File tree Expand file tree Collapse file tree 1 file changed +3
-3
lines changed Expand file tree Collapse file tree 1 file changed +3
-3
lines changed Original file line number Diff line number Diff line change 120120 <!-- acrylate C-[O]-C(=O) (same as ester) -->
121121 <Angle class1 =" CHx" type2 =" O_acryl_sp3" type3 =" C_acryl" angle =" 2.00713" k =" 519.65374" />
122122 <!-- acrylate O=[C]-O (same as carboxylic acid) -->
123- <Angle type1 =" O_acryl_sp2" type2 =" C_acryl" type3 =" O_acryl_sp3" angle =" 2.14675 " k =" 335.07273 " />
123+ <Angle type1 =" O_acryl_sp2" type2 =" C_acryl" type3 =" O_acryl_sp3" angle =" 2.18166 " k =" 519.65374 " />
124124 <!-- acrylate O=[C]-C -->
125- <Angle type1 =" O_acryl_sp2" type2 =" C_acryl" type3 =" CH_sp2-Csp2" angle =" 2.19911 " k =" 335.07273 " />
126- <Angle type1 =" O_acryl_sp2" type2 =" C_acryl" type3 =" C_sp2-Csp2" angle =" 2.19911 " k =" 335.07273 " />
125+ <Angle type1 =" O_acryl_sp2" type2 =" C_acryl" type3 =" CH_sp2-Csp2" angle =" 2.18166 " k =" 519.65374 " />
126+ <Angle type1 =" O_acryl_sp2" type2 =" C_acryl" type3 =" C_sp2-Csp2" angle =" 2.18166 " k =" 519.65374 " />
127127 <!-- acrylate C=C-C(=O) -->
128128 <Angle class1 =" CHx_sp2" type2 =" CH_sp2-Csp2" type3 =" C_acryl" angle =" 2.08916" k =" 585.50426" />
129129 <Angle class1 =" CHx_sp2" type2 =" C_sp2-Csp2" type3 =" C_acryl" angle =" 2.08916" k =" 585.50426" />
You can’t perform that action at this time.
0 commit comments