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	hartrees
Energy at 0K	-242.053946
Energy at 298.15K	-242.063319
Nuclear repulsion energy	197.818330

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	3679	3484	0.00
2	A₁'	2653	2512	0.00
3	A₁'	955	904	0.00
4	A₁'	867	822	0.00
5	A₂'	1343	1272	0.00
6	A₂'	1247	1181	0.00
7	A₂'	1057	1001	0.00
8	A₂"	940	891	223.83
9	A₂"	747	707	69.67
10	A₂"	387	367	39.34
11	E'	3682	3487	52.90
11	E'	3682	3487	52.90
12	E'	2643	2503	295.57
12	E'	2643	2503	295.57
13	E'	1515	1435	520.19
13	E'	1515	1435	520.19
14	E'	1419	1344	23.01
14	E'	1419	1344	23.01
15	E'	1092	1034	0.02
15	E'	1092	1034	0.02
16	E'	952	902	0.08
16	E'	952	902	0.08
17	E'	525	498	0.44
17	E'	525	498	0.44
18	E"	931	882	0.00
18	E"	931	882	0.00
19	E"	722	684	0.00
19	E"	722	684	0.00
20	E"	278	263	0.00
20	E"	278	263	0.00

Atom	x (Å)	y (Å)
N1	0.000	1.409
N2	1.221	-0.705
N3	-1.221	-0.705
B4	0.000	-1.450
B5	-1.255	0.725
B6	1.255	0.725
H7	0.000	2.417
H8	2.093	-1.209
H9	-2.093	-1.209
H10	0.000	-2.647
H11	-2.293	1.324
H12	2.293	1.324

	N1	N2	N3	B4	B5	B6	H7	H8	H9	H10	H11	H12
N1		2.4412	2.4412	2.8591	1.4300	1.4300	1.0078	3.3520	3.3520	4.0568	2.2943	2.2943
N2	2.4412		2.4412	1.4300	2.8591	1.4300	3.3520	1.0078	3.3520	2.2943	4.0568	2.2943
N3	2.4412	2.4412		1.4300	1.4300	2.8591	3.3520	3.3520	1.0078	2.2943	2.2943	4.0568
B4	2.8591	1.4300	1.4300		2.5108	2.5108	3.8668	2.1072	2.1072	1.1978	3.5983	3.5983
B5	1.4300	2.8591	1.4300	2.5108		2.5108	2.1072	3.8668	2.1072	3.5983	1.1978	3.5983
B6	1.4300	1.4300	2.8591	2.5108	2.5108		2.1072	2.1072	3.8668	3.5983	3.5983	1.1978
H7	1.0078	3.3520	3.3520	3.8668	2.1072	2.1072		4.1867	4.1867	5.0646	2.5401	2.5401
H8	3.3520	1.0078	3.3520	2.1072	3.8668	2.1072	4.1867		4.1867	2.5401	5.0646	2.5401
H9	3.3520	3.3520	1.0078	2.1072	2.1072	3.8668	4.1867	4.1867		2.5401	2.5401	5.0646
H10	4.0568	2.2943	2.2943	1.1978	3.5983	3.5983	5.0646	2.5401	2.5401		4.5854	4.5854
H11	2.2943	4.0568	2.2943	3.5983	1.1978	3.5983	2.5401	5.0646	2.5401	4.5854		4.5854
H12	2.2943	2.2943	4.0568	3.5983	3.5983	1.1978	2.5401	2.5401	5.0646	4.5854	4.5854

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	B5	N3	117.209	N1	B5	H11	121.395
N1	B6	N2	117.209	N1	B6	H12	121.395
N2	B4	N3	117.209	N2	B4	H10	121.395
N2	B6	H12	121.395	N3	B4	H10	121.395
N3	B5	H11	121.395	B4	N2	B6	122.791
B4	N2	H8	118.605	B4	N3	B5	122.791
B4	N3	H9	118.605	B5	N1	B6	122.791
B5	N1	H7	118.605	B5	N3	H9	118.605
B6	N1	H7	118.605	B6	N2	H8	118.605

All results from a given calculation for B₃N₃H₆ (borazine)

using model chemistry: MP2=FULL/6-311G*

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: MP2=FULL/6-311G*

States and conformations

All results from a given calculation for B₃N₃H₆ (borazine)