@MOLECULE n,n'-dihydroxyethanediamide 12 11 0 0 0 SMALL USER_CHARGES @ATOM 1 O -3.0038 -0.1934 -0.0182 O.3 1 UNL11111111 -0.2713 2 O 2.9946 0.1983 0.0053 O.3 1 UNL11111111 -0.2716 3 O -0.8921 1.4822 0.2518 O.2 1 UNL11111111 -0.4782 4 O 0.8950 -1.4903 0.2513 O.2 1 UNL11111111 -0.4579 5 N -1.6946 -0.5861 -0.2930 N.am 1 UNL11111111 -0.3469 6 N 1.6915 0.5872 -0.3085 N.am 1 UNL11111111 -0.3554 7 C -0.7026 0.2992 0.0771 C.2 1 UNL11111111 0.4430 8 C 0.7080 -0.3098 0.0735 C.2 1 UNL11111111 0.4524 9 H -1.6525 -1.5826 -0.1160 H 1 UNL11111111 0.3341 10 H 1.6315 1.5802 -0.1131 H 1 UNL11111111 0.3317 11 H -3.0822 0.7484 -0.3813 H 1 UNL11111111 0.3119 12 H 3.1794 -0.5844 -0.6072 H 1 UNL11111111 0.3080 @BOND 1 4 8 2 2 3 7 2 3 8 7 1 4 8 6 am 5 7 5 am 6 12 2 1 7 11 1 1 8 5 1 1 9 5 9 1 10 6 2 1 11 6 10 1