HEADER PROTEIN 07-JAN-16 NONE TITLE NULL COMPND MOLECULE: Crocin SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 07-JAN-16 0 HETATM 1 O UNK 0 7.908 -8.470 0.000 0.00 0.00 O+0 HETATM 2 O UNK 0 35.916 10.780 0.000 0.00 0.00 O+0 HETATM 3 O UNK 0 13.243 -10.010 0.000 0.00 0.00 O+0 HETATM 4 O UNK 0 29.247 10.010 0.000 0.00 0.00 O+0 HETATM 5 O UNK 0 33.249 10.780 0.000 0.00 0.00 O+0 HETATM 6 O UNK 0 10.576 -8.470 0.000 0.00 0.00 O+0 HETATM 7 O UNK 0 31.915 13.090 0.000 0.00 0.00 O+0 HETATM 8 O UNK 0 10.576 -13.090 0.000 0.00 0.00 O+0 HETATM 9 O UNK 0 33.249 7.700 0.000 0.00 0.00 O+0 HETATM 10 O UNK 0 10.576 -5.390 0.000 0.00 0.00 O+0 HETATM 11 O UNK 0 35.916 6.160 0.000 0.00 0.00 O+0 HETATM 12 O UNK 0 7.908 -3.850 0.000 0.00 0.00 O+0 HETATM 13 O UNK 0 29.247 14.630 0.000 0.00 0.00 O+0 HETATM 14 O UNK 0 13.243 -14.630 0.000 0.00 0.00 O+0 HETATM 15 O UNK 0 5.241 -5.390 0.000 0.00 0.00 O+0 HETATM 16 O UNK 0 38.583 7.700 0.000 0.00 0.00 O+0 HETATM 17 O UNK 0 26.580 13.090 0.000 0.00 0.00 O+0 HETATM 18 O UNK 0 15.910 -13.090 0.000 0.00 0.00 O+0 HETATM 19 O UNK 0 26.580 10.010 0.000 0.00 0.00 O+0 HETATM 20 O UNK 0 15.910 -10.010 0.000 0.00 0.00 O+0 HETATM 21 O UNK 0 38.583 12.320 0.000 0.00 0.00 O+0 HETATM 22 O UNK 0 3.907 -7.700 0.000 0.00 0.00 O+0 HETATM 23 O UNK 0 14.577 -7.700 0.000 0.00 0.00 O+0 HETATM 24 O UNK 0 27.914 7.700 0.000 0.00 0.00 O+0 HETATM 25 C UNK 0 11.909 -10.780 0.000 0.00 0.00 C+0 HETATM 26 C UNK 0 30.581 10.780 0.000 0.00 0.00 C+0 HETATM 27 C UNK 0 30.581 12.320 0.000 0.00 0.00 C+0 HETATM 28 C UNK 0 11.909 -12.320 0.000 0.00 0.00 C+0 HETATM 29 C UNK 0 34.582 8.470 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 9.242 -6.160 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 7.908 -5.390 0.000 0.00 0.00 C+0 HETATM 32 C UNK 0 35.916 7.700 0.000 0.00 0.00 C+0 HETATM 33 C UNK 0 29.247 13.090 0.000 0.00 0.00 C+0 HETATM 34 C UNK 0 13.243 -13.090 0.000 0.00 0.00 C+0 HETATM 35 C UNK 0 9.242 -7.700 0.000 0.00 0.00 C+0 HETATM 36 C UNK 0 34.582 10.010 0.000 0.00 0.00 C+0 HETATM 37 C UNK 0 6.574 -6.160 0.000 0.00 0.00 C+0 HETATM 38 C UNK 0 37.250 8.470 0.000 0.00 0.00 C+0 HETATM 39 C UNK 0 6.574 -7.700 0.000 0.00 0.00 C+0 HETATM 40 C UNK 0 37.250 10.010 0.000 0.00 0.00 C+0 HETATM 41 C UNK 0 14.577 -12.320 0.000 0.00 0.00 C+0 HETATM 42 C UNK 0 27.914 12.320 0.000 0.00 0.00 C+0 HETATM 43 C UNK 0 31.915 10.010 0.000 0.00 0.00 C+0 HETATM 44 C