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	hartrees
Energy at 0K	-187.516386
Energy at 298.15K	-187.521204
HF Energy	-186.938004
Nuclear repulsion energy	102.564262

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3529	3328	2.39
2	A'	3134	2955	8.77
3	A'	2199	2074	3.73
4	A'	1731	1632	29.33
5	A'	1535	1447	6.77
6	A'	1401	1321	9.82
7	A'	1153	1088	16.34
8	A'	974	918	167.44
9	A'	874	824	53.14
10	A'	564	532	10.66
11	A'	205	193	12.30
12	A"	3630	3423	6.11
13	A"	3189	3007	3.51
14	A"	1424	1343	0.05
15	A"	1226	1156	0.01
16	A"	917	865	0.03
17	A"	398	375	26.37
18	A"	275	260	49.14

Atom	x (Å)	y (Å)	z (Å)
N1	-1.455	0.724	0.000
C2	0.000	0.837	0.000
C3	0.725	-0.454	0.000
N4	1.249	-1.512	0.000
H5	-1.761	0.198	0.817
H6	-1.761	0.198	-0.817
H7	0.309	1.410	0.879
H8	0.309	1.410	-0.879

	N1	C2	C3	N4	H5	H6	H7	H8
N1		1.4599	2.4779	3.5094	1.0183	1.0183	2.0871	2.0871
C2	1.4599		1.4803	2.6608	2.0436	2.0436	1.0935	1.0935
C3	2.4779	1.4803		1.1813	2.6963	2.6963	2.1019	2.1019
N4	3.5094	2.6608	1.1813		3.5571	3.5571	3.1929	3.1929
H5	1.0183	2.0436	2.6963	3.5571		1.6332	2.3995	2.9373
H6	1.0183	2.0436	2.6963	3.5571	1.6332		2.9373	2.3995
H7	2.0871	1.0935	2.1019	3.1929	2.3995	2.9373		1.7576
H8	2.0871	1.0935	2.1019	3.1929	2.9373	2.3995	1.7576

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	C3	114.864	N1	C2	H7	108.802
N1	C2	H8	108.802	C2	N1	H5	109.827
C2	N1	H6	109.827	C2	C3	N4	177.061
C3	C2	H7	108.567	C3	C2	H8	108.567
H5	N1	H6	106.630	H7	C2	H8	106.956

All results from a given calculation for NH₂CH₂CN (Aminoacetonitrile)

using model chemistry: MP2/6-31G*

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 NH2CH2CN (Aminoacetonitrile)

using model chemistry: MP2/6-31G*

States and conformations

All results from a given calculation for NH₂CH₂CN (Aminoacetonitrile)