fixup! don't use OR for top node in 1,2_NH3_elimination

ReactionMechanismGenerator · Feb 12, 2019 · 92f8441 · 92f8441
1 parent 4515334
commit 92f8441
Showing 1 changed file with 9 additions and 1 deletion.
diff --git a/input/kinetics/families/1,2_NH3_elimination/groups.py b/input/kinetics/families/1,2_NH3_elimination/groups.py
@@ -35,7 +35,15 @@
 entry(
     index = 0,
     label = "NNHNH2",
-    group = "OR{non_charged, charged}",
+    group =
+"""
+1 *1 N u0 p1 c0 {2,S} {5,S} {6,S}
+2 *2 N u0 px cx {1,S} {4,S} {3,[S,D]}
+3 *3 N u0 px cx {2,[S,D]}
+4 *4 H u0 p0 c0 {2,S}
+5    H u0 p0 c0 {1,S}
+6    H u0 p0 c0 {1,S}
+""",
     kinetics = None,
 )