BHR7P6 -OEChem-04022112543D 39 41 0 0 0 0 0 0 0999 V2000 -2.0045 3.1514 0.3346 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2259 -0.1344 -0.5656 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2423 3.4912 0.3789 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2396 2.7817 0.2829 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2235 -0.6890 1.7086 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2332 -0.7125 -0.6150 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8977 0.9866 -0.1755 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1167 -1.8301 -0.8705 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1463 -0.7645 -0.6501 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6171 0.5527 -0.3019 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6227 0.5197 -0.3469 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5193 1.3386 -0.1296 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6898 -2.4064 0.4262 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5867 -3.6124 0.1473 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9992 -1.8398 -0.9247 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0161 0.7318 -0.3181 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6982 2.7234 0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8782 -0.3364 -0.5913 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3756 -1.6010 -0.8897 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1273 -4.2145 1.4344 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1041 2.3212 0.1517 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8135 -0.3521 0.6906 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2909 -0.1051 0.6146 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9201 -1.4723 -1.5254 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5754 -2.5960 -1.4336 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2616 -1.6424 0.9661 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8672 -2.7066 1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4254 -3.3116 -0.4913 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0223 -4.3786 -0.3969 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -2.8315 -1.1533 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4196 1.7140 -0.0873 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6789 0.3556 -0.3168 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0586 -2.4212 -1.0994 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3123 -4.5557 2.0806 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7231 -3.4829 1.9895 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7667 -5.0744 1.2114 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7424 -0.7874 -0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7405 -0.2891 1.5944 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4771 0.9343 0.3335 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 21 1 0 0 0 0 2 18 1 0 0 0 0 2 22 1 0 0 0 0 3 17 2 0 0 0 0 4 21 2 0 0 0 0 5 22 2 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 7 10 1 0 0 0 0 7 21 1 0 0 0 0 7 32 1 0 0 0 0 8 13 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 11 2 0 0 0 0 9 15 1 0 0 0 0 10 12 2 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 17 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 20 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 15 19 2 0 0 0 0 15 30 1 0 0 0 0 16 18 2 0 0 0 0 16 31 1 0 0 0 0 18 19 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 22 23 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 M END $$$$