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	hartrees
Energy at 0K	-32.990155
Energy at 298.15K	-32.994538
HF Energy	-32.501473
Nuclear repulsion energy	41.798739

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3423	3261	2.70
2	A	3254	3100	25.84
3	A	3135	2987	31.05
4	A	1567	1493	2.37
5	A	1371	1306	22.99
6	A	1265	1206	27.80
7	A	1249	1190	9.68
8	A	1217	1160	4.78
9	A	1088	1037	14.08
10	A	978	932	17.53
11	A	903	860	31.92
12	A	749	714	3.09

Atom	x (Å)	y (Å)	z (Å)
C1	0.688	-0.356	0.017
N2	-0.753	-0.444	-0.161
O3	-0.015	0.880	0.018
H4	1.130	-0.643	0.972
H5	1.277	-0.563	-0.874
H6	-1.152	-0.587	0.779

	C1	N2	O3	H4	H5	H6
C1		1.4549	1.4218	1.0909	1.0881	2.0050
N2	1.4549		1.5267	2.2064	2.1551	1.0306
O3	1.4218	1.5267		2.1309	2.1323	2.0062
H4	1.0909	2.2064	2.1309		1.8543	2.2904
H5	1.0881	2.1551	2.1323	1.8543		2.9382
H6	2.0050	1.0306	2.0062	2.2904	2.9382

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	O3	56.898	C1	N2	H6	106.284
C1	O3	N2	59.006	N2	C1	O3	64.096
N2	C1	H4	119.457	N2	C1	H5	115.110
O3	C1	H4	115.370	O3	C1	H5	115.690
O3	N2	H6	101.583	H4	C1	H5	116.635

All results from a given calculation for CNOH₃ (1,2-oxaziridine)

using model chemistry: MP2/CEP-121G*

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 CNOH3 (1,2-oxaziridine)

using model chemistry: MP2/CEP-121G*

States and conformations

All results from a given calculation for CNOH₃ (1,2-oxaziridine)