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	hartrees
Energy at 0K	-139.876337
Energy at 298.15K	-139.878867
HF Energy	-139.278472
Nuclear repulsion energy	54.246601

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3068	2957
2	A₁	2011	1938
3	A₁	1344	1295
4	A₁	820	791
5	E	3134	3021
5	E	3134	3020
6	E	1478	1424
6	E	1478	1424
7	E	919	886
7	E	919	886
8	E	356	343
8	E	356	343

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.296
B2	0.000	0.000	0.241
O3	0.000	0.000	1.450
H4	0.000	1.021	-1.675
H5	0.884	-0.510	-1.675
H6	-0.884	-0.510	-1.675

	C1	B2	O3	H4	H5	H6
C1		1.5372	2.7464	1.0887	1.0887	1.0887
B2	1.5372		1.2092	2.1709	2.1709	2.1709
O3	2.7464	1.2092		3.2877	3.2877	3.2877
H4	1.0887	2.1709	3.2877		1.7678	1.7678
H5	1.0887	2.1709	3.2877	1.7678		1.7678
H6	1.0887	2.1709	3.2877	1.7678	1.7678

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	B2	O3	180.000	B2	C1	H4	110.366
B2	C1	H5	110.366	B2	C1	H6	110.366
H4	C1	H5	108.561	H4	C1	H6	108.561
H5	C1	H6	108.561

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

using model chemistry: CCSD(T)=FULL/aug-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: CCSD(T)=FULL/aug-cc-pVTZ

States and conformations

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