B89XQC -OEChem-04022104033D 50 52 0 0 0 0 0 0 0999 V2000 4.1280 -2.3018 -1.8804 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.8240 -2.1818 2.0264 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.7976 0.7722 -2.4312 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9650 -2.1454 -0.3092 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8458 -0.0271 -0.4997 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9302 1.5242 0.4604 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6101 1.1987 -0.4858 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5238 1.9219 -1.1078 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 0.9713 -1.5478 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9625 2.9912 -0.1674 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3914 0.4299 -0.3584 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 2.3821 0.9759 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7335 0.9925 1.5611 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0872 0.5278 1.0938 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6686 0.6790 -1.2135 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0846 1.4607 0.8096 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3442 -0.8352 0.9451 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6911 -0.0607 -0.4297 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3388 1.0306 0.3766 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5984 -1.2652 0.5122 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5958 -0.3324 0.2278 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9646 -1.4087 -0.6618 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3858 0.6310 0.5626 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9330 -2.0648 0.0981 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3540 -0.0250 1.3226 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9030 -0.7813 -0.2243 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6276 -1.3729 1.0903 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2060 -2.7106 -0.7453 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9274 2.4197 -1.9981 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8193 0.1321 -2.1219 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2751 1.5089 -2.2187 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 3.6707 -0.7417 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7753 3.5986 0.2488 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2424 -0.2364 0.2415 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2008 -0.1810 -0.7728 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2867 3.2097 1.5526 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7997 1.8240 1.6573 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9153 1.7733 2.3132 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2067 0.1931 2.1002 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5642 1.0175 0.5127 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8963 2.5252 0.9215 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5757 -1.5722 1.1632 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1016 1.7739 0.1604 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7528 -2.3357 0.4108 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1879 1.6829 0.7531 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1482 -3.1161 -0.0817 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8884 0.5270 2.0916 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0979 -3.7983 -0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4431 -2.3650 -1.7558 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0064 -2.4457 -0.0483 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 2 27 1 0 0 0 0 3 15 2 0 0 0 0 4 26 1 0 0 0 0 4 28 1 0 0 0 0 5 26 2 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 29 1 0 0 0 0 9 11 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 12 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 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 17 1 0 0 0 0 15 18 1 0 0 0 0 16 19 1 0 0 0 0 16 41 1 0 0 0 0 17 20 2 0 0 0 0 17 42 1 0 0 0 0 18 22 2 0 0 0 0 18 23 1 0 0 0 0 19 21 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 26 1 0 0 0 0 22 24 1 0 0 0 0 23 25 2 0 0 0 0 23 45 1 0 0 0 0 24 27 2 0 0 0 0 24 46 1 0 0 0 0 25 27 1 0 0 0 0 25 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 M END $$$$