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	hartrees
Energy at 0K	-187.612764
Energy at 298.15K	-187.617587
HF Energy	-186.958575
Nuclear repulsion energy	102.200175

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3481	3353
2	A'	3086	2973
3	A'	2268	2185
4	A'	1668	1607
5	A'	1467	1413
6	A'	1364	1314
7	A'	1141	1099
8	A'	977	941
9	A'	863	831
10	A'	555	534
11	A'	205	197
12	A"	3565	3434
13	A"	3139	3024
14	A"	1399	1348
15	A"	1197	1153
16	A"	895	862
17	A"	396	381
18	A"	279	269

Atom	x (Å)	y (Å)	z (Å)
N1	-1.462	0.738	0.000
C2	0.000	0.844	0.000
C3	0.725	-0.463	0.000
N4	1.245	-1.519	0.000
H5	-1.742	0.177	0.811
H6	-1.742	0.177	-0.811
H7	0.325	1.415	0.887
H8	0.325	1.415	-0.887

	N1	C2	C3	N4	H5	H6	H7	H8
N1		1.4656	2.4948	3.5243	1.0254	1.0254	2.1065	2.1065
C2	1.4656		1.4947	2.6714	2.0344	2.0344	1.1039	1.1039
C3	2.4948	1.4947		1.1774	2.6753	2.6753	2.1152	2.1152
N4	3.5243	2.6714	1.1774		3.5301	3.5301	3.2007	3.2007
H5	1.0254	2.0344	2.6753	3.5301		1.6230	2.4105	2.9480
H6	1.0254	2.0344	2.6753	3.5301	1.6230		2.9480	2.4105
H7	2.1065	1.1039	2.1152	3.2007	2.4105	2.9480		1.7747
H8	2.1065	1.1039	2.1152	3.2007	2.9480	2.4105	1.7747

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	C3	114.858	N1	C2	H7	109.327
N1	C2	H8	109.327	C2	N1	H5	108.220
C2	N1	H6	108.220	C2	C3	N4	177.184
C3	C2	H7	108.024	C3	C2	H8	108.024
H5	N1	H6	104.636	H7	C2	H8	106.988

All results from a given calculation for NH₂CH₂CN (Aminoacetonitrile)

using model chemistry: CCSD(T)=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: CCSD(T)=FULL/cc-pVDZ

States and conformations

All results from a given calculation for NH₂CH₂CN (Aminoacetonitrile)