BUP8Y5 -OEChem-04012112393D 32 34 0 0 0 0 0 0 0999 V2000 -0.0556 0.6059 0.0025 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3254 2.6561 0.0028 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6664 -3.1378 -0.0083 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1365 -0.9967 -0.0036 O 0 5 0 0 0 0 0 0 0 0 0 0 -6.3092 1.1918 0.0006 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8795 0.6374 -1.1016 O 0 5 0 0 0 0 0 0 0 0 0 0 6.8856 0.6257 1.0935 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6191 0.1452 -0.0012 N 0 3 0 0 0 0 0 0 0 0 0 0 6.2853 0.5183 -0.0030 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0346 -0.8033 -0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4186 0.4476 0.0019 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7375 -0.5303 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1447 -0.2652 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1928 -2.0100 -0.0032 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4277 -0.9043 -0.0014 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2675 -1.7876 -0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1943 1.6070 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2012 0.2571 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5861 1.5100 0.0022 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8307 -0.1281 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8374 -0.1416 1.2109 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2013 0.1310 -1.2073 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2080 0.1178 1.2086 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8900 0.2542 -0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8876 -1.8893 -0.0033 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 -2.6590 -0.0023 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7170 2.5836 0.0045 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3089 -0.2198 -2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3206 -0.2440 2.1625 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6997 0.2314 -2.1681 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7116 0.2075 2.1678 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2066 2.4935 0.3724 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 2 19 1 0 0 0 0 2 32 1 0 0 0 0 3 14 2 0 0 0 0 4 8 1 0 0 0 0 5 8 2 0 0 0 0 6 9 1 0 0 0 0 7 9 2 0 0 0 0 8 18 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 15 2 0 0 0 0 11 17 2 0 0 0 0 12 13 1 0 0 0 0 12 16 2 0 0 0 0 13 20 2 0 0 0 0 13 21 1 0 0 0 0 14 16 1 0 0 0 0 15 18 1 0 0 0 0 15 25 1 0 0 0 0 16 26 1 0 0 0 0 17 19 1 0 0 0 0 17 27 1 0 0 0 0 18 19 2 0 0 0 0 20 22 1 0 0 0 0 20 28 1 0 0 0 0 21 23 2 0 0 0 0 21 29 1 0 0 0 0 22 24 2 0 0 0 0 22 30 1 0 0 0 0 23 24 1 0 0 0 0 23 31 1 0 0 0 0 M CHG 4 4 -1 6 -1 8 1 9 1 M END $$$$