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	hartrees
Energy at 0K	-169.579762
Energy at 298.15K	-169.584144
HF Energy	-168.875182
Nuclear repulsion energy	74.624289

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3422	3295
2	A	3198	3079
3	A	3118	3002
4	A	1560	1502
5	A	1361	1311
6	A	1266	1219
7	A	1246	1200
8	A	1232	1186
9	A	1098	1057
10	A	976	940
11	A	910	877
12	A	718	691

Atom	x (Å)	y (Å)	z (Å)
C1	0.669	-0.364	0.017
N2	-0.755	-0.422	-0.160
O3	0.010	0.870	0.018
H4	1.097	-0.671	0.963
H5	1.251	-0.591	-0.865
H6	-1.153	-0.555	0.771

	C1	N2	O3	H4	H5	H6
C1		1.4354	1.3990	1.0829	1.0812	1.9808
N2	1.4354		1.5117	2.1798	2.1329	1.0214
O3	1.3990	1.5117		2.1093	2.1110	1.9873
H4	1.0829	2.1798	2.1093		1.8365	2.2610
H5	1.0812	2.1329	2.1110	1.8365		2.9084
H6	1.9808	1.0214	1.9873	2.2610	2.9084

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	O3	56.612	C1	N2	H6	106.238
C1	O3	N2	58.943	N2	C1	O3	64.445
N2	C1	H4	119.233	N2	C1	H5	115.171
O3	C1	H4	115.803	O3	C1	H5	116.081
O3	N2	H6	101.600	H4	C1	H5	116.125

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

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 CNOH3 (1,2-oxaziridine)

using model chemistry: MP4=FULL/cc-pVTZ

States and conformations

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