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	hartrees
Energy at 0K	-139.654200
Energy at 298.15K	-139.656726
HF Energy	-139.223189
Nuclear repulsion energy	53.926106

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3074	2984
2	A₁	2029	1969
3	A₁	1395	1355
4	A₁	822	798
5	E	3159	3066
5	E	3159	3066
6	E	1510	1466
6	E	1510	1466
7	E	950	922
7	E	950	922
8	E	355	345
8	E	355	345

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.303
B2	0.000	0.000	0.241
O3	0.000	0.000	1.459
H4	0.000	1.027	-1.686
H5	0.889	-0.513	-1.686
H6	-0.889	-0.513	-1.686

	C1	B2	O3	H4	H5	H6
C1		1.5434	2.7611	1.0960	1.0960	1.0960
B2	1.5434		1.2177	2.1832	2.1832	2.1832
O3	2.7611	1.2177		3.3077	3.3077	3.3077
H4	1.0960	2.1832	3.3077		1.7785	1.7785
H5	1.0960	2.1832	3.3077	1.7785		1.7785
H6	1.0960	2.1832	3.3077	1.7785	1.7785

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	B2	O3	180.000	B2	C1	H4	110.465
B2	C1	H5	110.465	B2	C1	H6	110.465
H4	C1	H5	108.460	H4	C1	H6	108.460
H5	C1	H6	108.460

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

using model chemistry: CCSD(T)=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 CH3BO (Borane, methyloxo-)

using model chemistry: CCSD(T)=FULL/6-31G*

States and conformations

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