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	hartrees
Energy at 0K	-155.571423
Energy at 298.15K	-155.574076
Nuclear repulsion energy	35.391033

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3297	3259	4.07
2	A'	1566	1549	35.96
3	A'	1230	1216	72.92
4	A'	890	880	32.95
5	A"	3411	3372	0.58
6	A"	1287	1272	0.89

Atom	x (Å)	y (Å)	z (Å)
N1	-0.067	0.705	0.000
F2	-0.067	-0.747	0.000
H3	0.536	0.894	0.819
H4	0.536	0.894	-0.819

	N1	F2	H3	H4
N1		1.4513	1.0342	1.0342
F2	1.4513		1.9306	1.9306
H3	1.0342	1.9306		1.6374
H4	1.0342	1.9306	1.6374

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	N1	H3	100.580		F2	N1	H4	100.580
H3	N1	H4	104.665

All results from a given calculation for NH₂F (monofluoroamine)

using model chemistry: PBEPBE/6-31+G**

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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Number	Element	Mulliken
1	N	-0.429
2	F	-0.194
3	H	0.312
4	H	0.312

	x	y	z	Total
	2.008	1.495	0.000	2.504
CHELPG
AIM
ESP

	x	y	z
x	1.705	0.127	0.000
y	0.127	2.285	0.000
z	0.000	0.000	1.785

<r²>	19.234
(<r²>)^1/2	4.386

All results from a given calculation for NH2F (monofluoroamine)

using model chemistry: PBEPBE/6-31+G**

States and conformations

All results from a given calculation for NH₂F (monofluoroamine)