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	hartrees
Energy at 0K	-207.576539
Energy at 298.15K
HF Energy	-206.768919
Nuclear repulsion energy	105.004221

Atom	x (Å)	y (Å)
C1	1.199	1.219
C2	0.000	0.648
N3	-0.044	-0.783
O4	-1.167	-1.223
H5	2.086	0.602
H6	1.315	2.292
H7	-0.951	1.165

	C1	C2	N3	O4	H5	H6	H7
C1		1.3284	2.3574	3.4006	1.0802	1.0786	2.1507
C2	1.3284		1.4324	2.2052	2.0862	2.1048	1.0820
N3	2.3574	1.4324		1.2059	2.5406	3.3621	2.1491
O4	3.4006	2.2052	1.2059		3.7295	4.3026	2.3977
H5	1.0802	2.0862	2.5406	3.7295		1.8573	3.0881
H6	1.0786	2.1048	3.3621	4.3026	1.8573		2.5303
H7	2.1507	1.0820	2.1491	2.3977	3.0881	2.5303

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	117.219	C1	C2	H7	126.012
C2	C1	H5	119.674	C2	C1	H6	121.614
C2	N3	O4	113.129	N3	C2	H7	116.768
H5	C1	H6	118.712

All results from a given calculation for C₂H₃NO (Nitrosoethylene)

using model chemistry: CCSD/cc-pVQZ

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 C2H3NO (Nitrosoethylene)

using model chemistry: CCSD/cc-pVQZ

States and conformations

All results from a given calculation for C₂H₃NO (Nitrosoethylene)