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	hartrees
Energy at 0K	-139.689900
Energy at 298.15K	-139.692434
HF Energy	-139.233597
Nuclear repulsion energy	53.955780

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3104	3104
2	A₁	2001	2001
3	A₁	1384	1384
4	A₁	816	816
5	E	3199	3199
5	E	3199	3199
6	E	1499	1499
6	E	1499	1499
7	E	942	942
7	E	942	942
8	E	357	357
8	E	357	357

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.304
B2	0.000	0.000	0.239
O3	0.000	0.000	1.459
H4	0.000	1.022	-1.682
H5	0.885	-0.511	-1.682
H6	-0.885	-0.511	-1.682

	C1	B2	O3	H4	H5	H6
C1		1.5431	2.7632	1.0899	1.0899	1.0899
B2	1.5431		1.2201	2.1762	2.1762	2.1762
O3	2.7632	1.2201		3.3034	3.3034	3.3034
H4	1.0899	2.1762	3.3034		1.7707	1.7707
H5	1.0899	2.1762	3.3034	1.7707		1.7707
H6	1.0899	2.1762	3.3034	1.7707	1.7707

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	B2	O3	180.000	B2	C1	H4	110.294
B2	C1	H5	110.294	B2	C1	H6	110.294
H4	C1	H5	108.636	H4	C1	H6	108.636
H5	C1	H6	108.636

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

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

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: QCISD(T)=FULL/6-31+G**

States and conformations

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