B5WRO0 -OEChem-04022108423D 27 28 0 0 0 0 0 0 0999 V2000 -4.7536 1.2671 -0.3928 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.7894 1.7225 -0.9276 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 -0.5969 0.3963 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7644 -2.1004 -0.3411 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5167 -2.7675 0.0185 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9475 -0.0213 0.8414 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4955 0.0720 0.2923 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7901 0.5708 -0.2878 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3916 -0.8878 -0.1698 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4853 -1.8903 0.0072 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8562 1.3941 0.5547 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0761 1.2276 0.1984 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7312 -0.5249 -0.3887 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1935 1.7379 0.3311 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1160 0.7970 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5098 -0.7805 1.3951 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7085 0.7578 1.5752 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2022 1.3086 -0.8496 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0352 -0.2120 -1.0175 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1436 2.1291 0.9111 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7132 0.5157 0.7323 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8590 2.0687 0.8637 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4446 -1.2600 -0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5053 2.7622 0.5258 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3811 -3.7339 -0.2611 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4682 -2.5221 0.2694 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0068 0.9630 -1.4946 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 2 12 1 0 0 0 0 2 27 1 0 0 0 0 3 6 1 0 0 0 0 3 7 1 0 0 0 0 3 10 1 0 0 0 0 4 9 1 0 0 0 0 4 10 2 0 0 0 0 5 10 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 8 1 0 0 0 0 6 16 1 0 0 0 0 6 17 1 0 0 0 0 7 9 2 0 0 0 0 7 11 1 0 0 0 0 8 12 1 0 0 0 0 8 18 1 0 0 0 0 8 19 1 0 0 0 0 9 13 1 0 0 0 0 11 14 2 0 0 0 0 11 20 1 0 0 0 0 12 21 1 0 0 0 0 12 22 1 0 0 0 0 13 15 2 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 24 1 0 0 0 0 M END $$$$