21004 -OEChem-03292401543D 9 8 0 0 0 0 0 0 0999 V2000 -1.9079 0.7820 0.0680 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.3787 -1.6884 0.1299 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6887 0.7091 0.2589 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3708 0.0104 -0.3846 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9686 0.1870 -0.0721 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2684 0.0635 -1.4733 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7200 0.9122 0.2536 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0745 0.0487 -1.1528 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 -0.7492 0.4572 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 2 4 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 4 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 M END > 21004 > 0.4 > 1 3 2 > 5 1 -0.29 2 -0.29 3 -0.56 4 0.86 5 0.28 > 1 > 1 1 3 acceptor > 5 > 0 > 0 > 0 > 0 > 0 > 1 > 1 > 0000520C00000001 > 8.3375 > 5.074 > 139733 1 9724874142365007350 16714656 1 18333455347760069260 20096714 4 18341610391154146757 21015797 1 8644187244514668828 21040471 1 18410572872797164996 5460574 1 8934998174446481180 5943 1 10978183730162800719 > 100.77 2.34 1.46 0.66 0.22 0.89 0.02 -0.9 -0.04 -0.26 -0.1 -0.03 0.01 0 > 156.767 > 73.2 > 2 5 10 $$$$