B5MNU6 -OEChem-04022109253D 42 44 0 0 0 0 0 0 0999 V2000 5.1624 2.3061 1.6407 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -5.1607 -2.3082 -1.6399 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.7047 -3.3188 -0.9988 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -5.7036 3.3200 0.9923 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.5302 1.6167 -1.0647 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5302 -1.6157 1.0659 S 0 0 0 0 0 0 0 0 0 0 0 0 4.2304 2.8868 -1.0911 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0591 1.0116 -2.2960 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0581 -1.0106 2.2968 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2314 -2.8851 1.0929 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2670 1.6812 0.0651 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2665 -1.6800 -0.0633 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1205 0.8312 0.0328 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 -0.8300 -0.0303 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5956 0.4439 -0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5961 -0.4443 0.2779 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1545 1.3841 -0.0866 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2747 0.5536 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2752 -0.5523 0.1208 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1551 -1.3829 0.0892 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2862 0.7600 0.8816 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2861 -0.7618 -0.8817 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7142 -0.8067 -0.8665 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7160 0.8067 0.8654 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5436 -1.7631 -0.2807 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5456 1.7621 0.2784 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1157 -0.1962 1.4673 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1156 0.1937 -1.4688 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2444 -1.4578 0.8861 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2452 1.4556 -0.8888 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1102 2.5869 0.5263 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1092 -2.5858 -0.5242 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 2.4604 -0.1637 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2477 1.0117 -0.2437 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2482 -1.0104 0.2466 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2865 -2.4592 0.1661 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1765 -1.0653 -1.7738 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1783 1.0663 1.7725 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6689 0.0250 2.3765 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6679 -0.0285 -2.3784 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8946 -2.1930 1.3532 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8946 2.1905 -1.3575 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 2 22 1 0 0 0 0 3 25 1 0 0 0 0 4 26 1 0 0 0 0 5 7 2 0 0 0 0 5 8 2 0 0 0 0 5 11 1 0 0 0 0 5 15 1 0 0 0 0 6 9 2 0 0 0 0 6 10 2 0 0 0 0 6 12 1 0 0 0 0 6 16 1 0 0 0 0 11 13 1 0 0 0 0 11 31 1 0 0 0 0 12 14 1 0 0 0 0 12 32 1 0 0 0 0 13 17 2 0 0 0 0 13 19 1 0 0 0 0 14 18 2 0 0 0 0 14 20 1 0 0 0 0 15 21 2 0 0 0 0 15 23 1 0 0 0 0 16 22 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 21 27 1 0 0 0 0 22 28 1 0 0 0 0 23 25 2 0 0 0 0 23 37 1 0 0 0 0 24 26 2 0 0 0 0 24 38 1 0 0 0 0 25 29 1 0 0 0 0 26 30 1 0 0 0 0 27 29 2 0 0 0 0 27 39 1 0 0 0 0 28 30 2 0 0 0 0 28 40 1 0 0 0 0 29 41 1 0 0 0 0 30 42 1 0 0 0 0 M END $$$$