add new analogy reaction to adjust estimation

here we move to a higher up rule in the tree to estimate this particular reaction

Author: mjohnson541

input/kinetics/libraries/LithiumAnalogyKinetics/dictionary.txt

@@ -1075,3 +1075,24 @@ multiplicity 2
 14 H u0 p0 c0 {6,S}
 15 H u0 p0 c0 {6,S}
 16 Li u0 p0 c0 {10,S}
+
+[Li]CCO[C]1OCCO1
+multiplicity 2
+1  Li u0 p0 c0 {2,S}
+2  C  u0 p0 c0 {1,S} {3,S} {10,S} {11,S}
+3  C  u0 p0 c0 {2,S} {4,S} {12,S} {13,S}
+4  O  u0 p2 c0 {3,S} {5,S}
+5  C  u1 p0 c0 {4,S} {6,S} {9,S}
+6  O  u0 p2 c0 {5,S} {7,S}
+7  C  u0 p0 c0 {6,S} {8,S} {14,S} {15,S}
+8  C  u0 p0 c0 {7,S} {9,S} {16,S} {17,S}
+9  O  u0 p2 c0 {5,S} {8,S}
+10 H  u0 p0 c0 {2,S}
+11 H  u0 p0 c0 {2,S}
+12 H  u0 p0 c0 {3,S}
+13 H  u0 p0 c0 {3,S}
+14 H  u0 p0 c0 {7,S}
+15 H  u0 p0 c0 {7,S}
+16 H  u0 p0 c0 {8,S}
+17 H  u0 p0 c0 {8,S}
+

input/kinetics/libraries/LithiumAnalogyKinetics/reactions.py

@@ -28,3 +28,17 @@
 analogy to  [Li]OC(=O)OC[CH2] + C[CH2] <=> C=C + [Li]OC(=O)OCC
 """,
 )
+
+entry(
+    index = 2,
+    label = "O1CCO[C]1OC2(O[Li])OCCO2 <=> O=C1OCCO1 + [Li]O[C]1OCCO1",
+    degeneracy = 1.0,
+    kinetics = ArrheniusBM(A=(1.64384e+31,'s^-1'), n=-4.72524, w0=(741100,'J/mol'), E0=(9911.42,'J/mol'), Tmin=(300,'K'), Tmax=(1500,'K'), uncertainty=RateUncertainty(mu=0.2101947124094859, var=22.757813031131217, Tref=1000.0, N=3, data_mean=0.0, correlation='Root_Ext-3R-R_5R!H->C',), comment="""BM rule fitted to 3 training reactions at node Root_Ext-3R-R_5R!H->C
+        Total Standard Deviation in ln(k): 10.091746105650293"""),
+    longDesc =
+"""
+Higher up rule Root_Ext-3R-R_5R!H->C in 1,2_Elimination_LiR
+""",
+)
+
+