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	hartrees
Energy at 0K	-187.563112
Energy at 298.15K	-187.567900
HF Energy	-186.938927
Nuclear repulsion energy	102.386208

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3469	3327
2	A'	3082	2957
3	A'	2281	2188
4	A'	1723	1653
5	A'	1517	1456
6	A'	1386	1330
7	A'	1143	1097
8	A'	971	931
9	A'	864	829
10	A'	554	532
11	A'	202	193
12	A"	3559	3414
13	A"	3130	3003
14	A"	1413	1356
15	A"	1214	1164
16	A"	907	870
17	A"	392	376
18	A"	272	261

Atom	x (Å)	y (Å)	z (Å)
N1	-1.460	0.728	0.000
C2	0.000	0.840	0.000
C3	0.727	-0.461	0.000
N4	1.251	-1.512	0.000
H5	-1.762	0.194	0.818
H6	-1.762	0.194	-0.818
H7	0.313	1.411	0.883
H8	0.313	1.411	-0.883

	N1	C2	C3	N4	H5	H6	H7	H8
N1		1.4647	2.4899	3.5171	1.0219	1.0219	2.0958	2.0958
C2	1.4647		1.4898	2.6635	2.0466	2.0466	1.0973	1.0973
C3	2.4899	1.4898		1.1745	2.7004	2.7004	2.1106	2.1106
N4	3.5171	2.6635	1.1745		3.5574	3.5574	3.1943	3.1943
H5	1.0219	2.0466	2.7004	3.5574		1.6352	2.4066	2.9459
H6	1.0219	2.0466	2.7004	3.5574	1.6352		2.9459	2.4066
H7	2.0958	1.0973	2.1106	3.1943	2.4066	2.9459		1.7652
H8	2.0958	1.0973	2.1106	3.1943	2.9459	2.4066	1.7652

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	C3	114.859	N1	C2	H7	108.931
N1	C2	H8	108.931	C2	N1	H5	109.489
C2	N1	H6	109.489	C2	C3	N4	177.259
C3	C2	H7	108.379	C3	C2	H8	108.379
H5	N1	H6	106.268	H7	C2	H8	107.087

All results from a given calculation for NH₂CH₂CN (Aminoacetonitrile)

using model chemistry: QCISD(T)/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: QCISD(T)/6-31G*

States and conformations

All results from a given calculation for NH₂CH₂CN (Aminoacetonitrile)