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	hartrees
Energy at 0K	-132.388932
Energy at 298.15K	-132.391104
HF Energy	-131.884819
Nuclear repulsion energy	59.152303

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3583	3399	17.27
2	A'	3531	3350	80.88
3	A'	2211	2097	77.93
4	A'	1644	1560	30.21
5	A'	1070	1015	10.09
6	A'	745	706	223.74
7	A'	527	500	85.05
8	A'	391	371	6.65
9	A"	3682	3492	30.17
10	A"	1221	1158	0.12
11	A"	665	631	39.18
12	A"	354	336	4.33

Atom	x (Å)	y (Å)	z (Å)
C1	-0.026	1.374	0.000
C2	0.000	0.159	0.000
N3	0.113	-1.199	0.000
H4	-0.063	2.435	0.000
H5	-0.285	-1.619	0.830
H6	-0.285	-1.619	-0.830

	C1	C2	N3	H4	H5	H6
C1		1.2153	2.5768	1.0621	3.1163	3.1163
C2	1.2153		1.3627	2.2773	1.9823	1.9823
N3	2.5768	1.3627		3.6387	1.0115	1.0115
H4	1.0621	2.2773	3.6387		4.1439	4.1439
H5	3.1163	1.9823	1.0115	4.1439		1.6597
H6	3.1163	1.9823	1.0115	4.1439	1.6597

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	176.473	C2	C1	H4	179.212
C2	N3	H5	112.378	C2	N3	H6	112.378
H5	N3	H6	110.256

All results from a given calculation for HCCNH₂ (Ethynamine)

using model chemistry: MP2=FULL/6-311G**

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 HCCNH2 (Ethynamine)

using model chemistry: MP2=FULL/6-311G**

States and conformations

All results from a given calculation for HCCNH₂ (Ethynamine)