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	hartrees
Energy at 0K	-367.127907
Energy at 298.15K	-367.134239
HF Energy	-366.953566
Nuclear repulsion energy	56.861929

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	2492	2417
2	A₁	2332	2261
3	A₁	1138	1103
4	A₁	1004	973
5	A₁	376	365
6	A₂	200	194
7	E	2589	2511
7	E	2589	2511
8	E	2339	2269
8	E	2339	2269
9	E	1181	1145
9	E	1180	1145
10	E	1126	1092
10	E	1126	1092
11	E	880	853
11	E	880	853
12	E	377	366
12	E	377	365

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.487
P2	0.000	0.000	0.595
H3	0.000	-1.186	-1.748
H4	-1.027	0.593	-1.748
H5	1.027	0.593	-1.748
H6	0.000	1.267	1.254
H7	-1.097	-0.633	1.254
H8	1.097	-0.633	1.254

	B1	P2	H3	H4	H5	H6	H7	H8
B1		2.0815	1.2143	1.2143	1.2143	3.0194	3.0194	3.0194
P2	2.0815		2.6259	2.6259	2.6259	1.4280	1.4280	1.4280
H3	1.2143	2.6259		2.0538	2.0538	3.8767	3.2438	3.2438
H4	1.2143	2.6259	2.0538		2.0538	3.2438	3.2438	3.8767
H5	1.2143	2.6259	2.0538	2.0538		3.2438	3.8767	3.2438
H6	3.0194	1.4280	3.8767	3.2438	3.2438		2.1939	2.1939
H7	3.0194	1.4280	3.2438	3.2438	3.8767	2.1939		2.1939
H8	3.0194	1.4280	3.2438	3.8767	3.2438	2.1939	2.1939

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	P2	H6	117.501	B1	P2	H7	117.501
B1	P2	H8	117.501	P2	B1	H3	102.434
P2	B1	H4	102.434	P2	B1	H5	102.434
H3	B1	H4	115.497	H3	B1	H5	115.497
H4	B1	H5	115.497	H6	P2	H7	100.379
H6	P2	H8	100.379	H7	P2	H8	100.379

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

using model chemistry: MP4/3-21G

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: MP4/3-21G

States and conformations

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