BTE7I6 -OEChem-04022113553D 38 40 0 0 0 0 0 0 0999 V2000 3.1338 -2.9878 1.8861 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 1.1591 -0.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 2.1614 -1.6421 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1152 -0.7831 0.3888 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 0.6637 0.3889 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6442 1.9200 0.1516 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5042 0.9163 -0.2937 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5863 -0.3775 -0.0729 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6354 2.1930 -0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0240 1.4149 1.5171 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 2.6712 1.2796 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1640 2.4187 1.9624 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4445 -1.6801 0.4053 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5883 -0.0786 -0.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6312 0.1547 -0.4724 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3047 -2.6840 -0.0398 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4485 -1.0824 -1.4411 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7905 1.2781 -0.8805 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3066 -2.3852 -0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8819 0.0532 -0.9381 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8312 -1.8831 0.8334 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6975 -1.0636 -0.5246 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2296 -1.9990 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 0.3330 -1.1739 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0517 3.1644 -0.2895 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4431 2.2165 -1.6628 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9476 1.2311 2.0611 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3127 3.4552 1.6389 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4205 3.0035 2.8409 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6687 -1.9303 1.1251 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7128 0.9316 -1.3789 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1944 -3.6983 0.3325 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2288 -0.8499 -2.1599 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9764 -3.1667 -1.3095 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1602 -0.6597 0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3235 0.7727 -1.6184 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7076 -1.1257 -0.9144 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8459 -2.8362 0.6218 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 2 0 0 0 0 2 9 1 0 0 0 0 2 18 1 0 0 0 0 3 18 2 0 0 0 0 4 15 1 0 0 0 0 4 21 1 0 0 0 0 4 35 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 6 11 1 0 0 0 0 7 24 1 0 0 0 0 8 13 2 0 0 0 0 8 14 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 12 1 0 0 0 0 10 27 1 0 0 0 0 11 12 2 0 0 0 0 11 28 1 0 0 0 0 12 29 1 0 0 0 0 13 16 1 0 0 0 0 13 30 1 0 0 0 0 14 17 2 0 0 0 0 14 31 1 0 0 0 0 15 18 1 0 0 0 0 15 20 2 0 0 0 0 16 19 2 0 0 0 0 16 32 1 0 0 0 0 17 19 1 0 0 0 0 17 33 1 0 0 0 0 19 34 1 0 0 0 0 20 22 1 0 0 0 0 20 36 1 0 0 0 0 21 23 1 0 0 0 0 22 23 2 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 M END $$$$