D01BXV AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 BR UNL 1 1.056 0.203 -0.182 1.00 0.00 Br HETATM 2 C UNL 1 3.002 0.076 -0.222 1.00 0.00 C HETATM 3 C UNL 1 3.493 -0.448 -1.566 1.00 0.00 C HETATM 4 C UNL 1 3.264 0.614 -2.625 1.00 0.00 C HETATM 5 O UNL 1 2.479 0.114 -3.618 1.00 0.00 O HETATM 6 C UNL 1 2.208 0.997 -4.708 1.00 0.00 C HETATM 7 C UNL 1 4.979 -0.766 -1.469 1.00 0.00 C HETATM 8 BR UNL 1 5.665 -1.543 -3.122 1.00 0.00 Br HETATM 9 O UNL 1 3.724 1.745 -2.576 1.00 0.00 O HETATM 10 H UNL 1 3.261 -0.606 0.593 1.00 0.00 H HETATM 11 H UNL 1 3.384 1.074 0.015 1.00 0.00 H HETATM 12 H UNL 1 2.941 -1.356 -1.838 1.00 0.00 H HETATM 13 H UNL 1 2.070 0.386 -5.606 1.00 0.00 H HETATM 14 H UNL 1 3.027 1.696 -4.896 1.00 0.00 H HETATM 15 H UNL 1 1.280 1.540 -4.511 1.00 0.00 H HETATM 16 H UNL 1 5.172 -1.523 -0.700 1.00 0.00 H HETATM 17 H UNL 1 5.592 0.115 -1.262 1.00 0.00 H CONECT 1 2 CONECT 2 1 3 10 11 CONECT 3 2 4 7 12 CONECT 4 3 5 9 CONECT 5 4 6 CONECT 6 5 13 14 15 CONECT 7 3 8 16 17 CONECT 8 7 CONECT 9 4 CONECT 10 2 CONECT 11 2 CONECT 12 3 CONECT 13 6 CONECT 14 6 CONECT 15 6 CONECT 16 7 CONECT 17 7 MASTER 0 0 0 0 0 0 0 0 17 0 17 0 END M END $$$$