D0P5UW -OEChem-10101305022D 83 88 0 0 0 0 0 0 0999 V2000 2.1521 0.8224 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 12.7800 -2.5077 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 13.7800 -0.7756 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 9.2800 0.0904 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.6499 -1.6276 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1460 0.5904 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4140 -0.4096 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2892 -5.5554 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.3986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6964 2.6272 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7800 0.9564 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2800 1.8224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0071 3.5777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6964 1.0177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7502 2.3224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7502 1.3224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2800 1.8224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0071 0.0672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9856 3.7839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3392 4.3220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7800 0.9564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8842 2.8224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8842 0.8224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3392 -0.6771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0181 2.3224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0181 1.3224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6499 5.2725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6534 3.0396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3607 4.1158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2962 4.7344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6319 3.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9820 6.0168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6929 4.8601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2747 4.9407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7800 -0.7756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0035 5.8106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9426 4.1964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7800 -0.7756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9820 -2.3719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2800 -1.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2800 0.0904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0035 -2.1657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2927 -3.3224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2800 -1.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2800 0.0904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3357 -2.9100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6249 -4.0668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6464 -3.8605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7800 -0.7756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9785 -4.6048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4004 3.4498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8626 2.0345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1724 2.4330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3896 -0.4207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5540 0.3592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1974 0.7444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8877 0.3458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8842 3.4424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8842 0.2024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9567 -0.1892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7923 -0.9691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4812 2.6324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0900 1.4934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2566 5.4004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4608 2.4503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1681 3.5265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8822 5.1959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1746 6.6061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0460 2.7844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0862 4.7322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4674 5.5300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1974 -0.9877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8877 -1.3862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5492 4.3242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5895 6.2721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9700 -2.1786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9700 0.6273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8109 -1.5764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8994 -3.4503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5900 0.6273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7290 -2.7822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8175 -4.6561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8751 -6.0168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 2 44 1 0 0 0 0 3 49 1 0 0 0 0 4 6 2 0 0 0 0 4 7 2 0 0 0 0 4 11 1 0 0 0 0 4 35 1 0 0 0 0 5 24 1 0 0 0 0 5 39 1 0 0 0 0 8 50 1 0 0 0 0 8 83 1 0 0 0 0 9 50 2 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 10 15 1 0 0 0 0 11 21 1 0 0 0 0 11 63 1 0 0 0 0 12 14 2 0 0 0 0 12 17 1 0 0 0 0 13 19 1 0 0 0 0 13 20 1 0 0 0 0 13 51 1 0 0 0 0 14 16 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 22 1 0 0 0 0 16 23 1 0 0 0 0 17 21 1 0 0 0 0 17 52 1 0 0 0 0 17 53 1 0 0 0 0 18 24 1 0 0 0 0 18 54 1 0 0 0 0 18 55 1 0 0 0 0 19 28 2 0 0 0 0 19 30 1 0 0 0 0 20 27 2 0 0 0 0 20 29 1 0 0 0 0 21 56 1 0 0 0 0 21 57 1 0 0 0 0 22 25 2 0 0 0 0 22 58 1 0 0 0 0 23 26 2 0 0 0 0 23 59 1 0 0 0 0 24 60 1 0 0 0 0 24 61 1 0 0 0 0 25 26 1 0 0 0 0 25 62 1 0 0 0 0 27 32 1 0 0 0 0 27 64 1 0 0 0 0 28 31 1 0 0 0 0 28 65 1 0 0 0 0 29 33 2 0 0 0 0 29 66 1 0 0 0 0 30 34 2 0 0 0 0 30 67 1 0 0 0 0 31 37 2 0 0 0 0 31 69 1 0 0 0 0 32 36 2 0 0 0 0 32 68 1 0 0 0 0 33 36 1 0 0 0 0 33 70 1 0 0 0 0 34 37 1 0 0 0 0 34 71 1 0 0 0 0 35 38 1 0 0 0 0 35 72 1 0 0 0 0 35 73 1 0 0 0 0 36 75 1 0 0 0 0 37 74 1 0 0 0 0 38 40 2 0 0 0 0 38 41 1 0 0 0 0 39 42 2 0 0 0 0 39 43 1 0 0 0 0 40 44 1 0 0 0 0 40 76 1 0 0 0 0 41 45 2 0 0 0 0 41 77 1 0 0 0 0 42 46 1 0 0 0 0 42 78 1 0 0 0 0 43 47 2 0 0 0 0 43 79 1 0 0 0 0 44 49 2 0 0 0 0 45 49 1 0 0 0 0 45 80 1 0 0 0 0 46 48 2 0 0 0 0 46 81 1 0 0 0 0 47 48 1 0 0 0 0 47 82 1 0 0 0 0 48 50 1 0 0 0 0 M END $$$$