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	hartrees
Energy at 0K	-364.837992
Energy at 298.15K	-364.844579
HF Energy	-364.754821
Nuclear repulsion energy	58.733378

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2935	2559	12.99
2	A₁	2930	2555	6.45
3	A₁	1404	1225	122.43
4	A₁	1230	1072	220.70
5	A₁	571	498	10.44
6	A₂	168	147	0.00
7	E	3116	2717	34.15
7	E	3116	2717	34.15
8	E	2991	2607	0.03
8	E	2991	2607	0.03
9	E	1486	1295	11.64
9	E	1486	1295	11.64
10	E	1365	1190	21.51
10	E	1365	1190	21.51
11	E	1050	916	0.00
11	E	1050	916	0.00
12	E	477	416	2.14
12	E	477	416	2.14

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.430
P2	0.000	0.000	0.573
H3	0.000	-1.140	-1.708
H4	-0.987	0.570	-1.708
H5	0.987	0.570	-1.708
H6	0.000	1.227	1.228
H7	-1.063	-0.614	1.228
H8	1.063	-0.614	1.228

	B1	P2	H3	H4	H5	H6	H7	H8
B1		2.0023	1.1731	1.1731	1.1731	2.9269	2.9269	2.9269
P2	2.0023		2.5495	2.5495	2.5495	1.3910	1.3910	1.3910
H3	1.1731	2.5495		1.9739	1.9739	3.7709	3.1660	3.1660
H4	1.1731	2.5495	1.9739		1.9739	3.1660	3.1660	3.7709
H5	1.1731	2.5495	1.9739	1.9739		3.1660	3.7709	3.1660
H6	2.9269	1.3910	3.7709	3.1660	3.1660		2.1256	2.1256
H7	2.9269	1.3910	3.1660	3.1660	3.7709	2.1256		2.1256
H8	2.9269	1.3910	3.1660	3.7709	3.1660	2.1256	2.1256

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	P2	H6	118.087	B1	P2	H7	118.087
B1	P2	H8	118.087	P2	B1	H3	103.724
P2	B1	H4	103.724	P2	B1	H5	103.724
H3	B1	H4	114.556	H3	B1	H5	114.556
H4	B1	H5	114.556	H6	P2	H7	99.643
H6	P2	H8	99.643	H7	P2	H8	99.643

All results from a given calculation for BH₃PH₃ (borane phosphine)

using model chemistry: MP2/STO-3G

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 BH3PH3 (borane phosphine)

using model chemistry: MP2/STO-3G

States and conformations

All results from a given calculation for BH₃PH₃ (borane phosphine)