B2CME9 -OEChem-04022101543D 41 44 0 0 0 0 0 0 0999 V2000 -5.8452 -0.9672 -1.7338 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3112 1.1066 0.7870 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3571 0.4046 0.1084 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4327 -1.1012 0.8984 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9764 -2.3255 0.4836 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1322 -0.0882 0.3645 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9437 -1.4652 0.5532 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2146 0.2133 0.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3805 -0.4674 0.0417 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0319 0.7552 0.4468 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6774 0.9567 0.4985 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6765 0.0980 -0.2337 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 -1.8998 0.8131 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1929 -1.8124 0.2265 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0878 0.0583 -0.4864 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6241 1.7060 1.1974 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4447 -0.0909 -0.7725 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7159 -0.0620 0.6827 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8921 0.8052 -1.4164 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9811 1.5566 0.9113 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3914 0.6582 -0.0738 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9710 0.4853 0.4163 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1472 1.3526 -1.6828 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1866 1.1926 -0.7664 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2478 -1.0695 -1.9754 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1549 1.8257 0.3026 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0853 1.9691 1.2754 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5539 -2.9552 0.9679 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9993 -2.5348 0.1735 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3639 -0.5252 -1.0499 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3179 2.4089 1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5676 -0.6054 1.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0951 0.9377 -2.1444 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7175 2.1402 1.4561 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4604 0.5921 -0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7802 0.3619 1.1302 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3155 1.9027 -2.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1637 1.6189 -0.9738 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3857 -1.8107 -2.7694 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6625 -0.1252 -2.3442 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7818 -1.4417 -1.0945 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 25 1 0 0 0 0 2 8 1 0 0 0 0 2 11 1 0 0 0 0 2 27 1 0 0 0 0 3 6 1 0 0 0 0 3 9 2 0 0 0 0 4 8 2 0 0 0 0 4 13 1 0 0 0 0 5 7 1 0 0 0 0 5 14 2 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 7 13 2 0 0 0 0 8 10 1 0 0 0 0 9 12 1 0 0 0 0 9 14 1 0 0 0 0 10 26 1 0 0 0 0 11 15 2 0 0 0 0 11 16 1 0 0 0 0 12 18 2 0 0 0 0 12 19 1 0 0 0 0 13 28 1 0 0 0 0 14 29 1 0 0 0 0 15 17 1 0 0 0 0 15 30 1 0 0 0 0 16 20 2 0 0 0 0 16 31 1 0 0 0 0 17 21 2 0 0 0 0 18 22 1 0 0 0 0 18 32 1 0 0 0 0 19 23 2 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 22 24 2 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 M END $$$$