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	hartrees
Energy at 0K	-369.442896
Energy at 298.15K	-369.449439
HF Energy	-368.903316
Nuclear repulsion energy	59.428143

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	2523	2523
2	A₁	2489	2489
3	A₁	1116	1116
4	A₁	1038	1038
5	A₁	543	543
6	A₂	246	246
7	E	2574	2574
7	E	2574	2574
8	E	2531	2531
8	E	2531	2531
9	E	1181	1181
9	E	1181	1181
10	E	1155	1155
10	E	1154	1154
11	E	848	848
11	E	848	848
12	E	382	382
12	E	382	382

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.380
P2	0.000	0.000	0.551
H3	0.000	-1.169	-1.661
H4	-1.012	0.584	-1.661
H5	1.012	0.584	-1.661
H6	0.000	1.237	1.205
H7	-1.071	-0.618	1.205
H8	1.071	-0.618	1.205

	B1	P2	H3	H4	H5	H6	H7	H8
B1		1.9318	1.2020	1.2020	1.2020	2.8658	2.8658	2.8658
P2	1.9318		2.5024	2.5024	2.5024	1.3989	1.3989	1.3989
H3	1.2020	2.5024		2.0243	2.0243	3.7419	3.1088	3.1088
H4	1.2020	2.5024	2.0243		2.0243	3.1089	3.1088	3.7419
H5	1.2020	2.5024	2.0243	2.0243		3.1089	3.7419	3.1088
H6	2.8658	1.3989	3.7419	3.1089	3.1089		2.1424	2.1424
H7	2.8658	1.3989	3.1088	3.1088	3.7419	2.1424		2.1424
H8	2.8658	1.3989	3.1088	3.7419	3.1088	2.1424	2.1424

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	P2	H6	117.845	B1	P2	H7	117.845
B1	P2	H8	117.845	P2	B1	H3	103.519
P2	B1	H4	103.519	P2	B1	H5	103.519
H3	B1	H4	114.710	H3	B1	H5	114.710
H4	B1	H5	114.710	H6	P2	H7	99.947
H6	P2	H8	99.947	H7	P2	H8	99.947

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

using model chemistry: MP4=FULL/Def2TZVPP

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/Def2TZVPP

States and conformations

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