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	hartrees
Energy at 0K	-139.831791
Energy at 298.15K	-139.834341
HF Energy	-139.278324
Nuclear repulsion energy	54.592319

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3112	2903	0.20
2	A₁	2112	1970	219.90
3	A₁	1358	1266	13.64
4	A₁	837	781	0.05
5	E	3185	2970	0.32
5	E	3185	2970	0.32
6	E	1493	1392	5.08
6	E	1493	1392	5.08
7	E	925	863	25.08
7	E	925	863	25.08
8	E	360	336	13.89
8	E	360	336	13.89

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.290
B2	0.000	0.000	0.243
O3	0.000	0.000	1.440
H4	0.000	1.017	-1.666
H5	0.881	-0.509	-1.666
H6	-0.881	-0.509	-1.666

	C1	B2	O3	H4	H5	H6
C1		1.5328	2.7296	1.0843	1.0843	1.0843
B2	1.5328		1.1967	2.1628	2.1628	2.1628
O3	2.7296	1.1967		3.2678	3.2678	3.2678
H4	1.0843	2.1628	3.2678		1.7616	1.7616
H5	1.0843	2.1628	3.2678	1.7616		1.7616
H6	1.0843	2.1628	3.2678	1.7616	1.7616

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	B2	O3	180.000	B2	C1	H4	110.284
B2	C1	H5	110.284	B2	C1	H6	110.284
H4	C1	H5	108.646	H4	C1	H6	108.646
H5	C1	H6	108.646

All results from a given calculation for CH₃BO (Borane, methyloxo-)

using model chemistry: MP3=FULL/cc-pVTZ

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 CH3BO (Borane, methyloxo-)

using model chemistry: MP3=FULL/cc-pVTZ

States and conformations

All results from a given calculation for CH₃BO (Borane, methyloxo-)