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	hartrees
Energy at 0K	-169.492627
Energy at 298.15K	-169.497031
HF Energy	-168.875650
Nuclear repulsion energy	74.739778

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3453	3279	1.05
2	A	3243	3080	17.86
3	A	3138	2979	25.89
4	A	1557	1479	1.02
5	A	1366	1297	24.21
6	A	1270	1206	30.26
7	A	1254	1191	11.98
8	A	1228	1166	3.11
9	A	1098	1043	10.71
10	A	979	930	17.68
11	A	920	873	27.19
12	A	765	726	2.67

Atom	x (Å)	y (Å)	z (Å)
C1	0.686	-0.337	0.017
N2	-0.735	-0.448	-0.160
O3	-0.030	0.865	0.019
H4	1.125	-0.625	0.965
H5	1.277	-0.537	-0.868
H6	-1.126	-0.605	0.770

	C1	N2	O3	H4	H5	H6
C1		1.4365	1.3994	1.0840	1.0821	1.9801
N2	1.4365		1.5013	2.1817	2.1347	1.0214
O3	1.3994	1.5013		2.1097	2.1122	1.9810
H4	1.0840	2.1817	2.1097		1.8406	2.2592
H5	1.0821	2.1347	2.1122	1.8406		2.9083
H6	1.9801	1.0214	1.9810	2.2592	2.9083

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	O3	56.845	C1	N2	H6	106.104
C1	O3	N2	59.246	N2	C1	O3	63.909
N2	C1	H4	119.233	N2	C1	H5	115.178
O3	C1	H4	115.733	O3	C1	H5	116.092
O3	N2	H6	101.803	H4	C1	H5	116.363

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

using model chemistry: MP2/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 CNOH3 (1,2-oxaziridine)

using model chemistry: MP2/cc-pVTZ

States and conformations

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