HEADER REMARK betaine_aldehyde_3855 HETATM 1 O 1 2.701 1.083 0.000 O HETATM 2 C 1 1.501 1.033 0.000 C HETATM 3 C 1 0.819 -0.345 0.000 C HETATM 4 N 1 -0.700 -0.359 0.000 N HETATM 5 C 1 -1.162 -1.800 0.000 C HETATM 6 C 1 -1.237 0.323 1.239 C HETATM 7 C 1 -1.237 0.323 -1.239 C HETATM 8 H 1 0.874 1.947 0.000 H HETATM 9 H 1 1.154 -0.895 -0.885 H HETATM 10 H 1 1.154 -0.895 0.885 H HETATM 11 H 1 -0.779 -2.293 -0.894 H HETATM 12 H 1 -0.779 -2.293 0.894 H HETATM 13 H 1 -2.252 -1.816 0.000 H HETATM 14 H 1 -0.834 -0.181 2.119 H HETATM 15 H 1 -2.325 0.251 1.232 H HETATM 16 H 1 -0.939 1.371 1.237 H HETATM 17 H 1 -2.325 0.251 -1.232 H HETATM 18 H 1 -0.834 -0.181 -2.119 H HETATM 19 H 1 -0.939 1.371 -1.237 H CONECT 1 2 CONECT 2 1 3 8 CONECT 3 2 4 9 10 CONECT 4 3 5 6 7 CONECT 5 4 11 12 13 CONECT 6 4 14 15 16 CONECT 7 4 17 18 19 CONECT 8 2 CONECT 9 3 CONECT 10 3 CONECT 11 5 CONECT 12 5 CONECT 13 5 CONECT 14 6 CONECT 15 6 CONECT 16 6 CONECT 17 7 CONECT 18 7 CONECT 19 7 END