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	hartrees
Energy at 0K	-25.907265
Energy at 298.15K	-25.909801
HF Energy	-25.631432
Nuclear repulsion energy	27.890620

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2993	2922	3.41
2	A₁	1880	1835	94.94
3	A₁	1416	1382	25.50
4	A₁	795	776	0.21
5	E	3100	3026	8.34
5	E	3100	3026	8.34
6	E	1499	1463	12.06
6	E	1499	1463	12.06
7	E	968	945	20.43
7	E	968	945	20.43
8	E	349	341	8.49
8	E	349	341	8.49

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.321
B2	0.000	0.000	0.236
O3	0.000	0.000	1.485
H4	0.000	1.030	-1.710
H5	0.892	-0.515	-1.710
H6	-0.892	-0.515	-1.710

	C1	B2	O3	H4	H5	H6
C1		1.5572	2.8057	1.1012	1.1012	1.1012
B2	1.5572		1.2484	2.2021	2.2021	2.2021
O3	2.8057	1.2484		3.3567	3.3567	3.3567
H4	1.1012	2.2021	3.3567		1.7844	1.7844
H5	1.1012	2.2021	3.3567	1.7844		1.7844
H6	1.1012	2.2021	3.3567	1.7844	1.7844

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	B2	O3	180.000	B2	C1	H4	110.686
B2	C1	H5	110.686	B2	C1	H6	110.686
H4	C1	H5	108.229	H4	C1	H6	108.229
H5	C1	H6	108.229

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

using model chemistry: MP2/CEP-121G

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: MP2/CEP-121G

States and conformations

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