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	hartrees
Energy at 0K	-65.712727
Energy at 298.15K	-65.716695
HF Energy	-65.464559
Nuclear repulsion energy	31.863790

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3149	2985	12.44
2	A'	3040	2881	2.44
3	A'	2640	2503	109.26
4	A'	1503	1424	3.52
5	A'	1355	1284	82.18
6	A'	1293	1226	17.49
7	A'	1117	1059	71.77
8	A'	987	935	12.14
9	A'	558	529	1.10
10	A"	3203	3036	13.68
11	A"	2717	2576	156.47
12	A"	1456	1380	5.07
13	A"	1091	1034	18.97
14	A"	697	661	1.61
15	A"	166	157	1.35

Atom	x (Å)	y (Å)	z (Å)
C1	-0.018	-0.685	0.000
B2	-0.018	0.872	0.000
H3	1.052	-0.943	0.000
H4	-0.443	-1.139	0.893
H5	-0.443	-1.139	-0.893
H6	0.016	1.485	-1.023
H7	0.016	1.485	1.023

	C1	B2	H3	H4	H5	H6	H7
C1		1.5573	1.1009	1.0885	1.0885	2.3989	2.3989
B2	1.5573		2.1075	2.2418	2.2418	1.1927	1.1927
H3	1.1009	2.1075		1.7525	1.7525	2.8312	2.8312
H4	1.0885	2.2418	1.7525		1.7865	3.2815	2.6671
H5	1.0885	2.2418	1.7525	1.7865		2.6671	3.2815
H6	2.3989	1.1927	2.8312	3.2815	2.6671		2.0458
H7	2.3989	1.1927	2.8312	2.6671	3.2815	2.0458

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	B2	H6	120.895	C1	B2	H7	120.895
B2	C1	H3	103.569	B2	C1	H4	114.683
B2	C1	H5	114.683	H3	C1	H4	106.336
H3	C1	H5	106.336	H4	C1	H5	110.292
H6	B2	H7	118.106

All results from a given calculation for CH₃BH₂ (methylborane)

using model chemistry: MP2/TZVP

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All results from a given calculation for CH3BH2 (methylborane)

using model chemistry: MP2/TZVP

States and conformations

All results from a given calculation for CH₃BH₂ (methylborane)