BNLO86 -OEChem-04012113313D 26 27 0 0 0 0 0 0 0999 V2000 0.6328 0.3420 -1.5255 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4135 -2.7587 0.1165 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.3845 -1.9928 -0.2239 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5339 0.1993 0.4570 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5992 0.7130 -0.1029 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6097 -1.8088 -0.0335 N 0 3 0 0 0 0 0 0 0 0 0 0 1.1303 0.3804 0.8316 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2518 0.6160 -0.1473 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1786 0.4410 -0.3695 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1049 -0.4757 0.0137 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7619 1.9133 -0.0965 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1604 -0.9908 0.3023 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4169 1.1959 0.2087 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4682 -0.2702 0.2251 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1252 2.1188 0.1151 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9783 1.0271 0.2759 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4459 -0.6497 -0.0469 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8595 -0.4454 1.4964 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0654 1.3219 1.3879 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1073 2.7724 -0.2201 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6714 -1.9445 0.4434 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1601 2.2450 0.2641 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1661 -1.0934 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5225 3.1289 0.1548 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0398 1.1877 0.4406 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2688 -1.3161 -0.2608 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 2 0 0 0 0 2 6 1 0 0 0 0 3 6 2 0 0 0 0 4 7 1 0 0 0 0 4 12 1 0 0 0 0 4 13 1 0 0 0 0 5 13 2 0 0 0 0 5 17 1 0 0 0 0 6 10 1 0 0 0 0 7 9 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 2 0 0 0 0 10 14 2 0 0 0 0 11 15 1 0 0 0 0 11 20 1 0 0 0 0 12 17 2 0 0 0 0 12 21 1 0 0 0 0 13 22 1 0 0 0 0 14 16 1 0 0 0 0 14 23 1 0 0 0 0 15 16 2 0 0 0 0 15 24 1 0 0 0 0 16 25 1 0 0 0 0 17 26 1 0 0 0 0 M CHG 2 2 -1 6 1 M END $$$$