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	hartrees
Energy at 0K	-132.507688
Energy at 298.15K	-132.509814
HF Energy	-131.901275
Nuclear repulsion energy	59.322795

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3555	3423
2	A'	3500	3370
3	A'	2193	2112
4	A'	1654	1593
5	A'	1065	1025
6	A'	705	679
7	A'	492	473
8	A'	394	380
9	A"	3645	3510
10	A"	1218	1172
11	A"	639	615
12	A"	359	345

Atom	x (Å)	y (Å)	z (Å)
C1	-0.037	1.370	0.000
C2	0.000	0.160	0.000
N3	0.119	-1.195	0.000
H4	-0.073	2.425	0.000
H5	-0.270	-1.620	0.828
H6	-0.270	-1.620	-0.828

	C1	C2	N3	H4	H5	H6
C1		1.2107	2.5695	1.0560	3.1116	3.1116
C2	1.2107		1.3599	2.2667	1.9818	1.9818
N3	2.5695	1.3599		3.6253	1.0087	1.0087
H4	1.0560	2.2667	3.6253		4.1344	4.1344
H5	3.1116	1.9818	1.0087	4.1344		1.6552
H6	3.1116	1.9818	1.0087	4.1344	1.6552

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	176.718	C2	C1	H4	179.781
C2	N3	H5	112.743	C2	N3	H6	112.743
H5	N3	H6	110.255

All results from a given calculation for HCCNH₂ (Ethynamine)

using model chemistry: MP4=FULL/cc-pVTZ

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: MP4=FULL/cc-pVTZ

States and conformations

All results from a given calculation for HCCNH₂ (Ethynamine)