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	hartrees
Energy at 0K	-187.856348
Energy at 298.15K	-187.861174
HF Energy	-187.012705
Nuclear repulsion energy	103.161456

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3524	3394
2	A'	3090	2976
3	A'	2190	2109
4	A'	1676	1614
5	A'	1487	1432
6	A'	1372	1321
7	A'	1128	1086
8	A'	949	914
9	A'	852	820
10	A'	563	542
11	A'	214	206
12	A"	3606	3473
13	A"	3119	3003
14	A"	1400	1348
15	A"	1205	1160
16	A"	893	860
17	A"	389	374
18	A"	274	263

Atom	x (Å)	y (Å)	z (Å)
N1	-1.452	0.724	0.000
C2	0.000	0.830	0.000
C3	0.718	-0.457	0.000
N4	1.247	-1.499	0.000
H5	-1.754	0.199	0.810
H6	-1.754	0.199	-0.810
H7	0.317	1.395	0.873
H8	0.317	1.395	-0.873

	N1	C2	C3	N4	H5	H6	H7	H8
N1		1.4556	2.4707	3.4962	1.0116	1.0116	2.0835	2.0835
C2	1.4556		1.4741	2.6419	2.0329	2.0329	1.0872	1.0872
C3	2.4707	1.4741		1.1683	2.6835	2.6835	2.0865	2.0865
N4	3.4962	2.6419	1.1683		3.5420	3.5420	3.1626	3.1626
H5	1.0116	2.0329	2.6835	3.5420		1.6197	2.3928	2.9248
H6	1.0116	2.0329	2.6835	3.5420	1.6197		2.9248	2.3928
H7	2.0835	1.0872	2.0865	3.1626	2.3928	2.9248		1.7465
H8	2.0835	1.0872	2.0865	3.1626	2.9248	2.3928	1.7465

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	C3	114.978	N1	C2	H7	109.187
N1	C2	H8	109.187	C2	N1	H5	109.655
C2	N1	H6	109.655	C2	C3	N4	177.725
C3	C2	H7	108.151	C3	C2	H8	108.151
H5	N1	H6	106.372	H7	C2	H8	106.882

All results from a given calculation for NH₂CH₂CN (Aminoacetonitrile)

using model chemistry: MP4=FULL/cc-pVTZ

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: MP4=FULL/cc-pVTZ

States and conformations

All results from a given calculation for NH₂CH₂CN (Aminoacetonitrile)