LB30CQ -OEChem-05022322323D 45 47 0 0 0 0 0 0 0999 V2000 -7.8368 -2.6680 0.4188 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0829 5.1217 -0.1402 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 3.4265 -0.1519 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9989 0.8081 0.5789 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7414 0.3413 -0.6839 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7793 1.6625 0.2886 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5226 0.9515 0.2149 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0190 -0.4132 -0.4077 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9656 -0.3884 0.0779 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2664 0.7371 1.3754 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0003 0.4961 -1.0139 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4879 0.0672 1.3069 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2218 -0.1739 -1.0823 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7622 3.0030 0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2316 -1.0853 0.0072 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9915 -1.7999 -0.2592 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2270 0.2759 -0.3007 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1719 -2.4975 -0.0038 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4075 -0.4217 -0.0452 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4112 -0.3690 -0.1952 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2725 -2.4729 0.1416 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3801 -1.8084 0.1032 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 3.8206 -0.0635 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6320 -1.0406 -0.2634 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4930 -3.1446 0.0735 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6729 -2.4283 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7198 -0.0592 1.1914 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6896 1.3915 1.2032 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0791 -0.2904 -1.2906 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9731 1.2070 -1.3192 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9066 1.0853 2.3405 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4321 0.6557 -1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0550 -0.0921 2.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5794 -0.5226 -2.0483 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7028 3.5443 0.2236 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0559 -2.3471 -0.3384 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2605 1.3564 -0.4124 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1354 -3.5779 0.1102 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3415 0.1285 0.0362 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3972 0.7132 -0.3019 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3622 -3.0466 0.2999 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5506 -0.4831 -0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5251 -4.2251 0.1781 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6233 -2.9513 -0.1821 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8521 5.7143 -0.2799 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 2 23 1 0 0 0 0 2 45 1 0 0 0 0 3 23 2 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 8 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 14 2 0 0 0 0 7 10 2 0 0 0 0 7 11 1 0 0 0 0 8 16 2 0 0 0 0 8 17 1 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 9 15 1 0 0 0 0 10 12 1 0 0 0 0 10 31 1 0 0 0 0 11 13 2 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 13 34 1 0 0 0 0 14 23 1 0 0 0 0 14 35 1 0 0 0 0 15 20 2 0 0 0 0 15 21 1 0 0 0 0 16 18 1 0 0 0 0 16 36 1 0 0 0 0 17 19 2 0 0 0 0 17 37 1 0 0 0 0 18 22 2 0 0 0 0 18 38 1 0 0 0 0 19 22 1 0 0 0 0 19 39 1 0 0 0 0 20 24 1 0 0 0 0 20 40 1 0 0 0 0 21 25 2 0 0 0 0 21 41 1 0 0 0 0 24 26 2 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 M END $$$$