B1JX9O -OEChem-04022115133D 37 37 0 1 0 0 0 0 0999 V2000 0.3890 -1.7237 -0.3572 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7691 -2.2719 0.9308 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0999 -2.6081 -1.4697 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6824 0.7825 1.6179 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2021 -0.1386 -0.3890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5471 -0.5829 -0.8501 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0173 3.0027 0.1385 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0402 -0.7112 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9044 0.5413 0.0459 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6474 -0.6468 1.1362 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5631 0.0202 -1.1844 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3002 0.8807 0.2576 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7773 0.1493 1.3239 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6931 0.8161 -0.9966 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6054 1.8588 -0.6698 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1162 -1.4179 2.3005 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9415 -0.0248 -2.5424 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3709 0.3427 0.3694 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5089 1.7315 0.4568 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3385 0.4711 0.9817 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8942 -0.5588 -1.8162 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2545 0.2061 2.2994 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1047 1.3910 -1.8229 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 1.9029 -1.6286 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 1.9523 -0.8806 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1527 -2.4984 2.1301 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1358 -1.0531 2.6214 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7617 -1.2643 3.1761 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0568 0.4091 -2.5719 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9359 -1.0358 -2.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5326 0.5676 -3.2528 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2113 2.7467 0.7374 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1114 1.7815 -0.4566 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1540 1.3254 1.2433 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7534 3.8648 -0.3369 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5103 2.9967 1.0227 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6343 0.6598 1.8211 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 6 1 0 0 0 0 1 8 1 0 0 0 0 4 18 1 0 0 0 0 4 37 1 0 0 0 0 5 18 2 0 0 0 0 6 9 1 0 0 0 0 6 21 1 0 0 0 0 7 15 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 9 15 1 0 0 0 0 9 18 1 0 0 0 0 9 20 1 0 0 0 0 10 13 1 0 0 0 0 10 16 1 0 0 0 0 11 14 2 0 0 0 0 11 17 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 13 22 1 0 0 0 0 14 23 1 0 0 0 0 15 24 1 0 0 0 0 15 25 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 M END $$$$