BTO21Q -OEChem-04012117032D 34 37 0 0 0 0 0 0 0999 V2000 5.3923 -1.9455 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.3987 -1.2798 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5274 1.3255 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0321 0.4130 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.2013 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9641 1.0480 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0274 -0.2133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3364 0.7377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0274 -0.2133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7183 0.7377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3518 0.9700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7123 -0.9981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0547 0.2013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7328 -0.7894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3424 -0.9981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7029 0.9700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3219 -0.7894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7040 -0.3276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6814 -0.1159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3534 -0.8565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9867 0.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3307 -0.6448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6361 0.3074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5274 1.9455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5365 1.5618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1459 -1.2517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5408 -1.5855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5182 1.5618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2214 1.0034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9088 -1.2517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1641 -1.4469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5701 1.2955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7473 -1.1040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2420 0.4387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 2 18 2 0 0 0 0 3 8 1 0 0 0 0 3 10 1 0 0 0 0 3 24 1 0 0 0 0 4 13 1 0 0 0 0 4 18 1 0 0 0 0 4 29 1 0 0 0 0 5 16 2 0 0 0 0 5 17 1 0 0 0 0 6 21 1 0 0 0 0 6 23 2 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 8 11 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 16 1 0 0 0 0 11 13 2 0 0 0 0 11 25 1 0 0 0 0 12 14 2 0 0 0 0 13 14 1 0 0 0 0 14 26 1 0 0 0 0 15 17 2 0 0 0 0 15 27 1 0 0 0 0 16 28 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 20 22 2 0 0 0 0 20 31 1 0 0 0 0 21 32 1 0 0 0 0 22 23 1 0 0 0 0 22 33 1 0 0 0 0 23 34 1 0 0 0 0 M END $$$$