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	hartrees
Energy at 0K	-65.724104
Energy at 298.15K	-65.728060
HF Energy	-65.448641
Nuclear repulsion energy	31.872725

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3196	3196	14.80
2	A'	3096	3096	2.75
3	A'	2682	2682	99.67
4	A'	1547	1547	1.53
5	A'	1400	1400	60.94
6	A'	1316	1316	28.99
7	A'	1135	1135	79.32
8	A'	996	996	10.53
9	A'	595	595	0.53
10	A"	3247	3247	17.92
11	A"	2760	2760	150.34
12	A"	1508	1508	2.88
13	A"	1109	1109	20.06
14	A"	710	710	1.28
15	A"	139	139	1.14

Atom	x (Å)	y (Å)	z (Å)
C1	-0.016	-0.686	0.000
B2	-0.016	0.875	0.000
H3	1.044	-0.967	0.000
H4	-0.451	-1.132	0.890
H5	-0.451	-1.132	-0.890
H6	0.016	1.488	-1.018
H7	0.016	1.488	1.018

	C1	B2	H3	H4	H5	H6	H7
C1		1.5607	1.0967	1.0864	1.0864	2.4006	2.4006
B2	1.5607		2.1250	2.2376	2.2376	1.1890	1.1890
H3	1.0967	2.1250		1.7482	1.7482	2.8493	2.8493
H4	1.0864	2.2376	1.7482		1.7798	3.2743	2.6639
H5	1.0864	2.2376	1.7482	1.7798		2.6639	3.2743
H6	2.4006	1.1890	2.8493	3.2743	2.6639		2.0365
H7	2.4006	1.1890	2.8493	2.6639	3.2743	2.0365

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	B2	H6	121.038	C1	B2	H7	121.038
B2	C1	H3	104.845	B2	C1	H4	114.220
B2	C1	H5	114.220	H3	C1	H4	106.406
H3	C1	H5	106.406	H4	C1	H5	109.995
H6	B2	H7	117.828

All results from a given calculation for CH₃BH₂ (methylborane)

using model chemistry: MP3=FULL/6-31G**

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: MP3=FULL/6-31G**

States and conformations

All results from a given calculation for CH₃BH₂ (methylborane)