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	hartrees
Energy at 0K	-187.695036
Energy at 298.15K	-187.699901
HF Energy	-186.990893
Nuclear repulsion energy	102.896339

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3555	3373	2.25
2	A'	3121	2960	10.80
3	A'	2194	2081	3.75
4	A'	1674	1588	24.21
5	A'	1493	1417	6.59
6	A'	1385	1314	11.76
7	A'	1146	1087	13.55
8	A'	972	922	141.96
9	A'	870	825	48.32
10	A'	569	540	10.07
11	A'	213	202	11.58
12	A"	3647	3459	5.63
13	A"	3173	3010	3.74
14	A"	1411	1338	0.15
15	A"	1211	1149	0.04
16	A"	908	862	0.25
17	A"	401	380	20.74
18	A"	282	268	44.04

Atom	x (Å)	y (Å)	z (Å)
N1	-1.454	0.723	0.000
C2	0.000	0.834	0.000
C3	0.721	-0.455	0.000
N4	1.246	-1.504	0.000
H5	-1.752	0.193	0.812
H6	-1.752	0.193	-0.812
H7	0.315	1.403	0.878
H8	0.315	1.403	-0.878

	N1	C2	C3	N4	H5	H6	H7	H8
N1		1.4582	2.4736	3.5002	1.0142	1.0142	2.0887	2.0887
C2	1.4582		1.4770	2.6500	2.0346	2.0346	1.0926	1.0926
C3	2.4736	1.4770		1.1736	2.6824	2.6824	2.0942	2.0942
N4	3.5002	2.6500	1.1736		3.5395	3.5395	3.1763	3.1763
H5	1.0142	2.0346	2.6824	3.5395		1.6233	2.3960	2.9313
H6	1.0142	2.0346	2.6824	3.5395	1.6233		2.9313	2.3960
H7	2.0887	1.0926	2.0942	3.1763	2.3960	2.9313		1.7567
H8	2.0887	1.0926	2.0942	3.1763	2.9313	2.3960	1.7567

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	C3	114.856	N1	C2	H7	109.104
N1	C2	H8	109.104	C2	N1	H5	109.443
C2	N1	H6	109.443	C2	C3	N4	177.323
C3	C2	H7	108.242	C3	C2	H8	108.242
H5	N1	H6	106.312	H7	C2	H8	107.011

All results from a given calculation for NH₂CH₂CN (Aminoacetonitrile)

using model chemistry: MP2=FULL/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 NH2CH2CN (Aminoacetonitrile)

using model chemistry: MP2=FULL/6-311G**

States and conformations

All results from a given calculation for NH₂CH₂CN (Aminoacetonitrile)