B2OQR0 -OEChem-04022100212D 54 57 0 0 0 0 0 0 0999 V2000 2.0000 -2.4177 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.6132 -5.7694 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.9793 2.2694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5255 0.5784 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3733 -1.4906 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8042 -1.1816 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6132 -1.7694 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1132 -0.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1132 0.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1132 -0.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4223 -1.1816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0643 0.0784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9793 1.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8532 -1.4906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6132 -2.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6453 -2.4688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4793 -3.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1100 -0.8215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7472 -3.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8453 2.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6942 -2.7778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4793 -4.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 -1.1305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7472 -4.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 -2.1087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6132 -4.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8453 3.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7113 4.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9793 4.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7113 5.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9793 5.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8453 5.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9012 1.3520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5027 0.6618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2559 -0.5112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6540 0.2700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8727 0.6681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1913 0.6868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5898 1.3771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1060 -2.8837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0162 -2.9594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2389 -0.2151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2103 -2.9594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0574 2.1868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4559 2.8771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5653 -3.3843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0162 -4.5794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6982 -0.7157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2103 -4.5794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2483 3.9594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4423 3.9594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2483 5.5794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4423 5.5794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8453 6.3894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 2 26 1 0 0 0 0 3 13 1 0 0 0 0 3 20 1 0 0 0 0 4 10 2 0 0 0 0 5 11 2 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 14 1 0 0 0 0 7 11 1 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 9 13 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 16 2 0 0 0 0 14 18 1 0 0 0 0 15 17 2 0 0 0 0 15 19 1 0 0 0 0 16 21 1 0 0 0 0 16 40 1 0 0 0 0 17 22 1 0 0 0 0 17 41 1 0 0 0 0 18 23 2 0 0 0 0 18 42 1 0 0 0 0 19 24 2 0 0 0 0 19 43 1 0 0 0 0 20 27 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 25 2 0 0 0 0 21 46 1 0 0 0 0 22 26 2 0 0 0 0 22 47 1 0 0 0 0 23 25 1 0 0 0 0 23 48 1 0 0 0 0 24 26 1 0 0 0 0 24 49 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 28 30 1 0 0 0 0 28 50 1 0 0 0 0 29 31 2 0 0 0 0 29 51 1 0 0 0 0 30 32 2 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 32 54 1 0 0 0 0 M END $$$$