BTQK89 -OEChem-04022117543D 40 43 0 0 0 0 0 0 0999 V2000 0.7332 -1.8432 0.0493 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4136 0.0369 -0.0014 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0954 -1.8661 0.0504 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5433 -0.6913 -0.6831 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6543 -0.0800 0.7027 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2236 -0.1285 -1.2059 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2149 -0.1095 1.2113 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0603 0.2976 -0.0084 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3797 0.4193 -1.2198 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3711 0.4391 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3404 0.8202 -0.0224 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0098 0.6824 -1.2269 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0013 0.7024 1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0795 0.1842 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5235 0.3926 -0.0103 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1076 1.0983 -0.0296 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0920 -0.8841 0.0243 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8193 -1.2940 0.0345 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3222 1.5201 -0.0402 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4583 -1.0851 0.0303 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7095 1.3394 -0.0347 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2719 0.0493 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4817 -1.7835 -0.6046 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3899 -0.4417 -1.3288 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0049 0.9565 0.6256 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3404 -0.6258 1.3563 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7864 -0.8312 -1.9232 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3811 0.8411 -1.6918 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0639 0.7068 1.9257 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9949 -1.0671 1.6966 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8778 0.3246 -2.1799 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8593 0.3440 2.1612 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4901 0.7769 -2.1767 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4743 0.8091 2.1335 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3551 2.1571 -0.0594 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2897 -2.8601 0.0774 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9001 2.5186 -0.0671 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8902 -2.0790 0.0572 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3643 2.2067 -0.0577 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3530 -0.0626 0.0035 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 2 0 0 0 0 2 6 1 0 0 0 0 2 7 1 0 0 0 0 2 8 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 23 1 0 0 0 0 4 24 1 0 0 0 0 5 7 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 9 12 1 0 0 0 0 9 31 1 0 0 0 0 10 13 2 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 12 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 14 18 1 0 0 0 0 15 17 1 0 0 0 0 15 19 2 0 0 0 0 16 35 1 0 0 0 0 17 20 2 0 0 0 0 19 21 1 0 0 0 0 19 37 1 0 0 0 0 20 22 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 M END $$$$