BTP87R -OEChem-04022105093D 42 45 0 0 0 0 0 0 0999 V2000 4.1061 2.5523 0.0635 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1486 -0.0988 0.9168 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2803 1.1978 -0.5585 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7893 -0.5452 -0.3331 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9259 -0.4758 -1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9926 0.0310 -0.3306 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4767 0.2560 0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4469 -1.0013 -0.8052 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8235 -0.8829 -2.4859 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6192 -1.0699 0.0357 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5231 -1.3988 -2.1427 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2749 -0.0004 2.0704 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3530 0.3191 -0.5688 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2523 0.7548 1.9987 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 -1.3414 -2.9725 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4985 0.0075 0.1431 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1410 0.8191 0.4738 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5968 1.0327 1.7379 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8644 -2.2439 0.7481 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6231 -0.0890 0.9627 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9890 -2.3404 1.5677 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8683 -1.2629 1.6749 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0647 2.3564 -0.5547 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4850 3.4238 -1.4486 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6857 -0.8438 -3.1456 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4622 -1.7605 -2.5573 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0883 -0.9955 2.3275 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8158 0.3797 2.9378 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5244 0.7078 1.8521 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7920 0.1575 -1.5493 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8527 0.9300 2.9909 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5119 -1.6554 -4.0096 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1892 1.0423 0.2936 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2264 1.4215 2.5342 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1901 -3.0943 0.6775 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3533 0.6939 1.1049 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1798 -3.2542 2.1226 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4486 1.2269 -1.1425 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7433 -1.3395 2.3139 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4641 3.6585 -1.1341 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0921 4.3311 -1.3842 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4771 3.0730 -2.4843 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 2 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 2 12 1 0 0 0 0 3 16 1 0 0 0 0 3 23 1 0 0 0 0 3 38 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 13 2 0 0 0 0 7 14 2 0 0 0 0 8 10 1 0 0 0 0 8 11 2 0 0 0 0 9 15 2 0 0 0 0 9 25 1 0 0 0 0 10 16 1 0 0 0 0 10 19 2 0 0 0 0 11 15 1 0 0 0 0 11 26 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 17 1 0 0 0 0 13 30 1 0 0 0 0 14 18 1 0 0 0 0 14 31 1 0 0 0 0 15 32 1 0 0 0 0 16 20 2 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 19 21 1 0 0 0 0 19 35 1 0 0 0 0 20 22 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 M END $$$$