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	hartrees
Energy at 0K	-241.923546
Energy at 298.15K	-241.932944
Nuclear repulsion energy	197.024077

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	3674	3492	0.00
2	A₁'	2675	2543	0.00
3	A₁'	948	901	0.00
4	A₁'	859	816	0.00
5	A₂'	1316	1251	0.00
6	A₂'	1250	1188	0.00
7	A₂'	1047	995	0.00
8	A₂"	930	884	184.40
9	A₂"	741	705	57.85
10	A₂"	398	378	23.33
11	E'	3678	3495	63.62
11	E'	3678	3495	63.62
12	E'	2666	2534	302.45
12	E'	2666	2534	302.45
13	E'	1502	1428	500.55
13	E'	1502	1428	500.55
14	E'	1402	1332	5.65
14	E'	1402	1332	5.65
15	E'	1086	1032	0.00
15	E'	1086	1032	0.00
16	E'	947	900	0.12
16	E'	947	900	0.12
17	E'	522	496	0.57
17	E'	522	496	0.57
18	E"	934	888	0.00
18	E"	934	888	0.00
19	E"	712	677	0.00
19	E"	712	677	0.00
20	E"	287	272	0.00
20	E"	287	272	0.00

Atom	x (Å)	y (Å)
N1	0.000	1.413
N2	1.224	-0.707
N3	-1.224	-0.707
B4	0.000	-1.456
B5	-1.261	0.728
B6	1.261	0.728
H7	0.000	2.427
H8	2.102	-1.214
H9	-2.102	-1.214
H10	0.000	-2.662
H11	-2.305	1.331
H12	2.305	1.331

	N1	N2	N3	B4	B5	B6	H7	H8	H9	H10	H11	H12
N1		2.4482	2.4482	2.8696	1.4353	1.4353	1.0137	3.3645	3.3645	4.0755	2.3069	2.3069
N2	2.4482		2.4482	1.4353	2.8696	1.4353	3.3645	1.0137	3.3645	2.3069	4.0755	2.3069
N3	2.4482	2.4482		1.4353	1.4353	2.8696	3.3645	3.3645	1.0137	2.3069	2.3069	4.0755
B4	2.8696	1.4353	1.4353		2.5221	2.5221	3.8833	2.1159	2.1159	1.2059	3.6171	3.6171
B5	1.4353	2.8696	1.4353	2.5221		2.5221	2.1159	3.8833	2.1159	3.6171	1.2059	3.6171
B6	1.4353	1.4353	2.8696	2.5221	2.5221		2.1159	2.1159	3.8833	3.6171	3.6171	1.2059
H7	1.0137	3.3645	3.3645	3.8833	2.1159	2.1159		4.2040	4.2040	5.0892	2.5527	2.5527
H8	3.3645	1.0137	3.3645	2.1159	3.8833	2.1159	4.2040		4.2040	2.5527	5.0892	2.5527
H9	3.3645	3.3645	1.0137	2.1159	2.1159	3.8833	4.2040	4.2040		2.5527	2.5527	5.0892
H10	4.0755	2.3069	2.3069	1.2059	3.6171	3.6171	5.0892	2.5527	2.5527		4.6108	4.6108
H11	2.3069	4.0755	2.3069	3.6171	1.2059	3.6171	2.5527	5.0892	2.5527	4.6108		4.6108
H12	2.3069	2.3069	4.0755	3.6171	3.6171	1.2059	2.5527	2.5527	5.0892	4.6108	4.6108

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	B5	N3	117.051	N1	B5	H11	121.475
N1	B6	N2	117.051	N1	B6	H12	121.475
N2	B4	N3	117.051	N2	B4	H10	121.475
N2	B6	H12	121.475	N3	B4	H10	121.475
N3	B5	H11	121.475	B4	N2	B6	122.949
B4	N2	H8	118.525	B4	N3	B5	122.949
B4	N3	H9	118.525	B5	N1	B6	122.949
B5	N1	H7	118.525	B5	N3	H9	118.525
B6	N1	H7	118.525	B6	N2	H8	118.525

All results from a given calculation for B₃N₃H₆ (borazine)

using model chemistry: MP2=FULL/cc-pVDZ

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/cc-pVDZ

States and conformations

All results from a given calculation for B₃N₃H₆ (borazine)