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	hartrees
Energy at 0K	-319.336154
Energy at 298.15K
HF Energy	-318.473153
Nuclear repulsion energy	189.107678

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.612	0.000
O2	-1.211	0.579	0.000
O3	0.754	1.553	0.000
O4	0.672	-0.569	0.000
C5	-0.134	-1.766	0.000
H6	0.589	-2.571	0.000
H7	-0.753	-1.813	0.887
H8	-0.753	-1.813	-0.887

	N1	O2	O3	O4	C5	H6	H7	H8
N1		1.2117	1.2058	1.3595	2.3817	3.2371	2.6898	2.6898
O2	1.2117		2.1936	2.2061	2.5802	3.6281	2.5918	2.5918
O3	1.2058	2.1936		2.1239	3.4356	4.1271	3.7931	3.7931
O4	1.3595	2.2061	2.1239		1.4429	2.0033	2.0895	2.0895
C5	2.3817	2.5802	3.4356	1.4429		1.0823	1.0830	1.0830
H6	3.2371	3.6281	4.1271	2.0033	1.0823		1.7788	1.7788
H7	2.6898	2.5918	3.7931	2.0895	1.0830	1.7788		1.7750
H8	2.6898	2.5918	3.7931	2.0895	1.0830	1.7788	1.7750

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	O4	C5	116.364	O2	N1	O3	130.292
O2	N1	O4	118.076	O3	N1	O4	111.633
O4	C5	H6	104.076	O4	C5	H7	110.820
O4	C5	H8	110.820	H6	C5	H7	110.467
H6	C5	H8	110.467	H7	C5	H8	110.060

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

using model chemistry: MP3/6-31+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: MP3/6-31+G**

States and conformations

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