LJT8F4 -OEChem-05032301373D 42 45 0 1 0 0 0 0 0999 V2000 -3.5167 4.3088 0.1726 F 0 0 0 0 0 0 0 0 0 0 0 0 4.3098 -0.8084 -1.4148 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0708 2.5864 -0.2609 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8321 1.1630 -0.4136 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5992 -1.3403 0.4626 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8498 -3.1320 -0.1151 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8820 -0.4961 -0.5246 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2009 -2.8022 -0.6481 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5852 0.0510 -0.0204 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2544 -0.5152 1.2345 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5454 -0.9304 -0.5821 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2062 -0.8903 2.2745 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1745 -1.8619 1.7092 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6316 0.3903 -1.0811 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6689 -1.8078 0.0948 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7446 -0.9321 -0.0576 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6364 1.3865 -0.5505 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9555 0.4726 0.0675 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9572 -1.4991 -0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2998 0.7166 -0.2295 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1299 1.5645 0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0882 -3.5417 -0.4686 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8578 1.9999 -0.2034 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6754 2.8529 0.4367 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0189 3.0650 0.1361 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0675 0.9743 0.2676 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9378 0.2151 1.6821 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8481 -1.4060 0.9953 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0098 -0.4450 -1.4079 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0234 -1.8289 -0.9914 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6917 -1.3352 3.1503 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6979 0.0199 2.6175 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6393 -2.8370 1.5175 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3893 -2.0128 2.4606 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1728 0.7938 -1.9902 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9091 -0.6100 -2.1546 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8517 -0.6259 -0.7775 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 1.4243 0.6601 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2007 -4.6084 -0.6296 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9039 2.1669 -0.4372 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0433 3.6963 0.7011 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7309 3.2306 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 2 14 1 0 0 0 0 2 36 1 0 0 0 0 3 17 1 0 0 0 0 3 42 1 0 0 0 0 4 17 2 0 0 0 0 5 11 1 0 0 0 0 5 13 1 0 0 0 0 5 15 1 0 0 0 0 6 15 2 0 0 0 0 6 22 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 7 37 1 0 0 0 0 8 19 1 0 0 0 0 8 22 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 9 26 1 0 0 0 0 10 12 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 17 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 16 18 1 0 0 0 0 16 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 20 23 1 0 0 0 0 21 24 2 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 23 25 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 M END $$$$