LEJ2S0 -OEChem-05032300152D 51 54 0 0 0 0 0 0 0999 V2000 13.1229 2.8728 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.1747 -2.8907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -0.8907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0734 2.5622 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1724 3.1835 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5911 -3.6955 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -2.3907 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9017 -1.1355 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 -2.2975 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.8802 -0.9293 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -0.6883 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.4336 3.8233 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 -2.3907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 -3.3907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -2.3907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5911 -2.0860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -1.8907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -3.8907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -1.8907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1747 -2.8907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -2.3907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -3.3907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -1.8907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 -1.8907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 -0.8962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1909 0.0212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8122 1.9223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.5543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1694 0.2275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5231 0.7656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4801 1.1780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8337 1.7161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -1.2707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7837 -4.2848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7133 -1.4158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9162 -1.4158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -4.5107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0502 -2.8657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8472 -2.8657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3759 -3.7007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -3.0107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5402 -2.9039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9389 -0.4814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4847 -3.4277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 -1.6191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0867 1.3058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4197 2.1775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5835 -0.2340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9164 0.6377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0402 3.9512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0195 4.2848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 12 1 0 0 0 0 1 27 1 0 0 0 0 2 20 1 0 0 0 0 2 44 1 0 0 0 0 3 23 2 0 0 0 0 6 14 1 0 0 0 0 6 20 1 0 0 0 0 6 34 1 0 0 0 0 7 19 1 0 0 0 0 7 23 1 0 0 0 0 7 41 1 0 0 0 0 8 10 2 0 0 0 0 8 16 1 0 0 0 0 9 24 1 0 0 0 0 9 28 1 0 0 0 0 9 42 1 0 0 0 0 10 26 1 0 0 0 0 11 25 1 0 0 0 0 11 28 2 0 0 0 0 12 50 1 0 0 0 0 12 51 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 13 17 1 0 0 0 0 14 18 1 0 0 0 0 15 17 2 0 0 0 0 15 22 1 0 0 0 0 15 23 1 0 0 0 0 16 20 2 0 0 0 0 17 33 1 0 0 0 0 18 22 2 0 0 0 0 18 37 1 0 0 0 0 19 21 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 21 24 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 24 25 2 0 0 0 0 25 43 1 0 0 0 0 26 29 2 0 0 0 0 26 30 1 0 0 0 0 27 31 2 0 0 0 0 27 32 1 0 0 0 0 28 45 1 0 0 0 0 29 31 1 0 0 0 0 29 48 1 0 0 0 0 30 32 2 0 0 0 0 30 49 1 0 0 0 0 31 46 1 0 0 0 0 32 47 1 0 0 0 0 M END $$$$