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	hartrees
Energy at 0K	-319.368846
Energy at 298.15K
HF Energy	-318.475074
Nuclear repulsion energy	186.733652

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.620	0.000
O2	-1.224	0.554	0.000
O3	0.734	1.595	0.000
O4	0.718	-0.603	0.000
C5	-0.143	-1.760	0.000
H6	0.564	-2.584	0.000
H7	-0.763	-1.781	0.892
H8	-0.763	-1.781	-0.892

	N1	O2	O3	O4	C5	H6	H7	H8
N1		1.2262	1.2207	1.4182	2.3841	3.2529	2.6723	2.6723
O2	1.2262		2.2178	2.2611	2.5545	3.6118	2.5420	2.5420
O3	1.2207	2.2178		2.1988	3.4681	4.1828	3.7993	3.7993
O4	1.4182	2.2611	2.1988		1.4418	1.9866	2.0917	2.0917
C5	2.3841	2.5545	3.4681	1.4418		1.0853	1.0869	1.0869
H6	3.2529	3.6118	4.1828	1.9866	1.0853		1.7891	1.7891
H7	2.6723	2.5420	3.7993	2.0917	1.0869	1.7891		1.7850
H8	2.6723	2.5420	3.7993	2.0917	1.0869	1.7891	1.7850

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	O4	C5	112.940	O2	N1	O3	130.012
O2	N1	O4	117.341	O3	N1	O4	112.647
O4	C5	H6	102.736	O4	C5	H7	110.841
O4	C5	H8	110.841	H6	C5	H7	110.906
H6	C5	H8	110.906	H7	C5	H8	110.402

All results from a given calculation for CH₃NO₃ (Methyl nitrate)

using model chemistry: MP2/6-31+G**

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 CH3NO3 (Methyl nitrate)

using model chemistry: MP2/6-31+G**

States and conformations

All results from a given calculation for CH₃NO₃ (Methyl nitrate)