0 0 4 7 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 11 2 0 0 0 0 6 12 2 0 0 0 0 7 9 1 0 0 0 0 8 10 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 16 1 0 0 0 0 9 17 2 0 0 0 0 11 14 1 0 0 0 0 11 23 1 0 0 0 0 12 15 1 0 0 0 0 12 24 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 16 18 2 0 0 0 0 17 19 1 0 0 0 0 17 30 1 0 0 0 0 18 20 1 0 0 0 0 18 31 1 0 0 0 0 19 20 2 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 M END $$$$