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	hartrees
Energy at 0K	-65.683763
Energy at 298.15K	-65.687684
HF Energy	-65.441138
Nuclear repulsion energy	31.641696

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3097	3097
2	A'	3002	3002
3	A'	2608	2608
4	A'	1524	1524
5	A'	1386	1386
6	A'	1281	1281
7	A'	1111	1111
8	A'	982	982
9	A'	594	594
10	A"	3144	3144
11	A"	2680	2680
12	A"	1492	1492
13	A"	1093	1093
14	A"	700	700
15	A"	132	132

Atom	x (Å)	y (Å)	z (Å)
C1	-0.016	-0.688	0.000
B2	-0.016	0.878	0.000
H3	1.053	-0.979	0.000
H4	-0.457	-1.139	0.898
H5	-0.457	-1.139	-0.898
H6	0.016	1.498	-1.030
H7	0.016	1.498	1.030

	C1	B2	H3	H4	H5	H6	H7
C1		1.5662	1.1076	1.0971	1.0971	2.4164	2.4164
B2	1.5662		2.1427	2.2512	2.2512	1.2020	1.2020
H3	1.1076	2.1427		1.7638	1.7638	2.8757	2.8757
H4	1.0971	2.2512	1.7638		1.7959	3.2998	2.6815
H5	1.0971	2.2512	1.7638	1.7959		2.6815	3.2998
H6	2.4164	1.2020	2.8757	3.2998	2.6815		2.0591
H7	2.4164	1.2020	2.8757	2.6815	3.2998	2.0591

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	B2	H6	121.028	C1	B2	H7	121.028
B2	C1	H3	105.225	B2	C1	H4	114.240
B2	C1	H5	114.240	H3	C1	H4	106.260
H3	C1	H5	106.260	H4	C1	H5	109.865
H6	B2	H7	117.855

All results from a given calculation for CH₃BH₂ (methylborane)

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

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(TQ)/6-31G*

States and conformations

All results from a given calculation for CH₃BH₂ (methylborane)