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	hartrees
Energy at 0K	-634.118232
Energy at 298.15K
HF Energy	-633.904099
Nuclear repulsion energy	263.624423

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3842	3416	71.76
2	A	1391	1236	41.74
3	A	1177	1046	61.84
4	A	723	643	2.87
5	A	347	308	11.55
6	A	115	102	13.68
7	E	3840	3413	12.64
7	E	3840	3413	12.64
8	E	1341	1192	17.66
8	E	1341	1192	17.66
9	E	858	763	138.41
9	E	858	763	138.41
10	E	320	285	22.76
10	E	320	285	22.76
11	E	256	227	46.52
11	E	256	227	46.52
12	E	55i	49i	43.35
12	E	55i	49i	43.35

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	0.157
O2	0.000	0.000	1.692
O3	0.000	1.509	-0.667
O4	1.307	-0.754	-0.667
O5	-1.307	-0.754	-0.667
H6	0.375	2.137	0.041
H7	1.663	-1.394	0.041
H8	-2.039	-0.744	0.041

	P1	O2	O3	O4	O5	H6	H7	H8
P1		1.5342	1.7196	1.7196	1.7196	2.1730	2.1730	2.1730
O2	1.5342		2.8003	2.8003	2.8003	2.7263	2.7263	2.7263
O3	1.7196	2.8003		2.6135	2.6135	1.0186	3.4195	3.1195
O4	1.7196	2.8003	2.6135		2.6135	3.1195	1.0186	3.4195
O5	1.7196	2.8003	2.6135	2.6135		3.4195	3.1195	1.0186
H6	2.1730	2.7263	1.0186	3.1195	3.4195		3.7584	3.7584
H7	2.1730	2.7263	3.4195	1.0186	3.1195	3.7584		3.7584
H8	2.1730	2.7263	3.1195	3.4195	1.0186	3.7584	3.7584

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	O3	H6	101.985	P1	O4	H7	101.985
P1	O5	H8	101.985	O2	P1	O3	118.662
O2	P1	O4	118.662	O2	P1	O5	118.662
O3	P1	O4	98.912	O3	P1	O5	98.912
O4	P1	O5	98.912

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

using model chemistry: MP2=FULL/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 H3PO4 (Phosphoric Acid)

using model chemistry: MP2=FULL/STO-3G

States and conformations

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