BA4WQ8 -OEChem-04042102253D 31 32 0 1 0 0 0 0 0999 V2000 -3.2449 -0.1460 0.4617 N 0 0 2 0 0 0 0 0 0 0 0 0 -1.9029 1.7820 -0.3142 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8514 0.8541 -0.9217 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2877 1.1246 -0.2792 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2925 -1.0882 -0.1521 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 -0.4928 -0.2526 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5791 -0.7411 0.5358 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1815 -1.1044 0.2313 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5053 -0.5648 0.1729 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3319 -0.8008 -0.9408 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0135 0.2153 1.2279 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6226 -0.2750 -0.9978 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 0.7412 1.1708 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1087 0.4960 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6036 2.0606 0.7049 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9532 2.7096 -0.8959 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1241 1.3443 -0.8553 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0611 0.7201 -1.9907 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9820 1.8173 0.2118 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6495 0.9695 -1.3043 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6249 -1.3739 -1.1593 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2604 -2.0067 0.4474 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2761 -0.0612 1.0383 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5573 -1.6620 1.1292 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9825 -0.9784 -0.4552 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0908 -2.0737 0.7145 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9713 -1.3999 -1.7747 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4014 0.4180 2.1044 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2491 -0.4657 -1.8642 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6828 1.3418 1.9927 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1136 0.9055 0.0136 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 5 1 0 0 0 0 1 7 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 15 1 0 0 0 0 2 16 1 0 0 0 0 3 6 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 19 1 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 5 22 1 0 0 0 0 6 8 2 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 10 12 1 0 0 0 0 10 27 1 0 0 0 0 11 13 2 0 0 0 0 11 28 1 0 0 0 0 12 14 2 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 31 1 0 0 0 0 M END $$$$