B0J4RS -OEChem-04022115193D 52 53 0 1 0 0 0 0 0999 V2000 1.6434 -1.9953 -0.0647 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2226 -0.0330 1.3859 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8577 -2.5805 -1.3751 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8455 -2.7886 1.1331 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5632 2.7867 -0.3746 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7535 1.6630 0.4063 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5384 -0.5272 0.0712 N 0 0 2 0 0 0 0 0 0 0 0 0 2.3607 0.4884 -0.9926 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7122 0.7908 -1.6671 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5237 1.5495 -2.9866 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4897 -0.5017 -1.9437 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7842 1.6805 -0.2543 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -1.4014 -0.0554 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3425 0.7125 1.8456 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6516 -1.0723 -1.2559 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7061 -1.2618 1.1521 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4289 -0.2477 2.3053 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8990 1.6438 2.9636 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6495 -0.4643 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9654 -0.6037 -1.2486 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0198 -0.7933 1.1594 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0118 0.0228 -0.0339 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2626 1.3910 0.0683 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0744 -0.8757 -0.1294 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5760 1.8609 0.0751 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3877 -0.4060 -0.1227 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6385 0.9624 -0.0203 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6466 0.1827 -1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3577 1.3999 -1.0239 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9927 2.4949 -2.8438 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4934 1.7826 -3.4397 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9539 0.9519 -3.7068 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4232 -0.2795 -2.4734 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7686 -1.0214 -1.0223 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9124 -1.1880 -2.5718 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8023 1.3355 1.0784 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1466 -1.1812 -2.2112 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2332 -1.5080 2.0986 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7853 -0.8738 1.4813 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2876 0.2922 2.7168 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0459 -0.9285 3.0737 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1384 2.3479 2.6127 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7417 2.2177 3.3615 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4456 1.0766 3.7841 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4422 -0.3533 -2.1934 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5382 -0.6890 2.1096 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1941 3.5491 0.1202 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4458 2.1051 0.1435 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8966 -1.9456 -0.2097 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7713 2.9263 0.1546 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2152 -1.1055 -0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6612 1.3281 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 7 1 0 0 0 0 1 13 1 0 0 0 0 2 7 1 0 0 0 0 2 14 1 0 0 0 0 5 12 1 0 0 0 0 5 47 1 0 0 0 0 6 12 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 29 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 14 17 1 0 0 0 0 14 18 1 0 0 0 0 14 36 1 0 0 0 0 15 20 1 0 0 0 0 15 37 1 0 0 0 0 16 21 2 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 23 25 1 0 0 0 0 23 48 1 0 0 0 0 24 26 2 0 0 0 0 24 49 1 0 0 0 0 25 27 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 M END $$$$