LER4U8 -OEChem-05022323333D 50 53 0 0 0 0 0 0 0999 V2000 0.8829 3.5680 -0.9595 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1156 -2.2082 -1.3404 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2577 -2.8784 1.4621 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2712 -0.1318 -1.9426 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6597 -1.7608 -0.4674 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9047 0.0659 -1.3027 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9226 -0.6740 -2.5086 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4068 1.3351 -1.9924 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4898 -0.3226 -0.7888 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2469 -0.9818 -1.3729 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4724 -1.3387 -0.2021 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9076 -0.7575 -1.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2181 1.9982 -0.7991 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7000 -0.6673 0.3576 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7840 -0.0806 -0.2135 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6105 -1.0720 0.7639 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4600 -1.9932 0.6393 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3484 1.5100 0.4824 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7258 -0.2605 1.6916 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8106 -0.4527 -0.4585 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8713 0.7920 -0.0984 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5013 -1.1922 1.8344 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0024 2.4372 1.3441 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3472 3.5985 0.6884 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8624 0.3608 2.2096 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9470 0.1686 0.0593 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7642 0.6763 0.9689 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5790 -0.3138 1.9328 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9730 0.5753 1.3934 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7351 -1.6805 -2.8977 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3019 -0.0495 -3.3227 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4624 1.6167 -2.0324 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 1.6903 -2.9293 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1990 0.3944 -0.0168 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9948 0.2248 -1.5932 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9836 -1.9257 0.5865 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7696 -2.0672 -0.9678 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8625 -2.3749 -0.6039 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 0.5384 0.8091 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8659 -0.4204 2.3367 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8017 -0.7634 -1.4998 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0294 1.5705 -0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3721 -1.9575 2.5943 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2114 2.2602 2.3911 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8506 4.4629 1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6047 1.3598 1.0482 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8824 0.6780 3.2481 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8116 0.3362 -0.5763 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2756 -0.4005 2.7616 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8578 1.0592 1.7964 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 24 1 0 0 0 0 2 10 2 0 0 0 0 3 17 2 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 4 10 1 0 0 0 0 5 12 1 0 0 0 0 5 17 1 0 0 0 0 5 38 1 0 0 0 0 6 12 2 0 0 0 0 6 15 1 0 0 0 0 7 12 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 13 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 11 14 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 13 18 2 0 0 0 0 14 19 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 21 2 0 0 0 0 16 17 1 0 0 0 0 16 22 2 0 0 0 0 18 23 1 0 0 0 0 18 39 1 0 0 0 0 19 25 1 0 0 0 0 19 40 1 0 0 0 0 20 26 2 0 0 0 0 20 41 1 0 0 0 0 21 27 1 0 0 0 0 21 42 1 0 0 0 0 22 28 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 45 1 0 0 0 0 25 29 2 0 0 0 0 25 47 1 0 0 0 0 26 29 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 46 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 M END $$$$