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	hartrees
Energy at 0K	-27.589472
Energy at 298.15K	-27.594863
HF Energy	-27.157109
Nuclear repulsion energy	40.599980

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3711	3523	25.15
2	A	3579	3398	22.54
3	A	3536	3357	3.20
4	A	3128	2970	61.50
5	A	1729	1642	240.64
6	A	1645	1562	34.45
7	A	1407	1336	17.35
8	A	1348	1280	24.08
9	A	1135	1078	86.12
10	A	1098	1043	29.16
11	A	1033	981	1.19
12	A	821	780	26.81
13	A	663	629	405.13
14	A	545	517	5.50
15	A	421	400	105.51

Atom	x (Å)	y (Å)	z (Å)
C1	-0.122	0.408	-0.002
N2	1.159	-0.150	-0.088
N3	-1.188	-0.343	0.020
H4	-0.116	1.513	-0.022
H5	1.894	0.377	0.381
H6	1.168	-1.148	0.131
H7	-2.016	0.266	-0.002

	C1	N2	N3	H4	H5	H6	H7
C1		1.4003	1.3038	1.1056	2.0528	2.0256	1.8987
N2	1.4003		2.3574	2.0966	1.0191	1.0218	3.2032
N3	1.3038	2.3574		2.1442	3.1857	2.4920	1.0283
H4	1.1056	2.0966	2.1442		2.3437	2.9586	2.2728
H5	2.0528	1.0191	3.1857	2.3437		1.7075	3.9304
H6	2.0256	1.0218	2.4920	2.9586	1.7075		3.4864
H7	1.8987	3.2032	1.0283	2.2728	3.9304	3.4864

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H5	115.186	C1	N2	H6	112.569
C1	N3	H7	108.432	N2	C1	N3	121.295
N2	C1	H4	113.057	N3	C1	H4	125.532
H5	N2	H6	113.569

All results from a given calculation for NHCHNH₂ (aminomethanimine)

using model chemistry: MP2/CEP-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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Number	Element	Mulliken
1	C	-0.261
2	N	-0.535
3	N	-0.298
4	H	0.162
5	H	0.320
6	H	0.348
7	H	0.264

	x	y	z
x	0.000	0.000	0.000
y	0.000	0.000	0.000
z	0.000	0.000	0.000

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for NHCHNH2 (aminomethanimine)

using model chemistry: MP2/CEP-31G*

States and conformations

All results from a given calculation for NHCHNH₂ (aminomethanimine)