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	hartrees
Energy at 0K	-65.734239
Energy at 298.15K	-65.738188
HF Energy	-65.451947
Nuclear repulsion energy	31.730751

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3123	3123	14.22
2	A'	3024	3024	2.93
3	A'	2580	2580	102.59
4	A'	1520	1520	6.01
5	A'	1377	1377	70.21
6	A'	1263	1263	27.67
7	A'	1111	1111	65.09
8	A'	980	980	10.41
9	A'	585	585	0.48
10	A"	3175	3175	16.56
11	A"	2654	2654	150.29
12	A"	1487	1487	6.75
13	A"	1090	1090	21.54
14	A"	699	699	0.95
15	A"	149	149	1.46

Atom	x (Å)	y (Å)	z (Å)
C1	-0.017	-0.687	0.000
B2	-0.017	0.876	0.000
H3	1.051	-0.967	0.000
H4	-0.448	-1.140	0.895
H5	-0.448	-1.140	-0.895
H6	0.015	1.494	-1.029
H7	0.015	1.494	1.029

	C1	B2	H3	H4	H5	H6	H7
C1		1.5628	1.1037	1.0920	1.0920	2.4113	2.4113
B2	1.5628		2.1297	2.2472	2.2472	1.2006	1.2006
H3	1.1037	2.1297		1.7546	1.7546	2.8611	2.8611
H4	1.0920	2.2472	1.7546		1.7903	3.2940	2.6769
H5	1.0920	2.2472	1.7546	1.7903		2.6769	3.2940
H6	2.4113	1.2006	2.8611	3.2940	2.6769		2.0582
H7	2.4113	1.2006	2.8611	2.6769	3.2940	2.0582

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	B2	H6	120.958	C1	B2	H7	120.958
B2	C1	H3	104.694	B2	C1	H4	114.491
B2	C1	H5	114.491	H3	C1	H4	106.092
H3	C1	H5	106.092	H4	C1	H5	110.110
H6	B2	H7	117.994

All results from a given calculation for CH₃BH₂ (methylborane)

using model chemistry: MP3=FULL/6-311G*

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/6-311G*

States and conformations

All results from a given calculation for CH₃BH₂ (methylborane)