UNK 0 10.576 -10.010 0.000 0.00 0.00 C+0 HETATM 45 C UNK 0 27.914 10.780 0.000 0.00 0.00 C+0 HETATM 46 C UNK 0 14.577 -10.780 0.000 0.00 0.00 C+0 HETATM 47 C UNK 0 5.241 -8.470 0.000 0.00 0.00 C+0 HETATM 48 C UNK 0 38.583 10.780 0.000 0.00 0.00 C+0 HETATM 49 C UNK 0 15.910 -8.470 0.000 0.00 0.00 C+0 HETATM 50 C UNK 0 26.580 8.470 0.000 0.00 0.00 C+0 HETATM 51 C UNK 0 17.244 -7.700 0.000 0.00 0.00 C+0 HETATM 52 C UNK 0 25.246 7.700 0.000 0.00 0.00 C+0 HETATM 53 C UNK 0 18.578 -8.470 0.000 0.00 0.00 C+0 HETATM 54 C UNK 0 23.913 8.470 0.000 0.00 0.00 C+0 HETATM 55 C UNK 0 25.246 6.160 0.000 0.00 0.00 C+0 HETATM 56 C UNK 0 17.244 -6.160 0.000 0.00 0.00 C+0 HETATM 57 C UNK 0 23.913 5.390 0.000 0.00 0.00 C+0 HETATM 58 C UNK 0 18.578 -5.390 0.000 0.00 0.00 C+0 HETATM 59 C UNK 0 23.913 3.850 0.000 0.00 0.00 C+0 HETATM 60 C UNK 0 18.578 -3.850 0.000 0.00 0.00 C+0 HETATM 61 C UNK 0 22.579 3.080 0.000 0.00 0.00 C+0 HETATM 62 C UNK 0 19.911 -3.080 0.000 0.00 0.00 C+0 HETATM 63 C UNK 0 21.245 3.850 0.000 0.00 0.00 C+0 HETATM 64 C UNK 0 21.245 -3.850 0.000 0.00 0.00 C+0 HETATM 65 C UNK 0 22.579 1.540 0.000 0.00 0.00 C+0 HETATM 66 C UNK 0 19.911 -1.540 0.000 0.00 0.00 C+0 HETATM 67 C UNK 0 21.245 -0.770 0.000 0.00 0.00 C+0 HETATM 68 C UNK 0 21.245 0.770 0.000 0.00 0.00 C+0 CONECT 1 35 39 CONECT 2 36 40 CONECT 3 25 46 CONECT 4 26 45 CONECT 5 36 43 CONECT 6 35 44 CONECT 7 27 CONECT 8 28 CONECT 9 29 CONECT 10 30 CONECT 11 32 CONECT 12 31 CONECT 13 33 CONECT 14 34 CONECT 15 37 CONECT 16 38 CONECT 17 42 CONECT 18 41 CONECT 19 45 50 CONECT 20 46 49 CONECT 21 48 CONECT 22 47 CONECT 23 49 CONECT 24 50 CONECT 25 3 28 44 CONECT 26 4 27 43 CONECT 27 7 26 33 CONECT 28 8 25 34 CONECT 29 9 32 36 CONECT 30 10 31 35 CONECT 31 12 30 37 CONECT 32 11 29 38 CONECT 33 13 27 42 CONECT 34 14 28 41 CONECT 35 1 6 30 CONECT 36 2 5 29 CONECT 37 15 31 39 CONECT 38 16 32 40 CONECT 39 1 37 47 CONECT 40 2 38 48 CONECT 41 18 34 46 CONECT 42 17 33 45 CONECT 43 5 26 CONECT 44 6 25 CONECT 45 4 19 42 CONECT 46 3 20 41 CONECT 47 22 39 CONECT 48 21 40 CONECT 49 20 23 51 CONECT 50 19 24 52 CONECT 51 49 53 56 CONECT 52 50 54 55 CONECT 53 51 CONECT 54 52 CONECT 55 52 57 CONECT 56 51 58 CONECT 57 55 59 CONECT 58 56 60 CONECT 59 57 61 CONECT 60 58 62 CONECT 61 59 63 65 CONECT 62 60 64 66 CONECT 63 61 CONECT 64 62 CONECT 65 61 68 CONECT 66 62 67 CONECT 67 66 68 CONECT 68 65 67 MASTER 0 0 0 0 0 0 0 0 68 0 142 0 END