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	hartrees
Energy at 0K	-139.635248
Energy at 298.15K	-139.637377
HF Energy	-139.169670
Nuclear repulsion energy	54.262519

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3800	3687
2	A'	3158	3063
3	A'	1742	1690
4	A'	1348	1307
5	A'	1033	1002
6	A'	903	876
7	A'	626	607
8	A'	336	326
9	A"	3247	3150
10	A"	791	767
11	A"	607	589
12	A"	320	310

Atom	x (Å)	y (Å)	z (Å)
C1	0.040	1.410	0.000
B2	0.040	0.001	0.000
O3	0.040	-1.338	0.000
H4	0.040	1.983	0.932
H5	0.040	1.983	-0.932
H6	-0.847	-1.725	0.000

	C1	B2	O3	H4	H5	H6
C1		1.4088	2.7474	1.0947	1.0947	3.2576
B2	1.4088		1.3386	2.1909	2.1909	1.9404
O3	2.7474	1.3386		3.4496	3.4496	0.9681
H4	1.0947	2.1909	3.4496		1.8646	3.9253
H5	1.0947	2.1909	3.4496	1.8646		3.9253
H6	3.2576	1.9404	0.9681	3.9253	3.9253

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	B2	O3	180.000	B2	C1	H4	121.614
B2	C1	H5	121.614	B2	O3	H6	113.563
H4	C1	H5	116.772

All results from a given calculation for CH₂BOH (hydroxy(methylene)borane)

using model chemistry: QCISD(T)=FULL/aug-cc-pVDZ

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 CH2BOH (hydroxy(methylene)borane)

using model chemistry: QCISD(T)=FULL/aug-cc-pVDZ

States and conformations

All results from a given calculation for CH₂BOH (hydroxy(methylene)borane)