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	hartrees
Energy at 0K	-65.726867
Energy at 298.15K	-65.730824
HF Energy	-65.449697
Nuclear repulsion energy	31.860502

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3183	2965	16.50
2	A'	3080	2870	3.18
3	A'	2672	2490	113.93
4	A'	1530	1425	3.44
5	A'	1390	1295	72.01
6	A'	1309	1220	28.39
7	A'	1132	1054	74.18
8	A'	993	925	10.91
9	A'	585	545	0.78
10	A"	3234	3012	18.53
11	A"	2747	2559	171.12
12	A"	1491	1389	5.01
13	A"	1106	1030	19.47
14	A"	707	659	2.00
15	A"	144	134	1.10

Atom	x (Å)	y (Å)	z (Å)
C1	-0.016	-0.686	0.000
B2	-0.016	0.875	0.000
H3	1.046	-0.964	0.000
H4	-0.451	-1.133	0.891
H5	-0.451	-1.133	-0.891
H6	0.016	1.487	-1.019
H7	0.016	1.487	1.019

	C1	B2	H3	H4	H5	H6	H7
C1		1.5607	1.0981	1.0873	1.0873	2.4006	2.4006
B2	1.5607		2.1235	2.2390	2.2390	1.1894	1.1894
H3	1.0981	2.1235		1.7502	1.7502	2.8474	2.8474
H4	1.0873	2.2390	1.7502		1.7816	3.2758	2.6646
H5	1.0873	2.2390	1.7502	1.7816		2.6646	3.2758
H6	2.4006	1.1894	2.8474	3.2758	2.6646		2.0381
H7	2.4006	1.1894	2.8474	2.6646	3.2758	2.0381

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	B2	H6	120.998	C1	B2	H7	120.998
B2	C1	H3	104.665	B2	C1	H4	114.266
B2	C1	H5	114.266	H3	C1	H4	106.425
H3	C1	H5	106.425	H4	C1	H5	110.028
H6	B2	H7	117.906

All results from a given calculation for CH₃BH₂ (methylborane)

using model chemistry: MP3=FULL/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 CH3BH2 (methylborane)

using model chemistry: MP3=FULL/6-31+G**

States and conformations

All results from a given calculation for CH₃BH₂ (methylborane)