B10OCU -OEChem-04022103372D 85 91 0 1 0 0 0 0 0999 V2000 12.3311 -0.1594 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 12.4460 -3.6216 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 14.3300 -0.0930 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.9732 3.5641 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 10.9181 -2.8058 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2122 -0.5640 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4479 0.3780 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1906 1.0368 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -1.5599 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8607 -1.0747 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -3.1694 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.8010 0.7891 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2272 1.4497 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1840 1.7404 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9889 -0.6094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4026 0.2006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9405 -0.3020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6723 2.8310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6291 3.1217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0727 0.5658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8038 0.6232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9216 1.0942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8032 0.6564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3328 -0.2589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7706 1.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3317 -0.1926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8612 -1.1079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.8647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -2.3647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.8647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8885 2.0937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6196 2.1511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 -2.3647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.3647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3891 -1.9237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.3647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8553 3.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5864 3.1506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.8647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.8647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7043 3.6216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3886 -1.8905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8596 -1.0084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9170 -2.7394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8590 -0.9752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9165 -2.7063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3875 -1.8242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6257 1.9247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6695 2.1261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4266 -1.0486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9298 0.6018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9476 -0.2206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0446 -0.9132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5603 -0.2865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4749 3.4187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0905 2.6166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2109 3.3360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4317 3.7094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6901 0.0779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4868 0.1043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3042 1.5821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5076 1.5557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3785 0.8877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6754 1.2631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8449 0.1237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8713 -0.6730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8196 -0.5751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7931 0.2215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2860 -1.3391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9891 -1.7145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3621 1.7660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1665 1.8591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 -2.9847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8819 -2.3647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 -1.7447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.7447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.9847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1128 3.4782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.5547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.1747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6837 4.2412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2441 -3.2326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0071 -1.8036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4207 0.8097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4734 1.3154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 43 1 0 0 0 0 2 44 1 0 0 0 0 3 6 2 0 0 0 0 3 7 2 0 0 0 0 3 12 1 0 0 0 0 3 45 1 0 0 0 0 4 37 1 0 0 0 0 5 35 2 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 8 20 1 0 0 0 0 9 15 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 10 35 1 0 0 0 0 11 29 2 0 0 0 0 11 30 1 0 0 0 0 12 84 1 0 0 0 0 12 85 1 0 0 0 0 13 16 1 0 0 0 0 13 18 1 0 0 0 0 13 48 1 0 0 0 0 14 17 1 0 0 0 0 14 19 1 0 0 0 0 14 49 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 50 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 53 1 0 0 0 0 17 54 1 0 0 0 0 18 19 1 0 0 0 0 18 55 1 0 0 0 0 18 56 1 0 0 0 0 19 57 1 0 0 0 0 19 58 1 0 0 0 0 20 22 1 0 0 0 0 20 59 1 0 0 0 0 20 60 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 21 25 1 0 0 0 0 22 61 1 0 0 0 0 22 62 1 0 0 0 0 23 26 1 0 0 0 0 23 63 1 0 0 0 0 23 64 1 0 0 0 0 24 27 1 0 0 0 0 24 65 1 0 0 0 0 24 66 1 0 0 0 0 25 31 2 0 0 0 0 25 32 1 0 0 0 0 26 67 1 0 0 0 0 26 68 1 0 0 0 0 27 69 1 0 0 0 0 27 70 1 0 0 0 0 28 30 1 0 0 0 0 28 34 2 0 0 0 0 29 33 1 0 0 0 0 30 36 2 0 0 0 0 31 37 1 0 0 0 0 31 71 1 0 0 0 0 32 38 2 0 0 0 0 32 72 1 0 0 0 0 33 73 1 0 0 0 0 33 74 1 0 0 0 0 33 75 1 0 0 0 0 34 39 1 0 0 0 0 34 76 1 0 0 0 0 35 42 1 0 0 0 0 36 40 1 0 0 0 0 36 77 1 0 0 0 0 37 41 2 0 0 0 0 38 41 1 0 0 0 0 38 78 1 0 0 0 0 39 40 2 0 0 0 0 39 79 1 0 0 0 0 40 80 1 0 0 0 0 41 81 1 0 0 0 0 42 43 1 0 0 0 0 42 44 2 0 0 0 0 43 45 2 0 0 0 0 44 46 1 0 0 0 0 45 47 1 0 0 0 0 46 47 2 0 0 0 0 46 82 1 0 0 0 0 47 83 1 0 0 0 0 M END $$$$