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	hartrees
Energy at 0K	-168.241459
Energy at 298.15K
HF Energy	-167.766414
Nuclear repulsion energy	58.471725

Atom	x (Å)	y (Å)
H1	1.587	-1.139
N2	0.587	-1.025
C3	0.000	0.053
O4	-0.712	0.999

	H1	N2	C3	O4
H1		1.0057	1.9848	3.1397
N2	1.0057		1.2280	2.4057
C3	1.9848	1.2280		1.1842
O4	3.1397	2.4057	1.1842

All results from a given calculation for HNCO (Isocyanic acid)

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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