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	hartrees
Energy at 0K	-132.629668
Energy at 298.15K	-132.634042
HF Energy	-132.243254
Counterpoise corrected energy
CP Energy at 298.15K
Counterpoise optimized geometry corrected energy
CP opt. Energy at 298.15K
Nuclear repulsion energy	39.002024

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3952	3756	51.05
2	A'	3705	3521	347.24
3	A'	3686	3503	6.45
4	A'	3541	3365	4.28
5	A'	1801	1711	85.65
6	A'	1764	1677	40.45
7	A'	1194	1134	201.30
8	A'	479	455	122.24
9	A'	224	213	3.85
10	A'	180	171	54.49
11	A"	3686	3503	6.34
12	A"	1760	1672	33.78
13	A"	758	720	230.16
14	A"	137	130	26.09
15	A"	14	13	108.59

Atom	x (Å)	y (Å)	z (Å)
H1	-0.067	0.633	0.000
O2	-0.035	1.596	0.000
N3	-0.035	-1.416	0.000
H4	0.888	1.845	0.000
H5	0.829	-1.943	0.000
H6	-0.563	-1.696	0.816
H7	-0.563	-1.696	-0.816

	H1	O2	N3	H4	H5	H6	H7
H1		0.9637	2.0499	1.5434	2.7273	2.5175	2.5175
O2	0.9637		3.0128	0.9561	3.6430	3.4330	3.4330
N3	2.0499	3.0128		3.3900	1.0112	1.0116	1.0116
H4	1.5434	0.9561	3.3900		3.7887	3.9135	3.9135
H5	2.7273	3.6430	1.0112	3.7887		1.6322	1.6322
H6	2.5175	3.4330	1.0116	3.9135	1.6322		1.6319
H7	2.5175	3.4330	1.0116	3.9135	1.6322	1.6319

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H1	O2	H4	107.011	H1	N3	H5	122.269
H1	N3	H6	105.559	H1	N3	H7	105.559
O2	H1	N3	177.186	H5	N3	H6	107.590
H5	N3	H7	107.590	H6	N3	H7	107.526

All results from a given calculation for H₂ONH₃ (Water Ammonia Dimer)

using model chemistry: MP2/6-311G*

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 H2ONH3 (Water Ammonia Dimer)

using model chemistry: MP2/6-311G*

States and conformations

All results from a given calculation for H₂ONH₃ (Water Ammonia Dimer)