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lines changed Original file line number Diff line number Diff line change 33 <Author >The Open Force Field Initiative</Author >
44 <Date >2025-09-12</Date >
55 <Constraints version =" 0.3" >
6- <Constraint smirks =" [#1:1]-[*:2]" id =" c1" ></Constraint >
7- <Constraint smirks =" [#1:1]-[#8X2H2+0:2]-[#1]" id =" c-tip3p-H-O" distance =" 0.9572 * angstrom ** 1" ></Constraint >
6+ <Constraint smirks =" [#1:1]-[*:2]" id =" c1" ></Constraint >
7+ <Constraint smirks =" [#1:1]-[#8X2H2+0:2]-[#1]" id =" c-tip3p-H-O" distance =" 0.9572 * angstrom ** 1" ></Constraint >
88 <Constraint smirks =" [#1:1]-[#8X2H2+0]-[#1:2]" id =" c-tip3p-H-O-H" distance =" 1.5139006545247014 * angstrom ** 1" ></Constraint >
99 </Constraints >
1010 <Bonds version =" 0.4" potential =" harmonic" fractional_bondorder_method =" AM1-Wiberg" fractional_bondorder_interpolation =" linear" >
Original file line number Diff line number Diff line change 33 <Author >The Open Force Field Initiative</Author >
44 <Date >2025-09-12</Date >
55 <Constraints version =" 0.3" >
6- <Constraint smirks =" [#1:1]-[#8X2H2+0:2]-[#1]" id =" c-tip3p-H-O" distance =" 0.9572 * angstrom ** 1" ></Constraint >
6+ <Constraint smirks =" [#1:1]-[#8X2H2+0:2]-[#1]" id =" c-tip3p-H-O" distance =" 0.9572 * angstrom ** 1" ></Constraint >
77 <Constraint smirks =" [#1:1]-[#8X2H2+0]-[#1:2]" id =" c-tip3p-H-O-H" distance =" 1.5139006545247014 * angstrom ** 1" ></Constraint >
88 </Constraints >
99 <Bonds version =" 0.4" potential =" harmonic" fractional_bondorder_method =" AM1-Wiberg" fractional_bondorder_interpolation =" linear" >
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