HEADER REMARK 3_4_Hydroxyphenyl_pyruvate_4406 HETATM 1 O 1 1.784 1.660 2.739 O HETATM 2 O 1 -2.372 -3.383 -1.045 O HETATM 3 O 1 2.704 0.570 0.998 O HETATM 4 O 1 -0.067 2.664 1.180 O HETATM 5 C 1 0.590 1.480 -0.830 C HETATM 6 C 1 1.847 1.286 1.458 C HETATM 7 C 1 0.699 1.902 0.614 C HETATM 8 C 1 -1.619 -2.245 -0.991 C HETATM 9 C 1 -0.178 0.164 -0.900 C HETATM 10 C 1 -0.221 -2.263 -0.946 C HETATM 11 C 1 -2.300 -1.022 -0.981 C HETATM 12 C 1 -1.580 0.166 -0.930 C HETATM 13 C 1 0.490 -1.066 -0.894 C HETATM 14 H 1 1.000 2.248 2.811 H HETATM 15 H 1 -1.784 -4.153 -1.041 H HETATM 16 H 1 1.593 1.358 -1.248 H HETATM 17 H 1 0.061 2.267 -1.374 H HETATM 18 H 1 0.312 -3.212 -0.948 H HETATM 19 H 1 -3.385 -1.023 -1.016 H HETATM 20 H 1 1.574 -1.088 -0.841 H HETATM 21 H 1 -2.115 1.112 -0.920 H CONECT 1 6 14 CONECT 2 8 15 CONECT 3 6 CONECT 4 7 CONECT 5 7 9 16 17 CONECT 6 1 3 7 CONECT 7 4 5 6 CONECT 8 2 10 11 CONECT 9 5 12 13 CONECT 10 8 13 18 CONECT 11 8 12 19 CONECT 12 9 11 21 CONECT 13 9 10 20 CONECT 14 1 CONECT 15 2 CONECT 16 5 CONECT 17 5 CONECT 18 10 CONECT 19 11 CONECT 20 13 CONECT 21 12 END