L8J3EW -OEChem-05022323563D 52 55 0 1 0 0 0 0 0999 V2000 5.8917 0.7406 0.5450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 0.7553 0.7905 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9548 1.0755 -2.4706 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4288 -1.4760 -0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9618 1.3397 0.1662 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7652 -0.7038 0.3714 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7758 0.0954 1.7713 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3769 1.3367 1.8349 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4093 -2.4854 -0.4127 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7090 -1.7850 -0.2198 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4970 -0.4952 0.2535 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0524 -0.2830 0.3948 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1992 1.7933 -0.9712 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9425 -1.7007 -0.0247 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9930 -2.2468 -0.4437 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5335 0.3791 0.5213 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8324 -0.0801 0.2977 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9314 0.1169 0.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0903 -0.9692 0.3362 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0606 -1.3826 -0.1812 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1049 2.1716 -2.1511 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3801 -2.9440 -0.4519 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2859 2.9624 -0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6285 -2.1781 -0.0744 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8762 2.0679 0.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7503 -3.1792 -0.4743 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9495 1.9621 -0.1888 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8987 3.1322 0.7819 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2152 1.9801 -1.0322 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2641 -2.7447 -1.4663 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3412 -3.3588 0.2439 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5693 0.9669 -1.3125 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1734 -3.2504 -0.8128 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3366 1.3760 0.8982 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0782 -1.7258 -0.3511 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5040 2.4129 -3.0343 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7358 3.0354 -1.9145 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7232 -3.7450 -0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8591 3.8494 -0.3009 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6364 2.6944 0.2485 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6460 3.2399 -1.4363 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6993 -2.3533 -0.0903 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1356 3.0922 0.6376 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0992 2.0524 -0.8785 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1337 -4.1404 -0.8031 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9794 3.1077 1.3756 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9448 4.0894 0.2535 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7313 3.0850 1.4925 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2244 1.1323 -1.7258 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2964 2.9052 -1.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1061 1.8808 -0.4024 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5061 1.3524 -3.2222 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 27 1 0 0 0 0 2 12 2 0 0 0 0 3 21 1 0 0 0 0 3 52 1 0 0 0 0 4 9 1 0 0 0 0 4 12 1 0 0 0 0 4 14 1 0 0 0 0 5 13 1 0 0 0 0 5 18 1 0 0 0 0 5 25 1 0 0 0 0 6 14 1 0 0 0 0 6 19 2 0 0 0 0 7 8 1 0 0 0 0 7 18 2 0 0 0 0 8 25 2 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 13 21 1 0 0 0 0 13 23 1 0 0 0 0 13 32 1 0 0 0 0 14 22 2 0 0 0 0 15 20 2 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 19 24 1 0 0 0 0 20 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 26 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 26 2 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 44 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 M END $$$$