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	hartrees
Energy at 0K	-132.961341
Energy at 298.15K	-132.965451
HF Energy	-132.486748
Nuclear repulsion energy	64.082341

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3413	3413
2	A'	3266	3266
3	A'	3146	3146
4	A'	3078	3078
5	A'	1497	1497
6	A'	1438	1438
7	A'	1344	1344
8	A'	1227	1227
9	A'	1099	1099
10	A'	974	974
11	A'	471	471
12	A"	1007	1007
13	A"	783	783
14	A"	668	668
15	A"	490	490

Atom	x (Å)	y (Å)
C1	0.000	0.426
C2	1.167	-0.382
N3	-1.206	-0.140
H4	0.130	1.524
H5	2.166	0.067
H6	1.066	-1.473
H7	-1.926	0.598

	C1	C2	N3	H4	H5	H6	H7
C1		1.4198	1.3321	1.1049	2.1953	2.1783	1.9333
C2	1.4198		2.3850	2.1694	1.0947	1.0956	3.2442
N3	1.3321	2.3850		2.1337	3.3775	2.6340	1.0309
H4	1.1049	2.1694	2.1337		2.5030	3.1394	2.2550
H5	2.1953	1.0947	3.3775	2.5030		1.8918	4.1256
H6	2.1783	1.0956	2.6340	3.1394	1.8918		3.6386
H7	1.9333	3.2442	1.0309	2.2550	4.1256	3.6386

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	121.094	C1	C2	H6	119.432
C1	N3	H7	109.139	C2	C1	N3	120.117
C2	C1	H4	117.937	N3	C1	H4	121.946
H5	C2	H6	119.474

All results from a given calculation for CH₂CHNH (vinylazine)

using model chemistry: QCISD(TQ)/aug-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 CH2CHNH (vinylazine)

using model chemistry: QCISD(TQ)/aug-cc-pVDZ

States and conformations

All results from a given calculation for CH₂CHNH (vinylazine)