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	hartrees
Energy at 0K	-279.561468
Energy at 298.15K	-279.567119
HF Energy	-278.697057
Nuclear repulsion energy	211.137542

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	3273	3065	0.00
2	A₁'	1149	1076	0.00
3	A₁'	1015	951	0.00
4	A₂'	1430	1339	0.00
5	A₂'	1256	1176	0.00
6	A₂"	921	862	0.44
7	A₂"	770	721	29.43
8	E'	3268	3061	22.92
8	E'	3268	3061	22.92
9	E'	1623	1520	77.67
9	E'	1623	1520	77.67
10	E'	1469	1375	52.72
10	E'	1469	1375	52.72
11	E'	1212	1135	0.00
11	E'	1212	1135	0.00
12	E'	687	644	18.64
12	E'	687	644	18.64
13	E"	1027	962	0.00
13	E"	1027	962	0.00
14	E"	358	335	0.00
14	E"	358	335	0.00

Atom	x (Å)	y (Å)
C1	0.000	1.298
C2	1.124	-0.649
C3	-1.124	-0.649
N4	0.000	-1.379
N5	1.195	0.690
N6	-1.195	0.690
H7	0.000	2.381
H8	2.062	-1.191
H9	-2.062	-1.191

	C1	C2	C3	N4	N5	N6	H7	H8	H9
C1		2.2478	2.2478	2.6771	1.3404	1.3404	1.0833	3.2317	3.2317
C2	2.2478		2.2478	1.3404	1.3404	2.6771	3.2317	1.0833	3.2317
C3	2.2478	2.2478		1.3404	2.6771	1.3404	3.2317	3.2317	1.0833
N4	2.6771	1.3404	1.3404		2.3891	2.3891	3.7604	2.0707	2.0707
N5	1.3404	1.3404	2.6771	2.3891		2.3891	2.0707	2.0707	3.7604
N6	1.3404	2.6771	1.3404	2.3891	2.3891		2.0707	3.7604	2.0707
H7	1.0833	3.2317	3.2317	3.7604	2.0707	2.0707		4.1242	4.1242
H8	3.2317	1.0833	3.2317	2.0707	2.0707	3.7604	4.1242		4.1242
H9	3.2317	3.2317	1.0833	2.0707	3.7604	2.0707	4.1242	4.1242

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N5	C2	113.959	C1	N6	C3	113.959
C2	N4	C3	113.959	N4	C2	N5	126.041
N4	C2	H8	116.980	N4	C3	N6	126.041
N4	C3	H9	116.980	N5	C1	N6	126.041
N5	C1	H7	116.980	N5	C2	H8	116.980
N6	C1	H7	116.980	N6	C3	H9	116.980

All results from a given calculation for C₃H₃N₃ (1,3,5-Triazine)

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 C3H3N3 (1,3,5-Triazine)

using model chemistry: MP2/6-31G**

States and conformations

All results from a given calculation for C₃H₃N₃ (1,3,5-Triazine)