B1SKE2 -OEChem-04012114413D 49 53 0 1 0 0 0 0 0999 V2000 -6.6782 -3.1068 0.9164 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6522 -0.8640 -0.1565 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.8372 0.0797 -1.5325 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8328 2.7057 -1.8709 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8694 1.3902 0.8864 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0655 2.1663 0.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2375 -0.1429 2.0809 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4926 -0.7564 -2.4292 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0334 -2.5576 -2.1583 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1374 -1.1524 -0.3488 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9725 -2.6410 1.1460 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1863 2.8799 0.1630 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6729 3.3106 1.5406 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3179 1.9759 -0.3362 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3705 2.0626 2.0836 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7608 0.3387 0.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1942 -0.2544 -0.2641 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9817 2.1403 -0.7908 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0867 -1.3108 -0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2102 1.3391 -0.5542 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5827 -1.8134 0.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1137 -1.1798 2.0553 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2303 -1.5755 -1.6727 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1574 -0.0241 -0.2634 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4423 1.9882 -0.6328 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3368 -0.7382 -0.0514 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6218 1.2742 -0.4206 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5689 -0.0890 -0.1299 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7927 -0.8291 0.0883 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9788 -0.4842 -0.5267 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8497 -1.9271 0.9222 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0636 -2.2048 0.4882 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0499 3.7399 -0.5012 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4074 4.1187 1.4345 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 3.6592 2.2046 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9091 1.2298 -1.0246 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0876 2.5723 -0.8395 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6616 1.4133 2.6095 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1770 2.3402 2.7706 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2602 1.6309 1.0916 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4446 -1.5026 3.0391 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4976 3.0516 -0.8519 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2702 -1.8049 0.1496 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5585 1.8229 -0.4673 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5841 -3.1667 -1.5609 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1235 -2.7328 -3.1541 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0633 0.3426 -1.2245 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9936 -2.2868 1.4839 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9796 -2.7597 0.6495 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 2 24 1 0 0 0 0 3 8 1 0 0 0 0 3 17 1 0 0 0 0 4 18 2 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 5 16 1 0 0 0 0 6 12 1 0 0 0 0 6 18 1 0 0 0 0 6 40 1 0 0 0 0 7 16 2 0 0 0 0 7 22 1 0 0 0 0 8 23 2 0 0 0 0 9 23 1 0 0 0 0 9 45 1 0 0 0 0 9 46 1 0 0 0 0 10 30 2 0 0 0 0 10 32 1 0 0 0 0 11 31 1 0 0 0 0 11 32 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 33 1 0 0 0 0 13 15 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 17 19 2 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 19 23 1 0 0 0 0 20 24 2 0 0 0 0 20 25 1 0 0 0 0 21 22 2 0 0 0 0 22 41 1 0 0 0 0 24 26 1 0 0 0 0 25 27 2 0 0 0 0 25 42 1 0 0 0 0 26 28 2 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 30 47 1 0 0 0 0 31 48 1 0 0 0 0 32 49 1 0 0 0 0 M END $$$$