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	hartrees
Energy at 0K	-132.322581
Energy at 298.15K	-132.325137
HF Energy	-131.877977
Nuclear repulsion energy	59.321291

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3561	3339	6.14
2	A'	3264	3061	4.11
3	A'	2163	2028	245.21
4	A'	1504	1410	0.65
5	A'	1180	1106	33.58
6	A'	1091	1023	176.73
7	A'	754	707	83.97
8	A'	446	418	18.81
9	A"	3364	3155	0.03
10	A"	1039	975	0.00
11	A"	954	895	54.30
12	A"	408	382	0.02

Atom	x (Å)	y (Å)	z (Å)
C1	0.032	-1.257	0.000
C2	0.000	0.058	0.000
N3	-0.147	1.285	0.000
H4	0.054	-1.800	0.931
H5	0.054	-1.800	-0.931
H6	0.732	1.800	0.000

	C1	C2	N3	H4	H5	H6
C1		1.3153	2.5483	1.0779	1.0779	3.1359
C2	1.3153		1.2359	2.0786	2.0786	1.8895
N3	2.5483	1.2359		3.2285	3.2285	1.0191
H4	1.0779	2.0786	3.2285		1.8621	3.7794
H5	1.0779	2.0786	3.2285	1.8621		3.7794
H6	3.1359	1.8895	1.0191	3.7794	3.7794

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	174.544	C2	C1	H4	120.259
C2	C1	H5	120.259	C2	N3	H6	113.489
H4	C1	H5	119.473

All results from a given calculation for H₂CCNH (Ethenimine)

using model chemistry: CCD/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 H2CCNH (Ethenimine)

using model chemistry: CCD/6-31G**

States and conformations

All results from a given calculation for H₂CCNH (Ethenimine)