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	hartrees
Energy at 0K	-261.343403
Energy at 298.15K
HF Energy	-260.553424
Nuclear repulsion energy	163.471707

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3387	3152	0.90
2	A₁	1527	1421	16.85
3	A₁	1388	1292	2.55
4	A₁	1091	1015	0.88
5	A₁	1058	985	25.96
6	A₁	930	865	25.25
7	A₂	862	802	0.00
8	A₂	638	594	0.00
9	B₁	868	808	44.42
10	B₁	635	591	0.72
11	B₂	3373	3139	0.15
12	B₂	1649	1534	0.08
13	B₂	1252	1165	4.15
14	B₂	1013	942	3.85
15	B₂	981	912	13.34

Atom	y (Å)	z (Å)
O1	0.000	1.126
N2	1.131	0.356
N3	-1.131	0.356
C4	0.713	-0.882
C5	-0.713	-0.882
H6	1.407	-1.702
H7	-1.407	-1.702

	O1	N2	N3	C4	C5	H6	H7
O1		1.3679	1.3679	2.1301	2.1301	3.1578	3.1578
N2	1.3679		2.2614	1.3063	2.2203	2.0759	3.2667
N3	1.3679	2.2614		2.2203	1.3063	3.2667	2.0759
C4	2.1301	1.3063	2.2203		1.4253	1.0742	2.2723
C5	2.1301	2.2203	1.3063	1.4253		2.2723	1.0742
H6	3.1578	2.0759	3.2667	1.0742	2.2723		2.8132
H7	3.1578	3.2667	2.0759	2.2723	1.0742	2.8132

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	N2	C4	105.580	O1	N3	C5	105.580
N2	O1	N3	111.507	N2	C4	C5	108.666
N2	C4	H6	121.091	N3	C5	C4	108.666
N3	C5	H7	121.091	C4	C5	H7	130.243
C5	C4	H6	130.243

All results from a given calculation for C₂H₂N₂O (Furazan)

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 C2H2N2O (Furazan)

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

States and conformations

All results from a given calculation for C₂H₂N₂O (Furazan)