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	hartrees
Energy at 0K	-240.273958
Energy at 298.15K	-240.283623
Nuclear repulsion energy	195.593494

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	3624	3411	0.00
2	A₁'	2701	2542	0.00
3	A₁'	981	924	0.00
4	A₁'	876	825	0.00
5	A₂'	1407	1324	0.00
6	A₂'	1236	1164	0.00
7	A₂'	1078	1015	0.00
8	A₂"	1016	956	439.19
9	A₂"	761	716	55.79
10	A₂"	468	441	23.76
11	E'	3623	3411	41.47
11	E'	3623	3411	41.47
12	E'	2688	2531	299.08
12	E'	2688	2531	299.08
13	E'	1538	1448	482.32
13	E'	1538	1448	482.32
14	E'	1456	1371	116.89
14	E'	1456	1371	116.89
15	E'	1119	1053	0.26
15	E'	1119	1053	0.26
16	E'	963	906	1.67
16	E'	963	906	1.67
17	E'	540	508	0.30
17	E'	540	508	0.30
18	E"	965	908	0.00
18	E"	965	908	0.00
19	E"	799	752	0.00
19	E"	799	752	0.00
20	E"	306	288	0.00
20	E"	306	288	0.00

Atom	x (Å)	y (Å)
N1	0.000	1.428
N2	1.237	-0.714
N3	-1.237	-0.714
B4	0.000	-1.468
B5	-1.272	0.734
B6	1.272	0.734
H7	0.000	2.440
H8	2.113	-1.220
H9	-2.113	-1.220
H10	0.000	-2.666
H11	-2.309	1.333
H12	2.309	1.333

	N1	N2	N3	B4	B5	B6	H7	H8	H9	H10	H11	H12
N1		2.4733	2.4733	2.8962	1.4485	1.4485	1.0124	3.3881	3.3881	4.0937	2.3106	2.3106
N2	2.4733		2.4733	1.4485	2.8962	1.4485	3.3881	1.0124	3.3881	2.3106	4.0937	2.3106
N3	2.4733	2.4733		1.4485	1.4485	2.8962	3.3881	3.3881	1.0124	2.3106	2.3106	4.0937
B4	2.8962	1.4485	1.4485		2.5432	2.5432	3.9087	2.1279	2.1279	1.1974	3.6299	3.6299
B5	1.4485	2.8962	1.4485	2.5432		2.5432	2.1279	3.9087	2.1279	3.6299	1.1974	3.6299
B6	1.4485	1.4485	2.8962	2.5432	2.5432		2.1279	2.1279	3.9087	3.6299	3.6299	1.1974
H7	1.0124	3.3881	3.3881	3.9087	2.1279	2.1279		4.2268	4.2268	5.1061	2.5605	2.5605
H8	3.3881	1.0124	3.3881	2.1279	3.9087	2.1279	4.2268		4.2268	2.5605	5.1061	2.5605
H9	3.3881	3.3881	1.0124	2.1279	2.1279	3.9087	4.2268	4.2268		2.5605	2.5605	5.1061
H10	4.0937	2.3106	2.3106	1.1974	3.6299	3.6299	5.1061	2.5605	2.5605		4.6172	4.6172
H11	2.3106	4.0937	2.3106	3.6299	1.1974	3.6299	2.5605	5.1061	2.5605	4.6172		4.6172
H12	2.3106	2.3106	4.0937	3.6299	3.6299	1.1974	2.5605	2.5605	5.1061	4.6172	4.6172

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	B5	N3	117.235	N1	B5	H11	121.382
N1	B6	N2	117.235	N1	B6	H12	121.382
N2	B4	N3	117.235	N2	B4	H10	121.382
N2	B6	H12	121.382	N3	B4	H10	121.382
N3	B5	H11	121.382	B4	N2	B6	122.765
B4	N2	H8	118.618	B4	N3	B5	122.765
B4	N3	H9	118.618	B5	N1	B6	122.765
B5	N1	H7	118.618	B5	N3	H9	118.618
B6	N1	H7	118.618	B6	N2	H8	118.618

All results from a given calculation for B₃N₃H₆ (borazine)

using model chemistry: CISD/3-21G

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 B3N3H6 (borazine)

using model chemistry: CISD/3-21G

States and conformations

All results from a given calculation for B₃N₃H₆ (borazine)