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	hartrees
Energy at 0K	-65.873104
Energy at 298.15K	-65.877062
HF Energy	-65.470794
Nuclear repulsion energy	31.931344

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3097	3097
2	A'	2989	2989
3	A'	2593	2593
4	A'	1488	1488
5	A'	1337	1337
6	A'	1271	1271
7	A'	1094	1094
8	A'	983	983
9	A'	555	555
10	A"	3150	3150
11	A"	2666	2666
12	A"	1442	1442
13	A"	1074	1074
14	A"	687	687
15	A"	170	170

Atom	x (Å)	y (Å)	z (Å)
C1	-0.019	-0.682	0.000
B2	-0.019	0.870	0.000
H3	1.051	-0.940	0.000
H4	-0.437	-1.140	0.893
H5	-0.437	-1.140	-0.893
H6	0.015	1.480	-1.023
H7	0.015	1.480	1.023

	C1	B2	H3	H4	H5	H6	H7
C1		1.5517	1.1004	1.0871	1.0871	2.3922	2.3922
B2	1.5517		2.1021	2.2389	2.2389	1.1917	1.1917
H3	1.1004	2.1021		1.7467	1.7467	2.8241	2.8241
H4	1.0871	2.2389	1.7467		1.7851	3.2774	2.6627
H5	1.0871	2.2389	1.7467	1.7851		2.6627	3.2774
H6	2.3922	1.1917	2.8241	3.2774	2.6627		2.0457
H7	2.3922	1.1917	2.8241	2.6627	3.2774	2.0457

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	B2	H6	120.818	C1	B2	H7	120.818
B2	C1	H3	103.548	B2	C1	H4	114.951
B2	C1	H5	114.951	H3	C1	H4	105.969
H3	C1	H5	105.969	H4	C1	H5	110.377
H6	B2	H7	118.258

All results from a given calculation for CH₃BH₂ (methylborane)

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

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 CH3BH2 (methylborane)

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

States and conformations

All results from a given calculation for CH₃BH₂ (methylborane)