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	hartrees
Energy at 0K	-65.830715
Energy at 298.15K	-65.834703
HF Energy	-65.470732
Nuclear repulsion energy	32.034488

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3152	3017	8.83
2	A'	3037	2906	2.74
3	A'	2636	2523	107.31
4	A'	1497	1433	2.60
5	A'	1341	1283	84.22
6	A'	1283	1228	7.86
7	A'	1105	1057	66.99
8	A'	993	951	12.45
9	A'	553	530	0.83
10	A"	3209	3072	9.31
11	A"	2714	2597	149.17
12	A"	1449	1387	4.11
13	A"	1081	1034	19.21
14	A"	693	663	1.03
15	A"	184	176	1.20

Atom	x (Å)	y (Å)	z (Å)
C1	-0.019	-0.680	0.000
B2	-0.019	0.867	0.000
H3	1.048	-0.931	0.000
H4	-0.433	-1.139	0.890
H5	-0.433	-1.139	-0.890
H6	0.016	1.475	-1.019
H7	0.016	1.475	1.019

	C1	B2	H3	H4	H5	H6	H7
C1		1.5474	1.0967	1.0832	1.0832	2.3846	2.3846
B2	1.5474		2.0912	2.2334	2.2334	1.1875	1.1875
H3	1.0967	2.0912		1.7403	1.7403	2.8097	2.8097
H4	1.0832	2.2334	1.7403		1.7800	3.2682	2.6556
H5	1.0832	2.2334	1.7403	1.7800		2.6556	3.2682
H6	2.3846	1.1875	2.8097	3.2682	2.6556		2.0387
H7	2.3846	1.1875	2.8097	2.6556	3.2682	2.0387

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	B2	H6	120.800	C1	B2	H7	120.800
B2	C1	H3	103.211	B2	C1	H4	115.063
B2	C1	H5	115.063	H3	C1	H4	105.935
H3	C1	H5	105.935	H4	C1	H5	110.493
H6	B2	H7	118.286

All results from a given calculation for CH₃BH₂ (methylborane)

using model chemistry: MP2=FULL/cc-pVQZ

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=FULL/cc-pVQZ

States and conformations

All results from a given calculation for CH₃BH₂ (methylborane)