B5JTA1 -OEChem-04042103173D 24 25 0 0 0 0 0 0 0999 V2000 -4.1123 -2.2749 -0.0004 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -5.3682 0.7081 -0.0012 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2641 1.0516 0.0002 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2389 -1.2098 0.0005 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5396 1.5326 -0.0005 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5213 -2.4021 -0.0004 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8943 0.0793 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5371 -0.0991 0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5539 0.6137 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7368 -1.0324 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4358 1.3648 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5340 -0.7589 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1208 -0.8587 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8198 1.5384 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6624 0.4267 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3347 2.9835 -0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6269 -1.6626 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3193 -2.0375 0.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8129 2.2556 0.0013 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2251 2.5473 0.0002 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5108 1.2308 -0.0008 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7830 3.2924 0.8925 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7824 3.2922 -0.8935 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3042 3.4903 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 2 15 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 4 8 2 0 0 0 0 4 12 1 0 0 0 0 5 9 1 0 0 0 0 5 16 1 0 0 0 0 5 21 1 0 0 0 0 6 17 3 0 0 0 0 7 8 1 0 0 0 0 7 10 2 0 0 0 0 7 11 1 0 0 0 0 9 12 2 0 0 0 0 10 13 1 0 0 0 0 10 18 1 0 0 0 0 11 14 2 0 0 0 0 11 19 1 0 0 0 0 12 17 1 0 0 0 0 13 15 2 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 16 22 1 0 0 0 0 16 23 1 0 0 0 0 16 24 1 0 0 0 0 M END $$$$