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	hartrees
Energy at 0K	-263.579600
Energy at 298.15K	-263.585404
HF Energy	-262.694261
Nuclear repulsion energy	208.017792

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3274	3075	0.00
2	A_g	1634	1535	0.00
3	A_g	1273	1196	0.00
4	A_g	1036	973	0.00
5	A_g	605	568	0.00
6	A_u	946	889	0.00
7	A_u	330	310	0.00
8	B_1g	939	882	0.00
9	B_1u	3256	3058	1.61
10	B_1u	1525	1433	0.66
11	B_1u	1171	1100	6.52
12	B_1u	1037	974	28.19
13	B_2g	926	870	0.00
14	B_2g	691	649	0.00
15	B_2u	3270	3071	46.62
16	B_2u	1465	1376	33.69
17	B_2u	1369	1286	0.26
18	B_2u	1105	1038	11.28
19	B_3g	3255	3057	0.00
20	B_3g	1587	1490	0.00
21	B_3g	1391	1307	0.00
22	B_3g	715	672	0.00
23	B_3u	797	748	36.04
24	B_3u	415	390	26.26

Atom	y (Å)	z (Å)
N1	0.000	1.417
N2	0.000	-1.417
C3	1.136	0.698
C4	-1.136	0.698
C5	-1.136	-0.698
C6	1.136	-0.698
H7	2.065	1.254
H8	-2.065	1.254
H9	-2.065	-1.254
H10	2.065	-1.254

	N1	N2	C3	C4	C5	C6	H7	H8	H9	H10
N1		2.8332	1.3443	1.3443	2.4005	2.4005	2.0712	2.0712	3.3757	3.3757
N2	2.8332		2.4005	2.4005	1.3443	1.3443	3.3757	3.3757	2.0712	2.0712
C3	1.3443	2.4005		2.2721	2.6667	1.3960	1.0824	3.2488	3.7490	2.1616
C4	1.3443	2.4005	2.2721		1.3960	2.6667	3.2488	1.0824	2.1616	3.7490
C5	2.4005	1.3443	2.6667	1.3960		2.2721	3.7490	2.1616	1.0824	3.2488
C6	2.4005	1.3443	1.3960	2.6667	2.2721		2.1616	3.7490	3.2488	1.0824
H7	2.0712	3.3757	1.0824	3.2488	3.7490	2.1616		4.1296	4.8314	2.5078
H8	2.0712	3.3757	3.2488	1.0824	2.1616	3.7490	4.1296		2.5078	4.8314
H9	3.3757	2.0712	3.7490	2.1616	1.0824	3.2488	4.8314	2.5078		4.1296
H10	3.3757	2.0712	2.1616	3.7490	3.2488	1.0824	2.5078	4.8314	4.1296

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C3	C6	122.316	N1	C3	H7	116.780
N1	C4	C5	122.316	N1	C4	H8	116.780
N2	C5	C4	122.316	N2	C5	H9	116.780
N2	C6	C3	122.316	N2	C6	H10	116.780
C3	N1	C4	115.368	C3	C6	H10	120.904
C4	C5	H9	120.904	C5	N2	C6	115.368
C5	C4	H8	120.904	C6	C3	H7	120.904

All results from a given calculation for C₄H₄N₂ (Pyrazine)

using model chemistry: MP2=FULL/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 C4H4N2 (Pyrazine)

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

States and conformations

All results from a given calculation for C₄H₄N₂ (Pyrazine)