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PNL
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alongd committed Dec 15, 2023
1 parent 99984c1 commit 589be71
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Showing 2 changed files with 961 additions and 615 deletions.
14 changes: 13 additions & 1 deletion input/kinetics/libraries/primaryNitrogenLibrary/dictionary.txt
Original file line number Diff line number Diff line change
Expand Up @@ -60,6 +60,11 @@ multiplicity 3
1 N u2 p1 c0 {2,S}
2 H u0 p0 c0 {1,S}

NH(S)
multiplicity 1
1 N u0 p2 c0 {2,S}
2 H u0 p0 c0 {1,S}

NH2
multiplicity 2
1 N u1 p1 c0 {2,S} {3,S}
Expand Down Expand Up @@ -133,13 +138,20 @@ multiplicity 2
1 N u1 p1 c0 {2,D}
2 O u0 p2 c0 {1,D}

H2NO
NH2O
multiplicity 2
1 N u0 p1 c0 {2,S} {3,S} {4,S}
2 O u1 p2 c0 {1,S}
3 H u0 p0 c0 {1,S}
4 H u0 p0 c0 {1,S}

NHOH
multiplicity 2
1 N u1 p1 c0 {2,S} {3,S}
2 O u0 p2 c0 {1,S} {4,S}
3 H u0 p0 c0 {1,S}
4 H u0 p0 c0 {2,S}

H2NOH
1 N u0 p1 c0 {2,S} {3,S} {4,S}
2 O u0 p2 c0 {1,S} {5,S}
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