BA8EQ3 -OEChem-04022104383D 30 31 0 1 0 0 0 0 0999 V2000 1.2831 1.3166 -0.1566 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8148 -2.1279 -0.1401 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0441 0.0756 0.2301 N 0 0 1 0 0 0 0 0 0 0 0 0 2.1065 0.1834 -0.2963 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0927 -1.5134 0.4648 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0248 -0.5833 0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4086 -1.1689 -0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0928 1.6767 0.3525 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4037 1.2779 -0.3355 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0497 0.7476 0.1307 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4114 -0.9780 -0.0995 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4632 0.0633 -0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4942 0.4374 -0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3206 0.5931 0.6579 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8055 -2.5239 0.1479 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2528 -1.5707 1.5488 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2691 -1.1550 -1.3316 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0826 -2.0113 -0.0338 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2535 1.7993 1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8136 2.6691 -0.0252 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0782 2.1345 -0.1986 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2571 1.1785 -1.4196 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9766 -0.7957 0.2957 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5980 0.0223 -1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9740 0.9552 0.2293 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8735 -0.4211 -1.1665 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5622 1.3303 -1.2313 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9637 1.4362 1.2586 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2630 -0.3061 1.2803 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3710 0.7703 0.4075 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 10 1 0 0 0 0 2 11 2 0 0 0 0 3 7 1 0 0 0 0 3 9 1 0 0 0 0 3 12 1 0 0 0 0 4 11 1 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 15 1 0 0 0 0 5 16 1 0 0 0 0 6 10 2 0 0 0 0 6 11 1 0 0 0 0 7 17 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 M END $$$$