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	hartrees
Energy at 0K	-139.674477
Energy at 298.15K	-139.676997
HF Energy	-139.233760
Nuclear repulsion energy	53.958375

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3104	3104
2	A₁	2027	2027
3	A₁	1382	1382
4	A₁	818	818
5	E	3196	3196
5	E	3196	3196
6	E	1497	1497
6	E	1497	1497
7	E	941	941
7	E	941	941
8	E	350	350
8	E	350	350

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.305
B2	0.000	0.000	0.241
O3	0.000	0.000	1.459
H4	0.000	1.023	-1.682
H5	0.886	-0.512	-1.682
H6	-0.886	-0.512	-1.682

	C1	B2	O3	H4	H5	H6
C1		1.5452	2.7634	1.0909	1.0909	1.0909
B2	1.5452		1.2181	2.1784	2.1784	2.1784
O3	2.7634	1.2181		3.3036	3.3036	3.3036
H4	1.0909	2.1784	3.3036		1.7726	1.7726
H5	1.0909	2.1784	3.3036	1.7726		1.7726
H6	1.0909	2.1784	3.3036	1.7726	1.7726

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	B2	O3	180.000	B2	C1	H4	110.259
B2	C1	H5	110.259	B2	C1	H6	110.259
H4	C1	H5	108.672	H4	C1	H6	108.672
H5	C1	H6	108.672

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

using model chemistry: QCISD(TQ)/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(TQ)/6-31+G**

States and conformations

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