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	hartrees
Energy at 0K	-32.744347
Energy at 298.15K	-32.748622
HF Energy	-32.399635
Nuclear repulsion energy	40.125467

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3284	3205	17.19
2	A	3222	3145	17.98
3	A	3084	3010	21.49
4	A	1536	1499	0.36
5	A	1323	1291	14.69
6	A	1235	1206	5.27
7	A	1163	1135	18.31
8	A	1103	1076	12.15
9	A	1033	1009	16.82
10	A	952	929	24.95
11	A	807	787	29.36
12	A	632	617	0.27

Atom	x (Å)	y (Å)	z (Å)
C1	0.590	-0.544	0.020
N2	-0.876	-0.279	-0.157
O3	0.233	0.913	0.011
H4	0.957	-0.909	0.984
H5	1.096	-0.899	-0.877
H6	-1.331	-0.277	0.781

	C1	N2	O3	H4	H5	H6
C1		1.5001	1.4998	1.0940	1.0893	2.0831
N2	1.5001		1.6364	2.2491	2.1882	1.0431
O3	1.4998	1.6364		2.1882	2.1941	2.1103
H4	1.0940	2.2491	2.1882		1.8665	2.3818
H5	1.0893	2.1882	2.1941	1.8665		3.0038
H6	2.0831	1.0431	2.1103	2.3818	3.0038

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	O3	56.933	C1	N2	H6	108.654
C1	O3	N2	56.954	N2	C1	O3	66.113
N2	C1	H4	119.401	N2	C1	H5	114.415
O3	C1	H4	114.145	O3	C1	H5	114.941
O3	N2	H6	101.624	H4	C1	H5	117.498

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)