BT2O1V -OEChem-04012114083D 26 28 0 0 0 0 0 0 0999 V2000 -0.9980 2.7175 -0.0023 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.2944 -1.2077 -0.0684 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8475 1.4573 0.0314 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1898 -2.8910 0.0384 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6763 -1.1550 0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9876 -0.7029 -0.0197 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4499 0.2141 0.0029 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 0.8763 -0.0026 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5033 1.0982 0.0034 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1205 0.2894 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 2.2482 -0.0069 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8884 0.6907 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9749 -1.6776 0.0174 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7564 0.0105 1.2048 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7523 0.0025 -1.2111 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0301 -0.5581 1.2046 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0261 -0.5661 -1.2114 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6649 -0.8463 -0.0036 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1248 -1.7785 0.0251 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 3.0082 -0.0114 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2749 0.2283 2.1552 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2676 0.2141 -2.1614 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5276 -0.7766 2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5204 -0.7908 -2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6566 -1.2891 -0.0038 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4912 -1.2818 0.8812 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 11 1 0 0 0 0 2 6 1 0 0 0 0 2 26 1 0 0 0 0 3 12 2 0 0 0 0 4 13 2 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 5 19 1 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 8 10 1 0 0 0 0 8 11 2 0 0 0 0 9 12 1 0 0 0 0 10 14 2 0 0 0 0 10 15 1 0 0 0 0 11 20 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 15 17 2 0 0 0 0 15 22 1 0 0 0 0 16 18 2 0 0 0 0 16 23 1 0 0 0 0 17 18 1 0 0 0 0 17 24 1 0 0 0 0 18 25 1 0 0 0 0 M END $$$$