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	hartrees
Energy at 0K	-642.924201
Energy at 298.15K	-642.930099
HF Energy	-642.039691
Nuclear repulsion energy	275.636604

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3848	3658	24.44
2	A	1316	1251	256.87
3	A	1072	1019	59.61
4	A	817	777	16.10
5	A	441	419	31.12
6	A	311	296	76.53
7	E	3846	3656	170.04
7	E	3846	3656	170.04
8	E	1074	1021	62.43
8	E	1074	1021	62.43
9	E	929	883	312.77
9	E	929	883	312.77
10	E	441	419	74.47
10	E	441	419	74.47
11	E	367	349	41.31
11	E	367	349	41.31
12	E	155	148	70.97
12	E	155	148	70.97

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	0.125
O2	0.000	0.000	1.619
O3	0.000	1.452	-0.609
O4	1.258	-0.726	-0.609
O5	-1.258	-0.726	-0.609
H6	0.526	2.062	-0.069
H7	1.523	-1.486	-0.069
H8	-2.048	-0.576	-0.069

	P1	O2	O3	O4	O5	H6	H7	H8
P1		1.4933	1.6276	1.6276	1.6276	2.1365	2.1365	2.1365
O2	1.4933		2.6597	2.6597	2.6597	2.7155	2.7155	2.7155
O3	1.6276	2.6597		2.5153	2.5153	0.9697	3.3533	2.9326
O4	1.6276	2.6597	2.5153		2.5153	2.9326	0.9697	3.3533
O5	1.6276	2.6597	2.5153	2.5153		3.3533	2.9326	0.9697
H6	2.1365	2.7155	0.9697	2.9326	3.3533		3.6852	3.6852
H7	2.1365	2.7155	3.3533	0.9697	2.9326	3.6852		3.6852
H8	2.1365	2.7155	2.9326	3.3533	0.9697	3.6852	3.6852

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	O3	H6	107.997	P1	O4	H7	107.997
P1	O5	H8	107.997	O2	P1	O3	116.842
O2	P1	O4	116.842	O2	P1	O5	116.842
O3	P1	O4	101.196	O3	P1	O5	101.196
O4	P1	O5	101.196

All results from a given calculation for H₃PO₄ (Phosphoric Acid)

using model chemistry: MP2=FULL/cc-pVDZ

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 H3PO4 (Phosphoric Acid)

using model chemistry: MP2=FULL/cc-pVDZ

States and conformations

All results from a given calculation for H₃PO₄ (Phosphoric Acid)