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	hartrees
Energy at 0K	-295.485559
Energy at 298.15K	-295.490734
HF Energy	-294.583365
Nuclear repulsion energy	211.001378

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3276	3089	0.00
2	A_g	1442	1360	0.00
3	A_g	1015	957	0.00
4	A_g	749	706	0.00
5	A_u	338	319	0.00
6	B_1u	3275	3089	4.52
7	B_1u	1231	1161	64.42
8	B_1u	1107	1043	0.06
9	B_2g	980	924	0.00
10	B_2g	799	753	0.00
11	B_2u	1483	1399	6.91
12	B_2u	1226	1156	0.39
13	B_2u	1079	1018	29.56
14	B_3g	1560	1471	0.00
15	B_3g	1342	1265	0.00
16	B_3g	639	602	0.00
17	B_3u	921	868	1.47
18	B_3u	265	250	57.51

Atom	y (Å)	z (Å)
C1	0.000	1.273
C2	0.000	-1.273
N3	1.204	0.659
N4	-1.204	0.659
N5	-1.204	-0.659
N6	1.204	-0.659
H7	0.000	2.355
H8	0.000	-2.355

	C1	C2	N3	N4	N5	N6	H7	H8
C1		2.5468	1.3516	1.3516	2.2764	2.2764	1.0820	3.6288
C2	2.5468		2.2764	2.2764	1.3516	1.3516	3.6288	1.0820
N3	1.3516	2.2764		2.4074	2.7443	1.3174	2.0803	3.2455
N4	1.3516	2.2764	2.4074		1.3174	2.7443	2.0803	3.2455
N5	2.2764	1.3516	2.7443	1.3174		2.4074	3.2455	2.0803
N6	2.2764	1.3516	1.3174	2.7443	2.4074		3.2455	2.0803
H7	1.0820	3.6288	2.0803	2.0803	3.2455	3.2455		4.7108
H8	3.6288	1.0820	3.2455	3.2455	2.0803	2.0803	4.7108

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	N6	117.052	C1	N4	N5	117.052
C2	N5	N4	117.052	C2	N6	N3	117.052
N3	C1	N4	125.896	N3	C1	H7	117.052
N4	C1	H7	117.052	N5	C2	N6	125.896
N5	C2	H8	117.052	N6	C2	H8	117.052

All results from a given calculation for C₂H₂N₄ (sym-tetrazine)

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 C2H2N4 (sym-tetrazine)

using model chemistry: MP2/6-31G*

States and conformations

All results from a given calculation for C₂H₂N₄ (sym-tetrazine)