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	hartrees
Energy at 0K	-133.527636
Energy at 298.15K
HF Energy	-133.048148
Nuclear repulsion energy	76.294079

Atom	x (Å)	y (Å)	z (Å)
N1	-0.038	0.868	0.000
H2	0.884	1.285	0.000
C3	-0.038	-0.393	0.741
C4	-0.038	-0.393	-0.741
H5	-0.948	-0.609	1.283
H6	0.867	-0.713	1.241
H7	-0.948	-0.609	-1.283
H8	0.867	-0.713	-1.241

	N1	H2	C3	C4	H5	H6	H7	H8
N1		1.0120	1.4628	1.4628	2.1576	2.2040	2.1576	2.2040
H2	1.0120		2.0532	2.0532	2.9307	2.3516	2.9307	2.3516
C3	1.4628	2.0532		1.4812	1.0807	1.0823	2.2288	2.2014
C4	1.4628	2.0532	1.4812		2.2288	2.2014	1.0807	1.0823
H5	2.1576	2.9307	1.0807	2.2288		1.8183	2.5653	3.1098
H6	2.2040	2.3516	1.0823	2.2014	1.8183		3.1098	2.4810
H7	2.1576	2.9307	2.2288	1.0807	2.5653	3.1098		1.8183
H8	2.2040	2.3516	2.2014	1.0823	3.1098	2.4810	1.8183

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C3	C4	59.583	N1	C3	H5	115.228
N1	C3	H6	119.239	N1	C4	C3	59.583
N1	C4	H7	115.228	N1	C4	H8	119.239
H2	N1	C3	110.803	H2	N1	C4	110.803
C3	N1	C4	60.834	C3	C4	H7	120.103
C3	C4	H8	117.511	C4	C3	H5	120.103
C4	C3	H6	117.511	H5	C3	H6	114.414
H7	C4	H8	114.414

All results from a given calculation for C₂H₅N (Aziridine)

using model chemistry: MP3/6-31+G**

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 C2H5N (Aziridine)

using model chemistry: MP3/6-31+G**

States and conformations

All results from a given calculation for C₂H₅N (Aziridine)