HEADER PROTEIN 23-FEB-12 NONE TITLE NULL COMPND MOLECULE: 337 SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 23-FEB-12 0 HETATM 1 Cl UNK 0 17.595 -1.892 0.000 0.00 0.00 Cl+0 HETATM 2 O UNK 0 11.448 -2.273 0.000 0.00 0.00 O+0 HETATM 3 O UNK 0 9.250 -4.470 0.000 0.00 0.00 O+0 HETATM 4 O UNK 0 7.475 -3.614 0.000 0.00 0.00 O+0 HETATM 5 O UNK 0 11.049 -0.785 0.000 0.00 0.00 O+0 HETATM 6 O UNK 0 10.832 2.242 0.000 0.00 0.00 O+0 HETATM 7 O UNK 0 12.935 -0.493 0.000 0.00 0.00 O+0 HETATM 8 O UNK 0 18.129 1.141 0.000 0.00 0.00 O+0 HETATM 9 O UNK 0 16.373 -0.068 0.000 0.00 0.00 O+0 HETATM 10 O UNK 0 7.638 5.229 0.000 0.00 0.00 O+0 HETATM 11 O UNK 0 12.166 3.012 0.000 0.00 0.00 O+0 HETATM 12 O UNK 0 5.498 5.322 0.000 0.00 0.00 O+0 HETATM 13 N UNK 0 14.833 1.472 0.000 0.00 0.00 N+0 HETATM 14 C UNK 0 9.960 -1.874 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 12.959 -2.690 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 10.348 -3.390 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 11.857 -3.801 0.000 0.00 0.00 C+0 HETATM 18 C UNK 0 12.537 -1.184 0.000 0.00 0.00 C+0 HETATM 19 C UNK 0 8.871 -2.963 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 7.384 -2.565 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 6.985 -1.077 0.000 0.00 0.00 C+0 HETATM 22 C UNK 0 14.450 -3.077 0.000 0.00 0.00 C+0 HETATM 23 C UNK 0 14.024 -1.582 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 14.055 1.078 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 13.500 2.242 0.000 0.00 0.00 C+0 HETATM 26 C UNK 0 15.503 1.605 0.000 0.00 0.00 C+0 HETATM 27 C UNK 0 13.788 -0.439 0.000 0.00 0.00 C+0 HETATM 28 C UNK 0 16.682 0.615 0.000 0.00 0.00 C+0 HETATM 29 C UNK 0 5.498 -1.476 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 14.833 -0.068 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 14.968 -1.429 0.000 0.00 0.00 C+0 HETATM 32 C UNK 0 16.415 -0.902 0.000 0.00 0.00 C+0 HETATM 33 C UNK 0 13.500 3.782 0.000 0.00 0.00 C+0 HETATM 34 C UNK 0 16.167 2.242 0.000 0.00 0.00 C+0 HETATM 35 C UNK 0 10.832 3.782 0.000 0.00 0.00 C+0 HETATM 36 C UNK 0 9.499 4.552 0.000 0.00 0.00 C+0 HETATM 37 C UNK 0 14.833 4.552 0.000 0.00 0.00 C+0 HETATM 38 C UNK 0 16.167 3.782 0.000 0.00 0.00 C+0 HETATM 39 C UNK 0 6.334 -2.473 0.000 0.00 0.00 C+0 HETATM 40 C UNK 0 12.876 2.068 0.000 0.00 0.00 C+0 HETATM 41 C UNK 0 11.359 2.335 0.000 0.00 0.00 C+0 HETATM 42 C UNK 0 8.165 3.782 0.000 0.00 0.00 C+0 HETATM 43 C UNK 0 12.166 1.472 0.000 0.00 0.00 C+0 HETATM 44 C UNK 0 4.409 -0.387 0.000 0.00 0.00 C+0 HETATM 45 C UNK 0 9.637 -5.961 0.000 0.00 0.00 C+0 HETATM 46 C UNK 0 7.341 -5.148 0.000 0.00 0.00 C+0 HETATM 47 C UNK 0 6.831 4.552 0.000 0.00 0.00 C+0 HETATM 48 C UNK 0 5.498 2.242 0.000 0.00 0.00 C+0 HETATM 49 C UNK 0 10.832 5.322 0.000 0.00 0.00 C+0 HETATM 50 C UNK 0 4.409 1.153 0.000 0.00 0.00 C+0 HETATM 51 C UNK 0 10.369 1.155 0.000 0.00 0.00 C+0 HETATM 52 C UNK 0 5.498 3.782 0.000 0.00 0.00 C+0 HETATM 53 C UNK 0 3.882 1.060 0.000 0.00 0.00 C+0 HETATM 54 C UNK 0 3.963 2.108 0.000 0.00 0.00 C+0 HETATM 55 C UNK 0 19.309 0.152 0.000 0.00 0.00 C+0 HETATM 56 C UNK 0 3.080 3.370 0.000 0.00 0.00 C+0 HETATM 57 H UNK 0 9.655 -0.681 0.000 0.00 0.00 H+0 HETATM 58 H UNK 0 13.286 1.029 0.000 0.00 0.00 H+0 CONECT 1 32 CONECT 2 14 18 CONECT 3 16 45 CONECT 4 19 46 CONECT 5 18 CONECT 6 35 43 CONECT 7 23 CONECT 8 28 55 CONECT 9 30 CONECT 10 42 CONECT 11 43 CONECT 12 52 CONECT 13 25 30 34 CONECT 14 2 16 19 57 CONECT 15 17 18 22 CONECT 16 3 14 17 CONECT 17 15 16 CONECT 18 2 5 15 23 CONECT 19 4 14 20 CONECT 20 19 21 CONECT 21 20 29 39 CONECT 22 15 CONECT 23 7 18 30 CONECT 24 26 27 40 CONECT 25 13 33 43 58 CONECT 26 24 28 CONECT 27 24 31 CONECT 28 8 26 32 CONECT 29 21 44 CONECT 30 9 13 23 CONECT 31 27 32 CONECT 32 1 28 31 CONECT 33 25 37 CONECT 34 13 38 CONECT 35 6 36 41 CONECT 36 35 42 49 CONECT 37 33 38 CONECT 38 34 37 CONECT 39 21 CONECT 40 24 41 CONECT 41 35 40 51 CONECT 42 10 36 47 CONECT 43 6 11 25 CONECT 44 29 50 53 CONECT 45 3 CONECT 46 4 CONECT 47 42 52 CONECT 48 50 52 54 CONECT 49 36 CONECT 50 44 48 CONECT 51 41 CONECT 52 12 47 48 CONECT 53 44 CONECT 54 48 56 CONECT 55 8 CONECT 56 54 CONECT 57 14 CONECT 58 25 MASTER 0 0 0 0 0 0 0 0 58 0 122 0 END