B0GWI3 -OEChem-04012116502D 49 52 0 1 0 0 0 0 0999 V2000 8.1852 -1.9212 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 -1.3334 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6651 -2.8779 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7818 -1.3880 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 0.1666 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 1.6666 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 1.6666 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 -1.3334 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.8032 -1.9212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4942 -2.8722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 -0.3334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4942 -2.8722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 -0.3334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 0.1666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 1.1666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 1.1666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5022 -0.3681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5022 1.7013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5961 1.1874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5961 0.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5138 -1.3680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.6908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6536 -1.8780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 1.1941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7359 2.6908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.6974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8718 3.1941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0038 2.6974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4418 -1.0519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3696 -2.1734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1132 -1.3842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4294 -3.4888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1007 -3.0011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6048 -0.4411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2063 0.2492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8878 -3.0011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5590 -3.4888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5094 2.3212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0604 -0.1663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7325 -1.9481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1230 -1.2533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 2.2866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5312 1.3566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8617 0.5741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2740 2.9987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4619 1.3895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8742 3.8141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4681 3.0095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1318 -3.1941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 12 1 0 0 0 0 2 13 2 0 0 0 0 3 23 1 0 0 0 0 3 49 1 0 0 0 0 4 23 2 0 0 0 0 5 11 1 0 0 0 0 5 13 1 0 0 0 0 5 15 1 0 0 0 0 6 15 2 0 0 0 0 6 16 1 0 0 0 0 7 15 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 29 1 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 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 14 16 1 0 0 0 0 14 17 2 0 0 0 0 16 18 2 0 0 0 0 17 20 1 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 39 1 0 0 0 0 21 23 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 24 26 1 0 0 0 0 24 44 1 0 0 0 0 25 27 2 0 0 0 0 25 45 1 0 0 0 0 26 28 2 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 M END $$$$