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	hartrees
Energy at 0K	-263.121865
Energy at 298.15K	-263.127661
HF Energy	-262.547705
Nuclear repulsion energy	204.728914

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3240	3100	0.00
2	A_g	1567	1500	0.00
3	A_g	1268	1213	0.00
4	A_g	990	947	0.00
5	A_g	616	589	0.00
6	A_u	940	899	0.00
7	A_u	337	323	0.00
8	B_1g	928	888	0.00
9	B_1u	3217	3078	9.09
10	B_1u	1494	1430	13.26
11	B_1u	1147	1097	0.00
12	B_1u	1003	960	26.26
13	B_2g	931	891	0.00
14	B_2g	735	703	0.00
15	B_2u	3232	3092	47.78
16	B_2u	1437	1375	29.60
17	B_2u	1217	1164	7.32
18	B_2u	1082	1035	9.70
19	B_3g	3213	3075	0.00
20	B_3g	1496	1432	0.00
21	B_3g	1383	1323	0.00
22	B_3g	712	681	0.00
23	B_3u	787	753	33.63
24	B_3u	425	406	29.42

Atom	y (Å)	z (Å)
N1	0.000	1.431
N2	0.000	-1.431
C3	1.165	0.704
C4	-1.165	0.704
C5	-1.165	-0.704
C6	1.165	-0.704
H7	2.091	1.275
H8	-2.091	1.275
H9	-2.091	-1.275
H10	2.091	-1.275

	N1	N2	C3	C4	C5	C6	H7	H8	H9	H10
N1		2.8624	1.3730	1.3730	2.4321	2.4321	2.0963	2.0963	3.4197	3.4197
N2	2.8624		2.4321	2.4321	1.3730	1.3730	3.4197	3.4197	2.0963	2.0963
C3	1.3730	2.4321		2.3292	2.7217	1.4080	1.0879	3.3048	3.8096	2.1850
C4	1.3730	2.4321	2.3292		1.4080	2.7217	3.3048	1.0879	2.1850	3.8096
C5	2.4321	1.3730	2.7217	1.4080		2.3292	3.8096	2.1850	1.0879	3.3048
C6	2.4321	1.3730	1.4080	2.7217	2.3292		2.1850	3.8096	3.3048	1.0879
H7	2.0963	3.4197	1.0879	3.3048	3.8096	2.1850		4.1810	4.8974	2.5502
H8	2.0963	3.4197	3.3048	1.0879	2.1850	3.8096	4.1810		2.5502	4.8974
H9	3.4197	2.0963	3.8096	2.1850	1.0879	3.3048	4.8974	2.5502		4.1810
H10	3.4197	2.0963	2.1850	3.8096	3.3048	1.0879	2.5502	4.8974	4.1810

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C3	C6	121.981	N1	C3	H7	116.354
N1	C4	C5	121.981	N1	C4	H8	116.354
N2	C5	C4	121.981	N2	C5	H9	116.354
N2	C6	C3	121.981	N2	C6	H10	116.354
C3	N1	C4	116.039	C3	C6	H10	121.665
C4	C5	H9	121.665	C5	N2	C6	116.039
C5	C4	H8	121.665	C6	C3	H7	121.665

All results from a given calculation for C₄H₄N₂ (Pyrazine)

using model chemistry: MP2/6-31G

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 C4H4N2 (Pyrazine)

using model chemistry: MP2/6-31G

States and conformations

All results from a given calculation for C₄H₄N₂ (Pyrazine)