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	hartrees
Energy at 0K	-139.552705
Energy at 298.15K
HF Energy	-139.142377
Nuclear repulsion energy	55.870075

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	2558	2406	5.59	237.01	0.00	0.00
2	A₁	2151	2023	276.57	158.74	0.29	0.45
3	A₁	1141	1073	17.71	28.91	0.51	0.67
4	A₁	699	658	35.29	0.30	0.09	0.17
5	E	2646	2489	62.69	114.22	0.75	0.86
5	E	2646	2489	62.69	114.22	0.75	0.86
6	E	1172	1102	0.00	17.15	0.75	0.86
6	E	1172	1102	0.00	17.15	0.75	0.86
7	E	846	796	0.38	0.25	0.75	0.86
7	E	846	796	0.38	0.25	0.75	0.86
8	E	299	281	9.87	0.19	0.75	0.86
8	E	299	281	9.87	0.19	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.367
C2	0.000	0.000	0.186
O3	0.000	0.000	1.336
H4	0.000	1.166	-1.655
H5	1.010	-0.583	-1.655
H6	-1.010	-0.583	-1.655

	B1	C2	O3	H4	H5	H6
B1		1.5535	2.7031	1.2008	1.2008	1.2008
C2	1.5535		1.1495	2.1791	2.1791	2.1791
O3	2.7031	1.1495		3.2098	3.2098	3.2098
H4	1.2008	2.1791	3.2098		2.0193	2.0193
H5	1.2008	2.1791	3.2098	2.0193		2.0193
H6	1.2008	2.1791	3.2098	2.0193	2.0193

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	C2	O3	180.000	C2	B1	H4	103.852
C2	B1	H5	103.852	C2	B1	H6	103.852
H4	B1	H5	114.458	H4	B1	H6	114.458
H5	B1	H6	114.458

All results from a given calculation for BH₃CO (Borane carbonyl)

using model chemistry: MP2/6-31+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 BH3CO (Borane carbonyl)

using model chemistry: MP2/6-31+G**

States and conformations

All results from a given calculation for BH₃CO (Borane carbonyl)