BXQ6V5 -OEChem-04022115173D 40 43 0 1 0 0 0 0 0999 V2000 4.9275 -1.2390 -1.1601 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.2923 -1.8226 -1.9380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9712 -0.7991 1.3030 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0862 -0.0651 -0.3713 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4426 -0.5561 -0.5100 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8011 -1.8159 1.0940 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2463 0.4292 -0.6427 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9207 0.5298 0.6657 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1611 -0.2916 0.5732 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0324 -1.2584 -0.4251 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7051 -1.1193 -1.0343 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3755 1.9054 -0.3441 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2411 -0.3945 0.1754 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3257 -0.2020 1.3117 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0360 -2.1585 -0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0768 2.8450 -1.3309 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7932 2.3281 0.9177 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3581 -1.1020 1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2141 -2.0714 0.0171 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1959 4.2074 -1.0557 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9123 3.6903 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6137 4.6300 0.2062 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6099 -1.2180 -0.0609 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8429 -2.1193 -0.0076 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0818 -2.3324 1.1226 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4496 0.2444 -1.7059 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1433 1.5739 0.4296 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4431 0.4201 1.6429 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4423 0.5430 2.0911 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9228 -2.9043 -1.5041 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2516 2.5277 -2.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 1.6365 1.7216 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2849 -1.0532 1.5928 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0311 -2.7591 -0.1846 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5328 -0.1581 -1.4414 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0374 4.9390 -1.8237 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2337 4.0201 2.1767 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7054 5.6906 0.4209 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8592 -2.4291 -0.2046 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4166 -2.8629 2.0037 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 11 2 0 0 0 0 3 13 2 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 4 11 1 0 0 0 0 5 13 1 0 0 0 0 5 23 1 0 0 0 0 5 35 1 0 0 0 0 6 23 2 0 0 0 0 6 25 1 0 0 0 0 7 12 1 0 0 0 0 7 13 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 12 16 2 0 0 0 0 12 17 1 0 0 0 0 14 18 1 0 0 0 0 14 29 1 0 0 0 0 15 19 1 0 0 0 0 15 30 1 0 0 0 0 16 20 1 0 0 0 0 16 31 1 0 0 0 0 17 21 2 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 33 1 0 0 0 0 19 34 1 0 0 0 0 20 22 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 M END $$$$