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	hartrees
Energy at 0K	-187.615486
Energy at 298.15K	-187.620305
HF Energy	-186.956959
Nuclear repulsion energy	102.057291

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3487	3366
2	A'	3088	2980
3	A'	2169	2094
4	A'	1668	1610
5	A'	1467	1416
6	A'	1362	1315
7	A'	1141	1101
8	A'	975	941
9	A'	861	831
10	A'	553	534
11	A'	203	196
12	A"	3573	3448
13	A"	3143	3033
14	A"	1398	1350
15	A"	1196	1154
16	A"	894	863
17	A"	396	383
18	A"	279	269

Atom	x (Å)	y (Å)	z (Å)
N1	-1.462	0.740	0.000
C2	0.000	0.845	0.000
C3	0.724	-0.461	0.000
N4	1.246	-1.525	0.000
H5	-1.742	0.180	0.811
H6	-1.742	0.180	-0.811
H7	0.324	1.417	0.887
H8	0.324	1.417	-0.887

	N1	C2	C3	N4	H5	H6	H7	H8
N1		1.4656	2.4943	3.5303	1.0251	1.0251	2.1059	2.1059
C2	1.4656		1.4932	2.6775	2.0338	2.0338	1.1040	1.1040
C3	2.4943	1.4932		1.1851	2.6745	2.6745	2.1147	2.1147
N4	3.5303	2.6775	1.1851		3.5347	3.5347	3.2078	3.2078
H5	1.0251	2.0338	2.6745	3.5347		1.6226	2.4097	2.9471
H6	1.0251	2.0338	2.6745	3.5347	1.6226		2.9471	2.4097
H7	2.1059	1.1040	2.1147	3.2078	2.4097	2.9471		1.7741
H8	2.1059	1.1040	2.1147	3.2078	2.9471	2.4097	1.7741

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	C3	114.915	N1	C2	H7	109.267
N1	C2	H8	109.267	C2	N1	H5	108.179
C2	N1	H6	108.179	C2	C3	N4	177.096
C3	C2	H7	108.084	C3	C2	H8	108.084
H5	N1	H6	104.638	H7	C2	H8	106.926

All results from a given calculation for NH₂CH₂CN (Aminoacetonitrile)

using model chemistry: MP4=FULL/cc-pVDZ

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-pVDZ

States and conformations

All results from a given calculation for NH₂CH₂CN (Aminoacetonitrile)