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	hartrees
Energy at 0K	-131.441841
Energy at 298.15K	-131.444462
HF Energy	-131.131272
Nuclear repulsion energy	58.907043

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3333	3204	1.62
2	A'	3161	3038	2.98
3	A'	2109	2027	176.67
4	A'	1517	1458	5.44
5	A'	1143	1099	1.37
6	A'	1057	1015	351.54
7	A'	810	778	111.03
8	A'	474	456	25.41
9	A"	3240	3114	0.71
10	A"	1089	1046	0.48
11	A"	957	920	59.68
12	A"	431	414	1.00

Atom	x (Å)	y (Å)	z (Å)
C1	-0.076	-1.264	0.000
C2	0.000	0.056	0.000
N3	-0.027	1.295	0.000
H4	-0.110	-1.823	0.931
H5	-0.110	-1.823	-0.931
H6	0.860	1.825	0.000

	C1	C2	N3	H4	H5	H6
C1		1.3226	2.5599	1.0865	1.0865	3.2276
C2	1.3226		1.2392	2.1000	2.1000	1.9666
N3	2.5599	1.2392		3.2550	3.2550	1.0327
H4	1.0865	2.1000	3.2550		1.8627	3.8875
H5	1.0865	2.1000	3.2550	1.8627		3.8875
H6	3.2276	1.9666	1.0327	3.8875	3.8875

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	175.495	C2	C1	H4	120.996
C2	C1	H5	120.996	C2	N3	H6	119.631
H4	C1	H5	118.008

All results from a given calculation for H₂CCNH (Ethenimine)

using model chemistry: QCISD/3-21G*

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: QCISD/3-21G*

States and conformations

All results from a given calculation for H₂CCNH (Ethenimine)