HEADER PROTEIN 07-JAN-16 NONE TITLE NULL COMPND MOLECULE: Ellagic acid acetyl-xyloside SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 07-JAN-16 0 HETATM 1 H UNK 0 13.241 6.105 0.000 0.00 0.00 H+0 HETATM 2 C UNK 0 14.011 4.771 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 14.781 3.437 0.000 0.00 0.00 C+0 HETATM 4 O UNK 0 14.011 2.104 0.000 0.00 0.00 O+0 HETATM 5 C UNK 0 12.471 2.104 0.000 0.00 0.00 C+0 HETATM 6 H UNK 0 10.931 2.104 0.000 0.00 0.00 H+0 HETATM 7 O UNK 0 11.701 0.770 0.000 0.00 0.00 O+0 HETATM 8 C UNK 0 10.161 0.770 0.000 0.00 0.00 C+0 HETATM 9 C UNK 0 9.391 2.104 0.000 0.00 0.00 C+0 HETATM 10 C UNK 0 7.851 2.104 0.000 0.00 0.00 C+0 HETATM 11 C UNK 0 7.081 0.770 0.000 0.00 0.00 C+0 HETATM 12 C UNK 0 7.851 -0.564 0.000 0.00 0.00 C+0 HETATM 13 O UNK 0 7.081 -1.897 0.000 0.00 0.00 O+0 HETATM 14 C UNK 0 5.541 -1.897 0.000 0.00 0.00 C+0 HETATM 15 O UNK 0 4.771 -3.231 0.000 0.00 0.00 O+0 HETATM 16 C UNK 0 4.771 -0.564 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 3.231 -0.564 0.000 0.00 0.00 C+0 HETATM 18 C UNK 0 2.461 0.770 0.000 0.00 0.00 C+0 HETATM 19 O UNK 0 0.921 0.770 0.000 0.00 0.00 O+0 HETATM 20 C UNK 0 3.231 2.104 0.000 0.00 0.00 C+0 HETATM 21 O UNK 0 2.461 3.437 0.000 0.00 0.00 O+0 HETATM 22 C UNK 0 4.771 2.104 0.000 0.00 0.00 C+0 HETATM 23 O UNK 0 5.541 3.437 0.000 0.00 0.00 O+0 HETATM 24 C UNK 0 7.081 3.437 0.000 0.00 0.00 C+0 HETATM 25 O UNK 0 7.851 4.771 0.000 0.00 0.00 O+0 HETATM 26 C UNK 0 5.541 0.770 0.000 0.00 0.00 C+0 HETATM 27 C UNK 0 9.391 -0.564 0.000 0.00 0.00 C+0 HETATM 28 O UNK 0 10.161 -1.897 0.000 0.00 0.00 O+0 HETATM 29 C UNK 0 11.701 3.437 0.000 0.00 0.00 C+0 HETATM 30 H UNK 0 10.931 4.771 0.000 0.00 0.00 H+0 HETATM 31 O UNK 0 10.161 3.437 0.000 0.00 0.00 O+0 HETATM 32 C UNK 0 12.471 4.771 0.000 0.00 0.00 C+0 HETATM 33 H UNK 0 13.241 3.437 0.000 0.00 0.00 H+0 HETATM 34 O UNK 0 11.701 6.105 0.000 0.00 0.00 O+0 HETATM 35 O UNK 0 14.781 6.105 0.000 0.00 0.00 O+0 HETATM 36 C UNK 0 16.321 6.105 0.000 0.00 0.00 C+0 HETATM 37 C UNK 0 17.091 7.438 0.000 0.00 0.00 C+0 HETATM 38 O UNK 0 17.091 4.771 0.000 0.00 0.00 O+0 CONECT 1 2 CONECT 2 1 3 32 35 CONECT 3 2 4 CONECT 4 3 5 CONECT 5 4 6 7 29 CONECT 6 5 CONECT 7 5 8 CONECT 8 7 9 27 CONECT 9 8 10 CONECT 10 9 11 24 CONECT 11 10 12 26 CONECT 12 11 13 27 CONECT 13 12 14 CONECT 14 13 15 16 CONECT 15 14 CONECT 16 14 17 26 CONECT 17 16 18 CONECT 18 17 19 20 CONECT 19 18 CONECT 20 18 21 22 CONECT 21 20 CONECT 22 20 23 26 CONECT 23 22 24 CONECT 24 23 10 25 CONECT 25 24 CONECT 26 22 11 16 CONECT 27 12 8 28 CONECT 28 27 CONECT 29 5 30 31 32 CONECT 30 29 CONECT 31 29 CONECT 32 29 2 33 34 CONECT 33 32 CONECT 34 32 CONECT 35 2 36 CONECT 36 35 37 38 CONECT 37 36 CONECT 38 36 MASTER 0 0 0 0 0 0 0 0 38 0 84 0 END