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	hartrees
Energy at 0K	-132.282043
Energy at 298.15K	-132.284652
HF Energy	-131.885862
Nuclear repulsion energy	59.268097

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3577	3297	19.20
2	A'	3269	3013	8.14
3	A'	2179	2008	352.29
4	A'	1485	1369	1.27
5	A'	1194	1101	36.88
6	A'	1095	1009	166.43
7	A'	754	695	89.54
8	A'	482	444	20.86
9	A"	3375	3111	0.53
10	A"	1033	952	0.01
11	A"	940	866	51.46
12	A"	423	390	0.03

Atom	x (Å)	y (Å)	z (Å)
C1	-0.082	-1.255	0.000
C2	0.000	0.061	0.000
N3	-0.028	1.293	0.000
H4	-0.108	-1.797	0.942
H5	-0.108	-1.797	-0.942
H6	0.906	1.709	0.000

	C1	C2	N3	H4	H5	H6
C1		1.3193	2.5487	1.0872	1.0872	3.1248
C2	1.3193		1.2318	2.0867	2.0867	1.8804
N3	2.5487	1.2318		3.2316	3.2316	1.0228
H4	1.0872	2.0867	3.2316		1.8843	3.7700
H5	1.0872	2.0867	3.2316	1.8843		3.7700
H6	3.1248	1.8804	1.0228	3.7700	3.7700

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	175.130	C2	C1	H4	119.937
C2	C1	H5	119.937	C2	N3	H6	112.708
H4	C1	H5	120.120

All results from a given calculation for H₂CCNH (Ethenimine)

using model chemistry: CISD/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 H2CCNH (Ethenimine)

using model chemistry: CISD/cc-pVDZ

States and conformations

All results from a given calculation for H₂CCNH (Ethenimine)