B2R1KP -OEChem-04022110353D 40 42 0 1 0 0 0 0 0999 V2000 2.5048 2.2624 1.6264 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1766 -1.0405 0.1712 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -2.9797 0.9926 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6021 0.5021 -0.5336 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0802 -1.3736 0.0218 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3359 0.7955 -0.0238 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2725 -0.1270 -0.7318 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7727 -0.0827 -1.0378 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9987 1.1309 0.1006 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2203 -1.5404 -0.9088 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3309 -2.0916 0.1936 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3465 1.4801 0.6988 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5112 2.2869 -0.7636 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1364 -1.8884 0.4437 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6933 1.0624 0.0684 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4761 -1.4934 0.5661 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4912 -0.4520 0.1963 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8177 0.5564 1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1081 -0.4922 -1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7613 1.5246 0.7594 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0516 0.4760 -1.3976 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3782 1.4843 -0.4909 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6535 -0.1936 -1.6335 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0078 0.3383 -2.0211 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 0.9483 0.9155 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2806 -1.6795 -0.6852 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -2.0655 -1.8468 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1844 -3.1732 0.1245 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7216 -1.8484 1.1877 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2246 2.5273 -1.5597 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3783 3.1916 -0.1604 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4506 2.0444 -1.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9072 1.8413 0.8187 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4931 -1.6705 1.6487 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7064 -2.4411 0.0638 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3419 0.5998 2.0792 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8604 -1.2715 -1.7698 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0151 2.3102 1.4651 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5316 0.4451 -2.3715 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1126 2.2384 -0.7585 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 2 14 1 0 0 0 0 2 16 1 0 0 0 0 3 14 2 0 0 0 0 4 15 2 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 5 14 1 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 6 15 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 23 1 0 0 0 0 8 10 1 0 0 0 0 8 24 1 0 0 0 0 9 12 1 0 0 0 0 9 13 1 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 18 36 1 0 0 0 0 19 21 2 0 0 0 0 19 37 1 0 0 0 0 20 22 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 M END $$$$