BTE2I1 -OEChem-04012116332D 28 30 0 0 0 0 0 0 0999 V2000 5.1357 0.7058 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0617 -0.3184 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5357 0.2158 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4075 1.7124 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4781 0.4864 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4781 -1.1231 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6658 -1.3184 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7998 0.1816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5319 0.1816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7998 -0.8184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5319 -0.8184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6658 0.6816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9059 0.7163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9059 -1.3530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 0.2024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0617 -0.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 -0.8392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2678 0.2091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4037 0.7124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6658 1.3016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9130 1.3362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6707 1.0757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6707 -1.7124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9130 -1.9730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.1513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8674 -0.2643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6645 -0.2674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.5279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 18 1 0 0 0 0 2 16 2 0 0 0 0 3 19 1 0 0 0 0 3 28 1 0 0 0 0 4 19 2 0 0 0 0 5 9 1 0 0 0 0 5 16 1 0 0 0 0 5 22 1 0 0 0 0 6 11 1 0 0 0 0 6 16 1 0 0 0 0 6 23 1 0 0 0 0 7 10 2 0 0 0 0 7 11 1 0 0 0 0 8 10 1 0 0 0 0 8 12 2 0 0 0 0 8 13 1 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 10 14 1 0 0 0 0 12 20 1 0 0 0 0 13 15 2 0 0 0 0 13 21 1 0 0 0 0 14 17 2 0 0 0 0 14 24 1 0 0 0 0 15 17 1 0 0 0 0 17 25 1 0 0 0 0 18 19 1 0 0 0 0 18 26 1 0 0 0 0 18 27 1 0 0 0 0 M END $$$$