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	hartrees
Energy at 0K	-369.328127
Energy at 298.15K	-369.334685
HF Energy	-368.905013
Nuclear repulsion energy	59.489716

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	2513	2420
2	A₁	2494	2401
3	A₁	1113	1072
4	A₁	1027	989
5	A₁	556	535
6	A₂	247	238
7	E	2581	2485
7	E	2581	2485
8	E	2525	2432
8	E	2525	2432
9	E	1186	1142
9	E	1186	1142
10	E	1144	1102
10	E	1144	1101
11	E	847	815
11	E	847	815
12	E	381	367
12	E	380	366

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.377
P2	0.000	0.000	0.551
H3	0.000	-1.164	-1.663
H4	-1.008	0.582	-1.663
H5	1.008	0.582	-1.663
H6	0.000	1.238	1.204
H7	-1.072	-0.619	1.204
H8	1.072	-0.619	1.204

	B1	P2	H3	H4	H5	H6	H7	H8
B1		1.9270	1.1990	1.1990	1.1990	2.8625	2.8625	2.8625
P2	1.9270		2.5008	2.5008	2.5008	1.4002	1.4002	1.4002
H3	1.1990	2.5008		2.0167	2.0167	3.7406	3.1092	3.1092
H4	1.1990	2.5008	2.0167		2.0167	3.1092	3.1092	3.7406
H5	1.1990	2.5008	2.0167	2.0167		3.1092	3.7406	3.1092
H6	2.8625	1.4002	3.7406	3.1092	3.1092		2.1447	2.1447
H7	2.8625	1.4002	3.1092	3.1092	3.7406	2.1447		2.1447
H8	2.8625	1.4002	3.1092	3.7406	3.1092	2.1447	2.1447

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	P2	H6	117.835	B1	P2	H7	117.835
B1	P2	H8	117.835	P2	B1	H3	103.809
P2	B1	H4	103.809	P2	B1	H5	103.809
H3	B1	H4	114.491	H3	B1	H5	114.491
H4	B1	H5	114.490	H6	P2	H7	99.960
H6	P2	H8	99.960	H7	P2	H8	99.960

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

using model chemistry: MP4=FULL/cc-pVTZ

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=FULL/cc-pVTZ

States and conformations

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