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	hartrees
Energy at 0K	-187.789976
Energy at 298.15K	-187.794776
HF Energy	-187.013352
Nuclear repulsion energy	102.965037

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3505	3417
2	A'	3079	3001
3	A'	2276	2218
4	A'	1673	1631
5	A'	1481	1444
6	A'	1370	1335
7	A'	1124	1095
8	A'	949	925
9	A'	849	828
10	A'	560	546
11	A'	211	205
12	A"	3588	3497
13	A"	3122	3044
14	A"	1398	1363
15	A"	1203	1173
16	A"	894	872
17	A"	381	371
18	A"	266	260

Atom	x (Å)	y (Å)	z (Å)
N1	-1.457	0.725	0.000
C2	0.000	0.834	0.000
C3	0.723	-0.461	0.000
N4	1.248	-1.500	0.000
H5	-1.756	0.194	0.810
H6	-1.756	0.194	-0.810
H7	0.318	1.399	0.877
H8	0.318	1.399	-0.877

	N1	C2	C3	N4	H5	H6	H7	H8
N1		1.4606	2.4814	3.5014	1.0139	1.0139	2.0910	2.0910
C2	1.4606		1.4836	2.6464	2.0370	2.0370	1.0905	1.0905
C3	2.4814	1.4836		1.1633	2.6890	2.6890	2.0961	2.0961
N4	3.5014	2.6464	1.1633		3.5418	3.5418	3.1679	3.1679
H5	1.0139	2.0370	2.6890	3.5418		1.6206	2.3994	2.9326
H6	1.0139	2.0370	2.6890	3.5418	1.6206		2.9326	2.3994
H7	2.0910	1.0905	2.0961	3.1679	2.3994	2.9326		1.7541
H8	2.0910	1.0905	2.0961	3.1679	2.9326	2.3994	1.7541

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	C3	114.871	N1	C2	H7	109.242
N1	C2	H8	109.242	C2	N1	H5	109.486
C2	N1	H6	109.486	C2	C3	N4	177.629
C3	C2	H7	108.066	C3	C2	H8	108.066
H5	N1	H6	106.103	H7	C2	H8	107.072

All results from a given calculation for NH₂CH₂CN (Aminoacetonitrile)

using model chemistry: CCSD(T)/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: CCSD(T)/cc-pVTZ

States and conformations

All results from a given calculation for NH₂CH₂CN (Aminoacetonitrile)