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	hartrees
Energy at 0K	-238.420137
Energy at 298.15K	-238.429628
Nuclear repulsion energy	197.734436

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	3844	3417	0.00
2	A₁'	3121	2774	0.00
3	A₁'	1049	933	0.00
4	A₁'	954	848	0.00
5	A₂'	1465	1302	0.00
6	A₂'	1254	1115	0.00
7	A₂'	1176	1045	0.00
8	A₂"	1052	935	325.80
9	A₂"	815	725	6.34
10	A₂"	488	434	20.24
11	E'	3847	3420	26.59
11	E'	3847	3420	26.59
12	E'	3119	2772	43.16
12	E'	3119	2772	43.16
13	E'	1667	1481	421.10
13	E'	1667	1481	421.10
14	E'	1582	1406	0.00
14	E'	1582	1406	0.00
15	E'	1206	1072	0.00
15	E'	1206	1072	0.00
16	E'	1061	943	4.07
16	E'	1061	943	4.07
17	E'	577	513	1.78
17	E'	577	513	1.78
18	E"	1038	923	0.00
18	E"	1038	923	0.00
19	E"	834	741	0.00
19	E"	834	741	0.00
20	E"	335	298	0.00
20	E"	335	298	0.00

Atom	x (Å)	y (Å)
N1	0.000	1.405
N2	1.217	-0.702
N3	-1.217	-0.702
B4	0.000	-1.452
B5	-1.258	0.726
B6	1.258	0.726
H7	0.000	2.446
H8	2.118	-1.223
H9	-2.118	-1.223
H10	0.000	-2.625
H11	-2.274	1.313
H12	2.274	1.313

	N1	N2	N3	B4	B5	B6	H7	H8	H9	H10	H11	H12
N1		2.4330	2.4330	2.8568	1.4290	1.4290	1.0408	3.3747	3.3747	4.0300	2.2754	2.2754
N2	2.4330		2.4330	1.4290	2.8568	1.4290	3.3747	1.0408	3.3747	2.2754	4.0300	2.2754
N3	2.4330	2.4330		1.4290	1.4290	2.8568	3.3747	3.3747	1.0408	2.2754	2.2754	4.0300
B4	2.8568	1.4290	1.4290		2.5150	2.5150	3.8975	2.1302	2.1302	1.1732	3.5795	3.5795
B5	1.4290	2.8568	1.4290	2.5150		2.5150	2.1302	3.8975	2.1302	3.5795	1.1732	3.5795
B6	1.4290	1.4290	2.8568	2.5150	2.5150		2.1302	2.1302	3.8975	3.5795	3.5795	1.1732
H7	1.0408	3.3747	3.3747	3.8975	2.1302	2.1302		4.2357	4.2357	5.0708	2.5402	2.5402
H8	3.3747	1.0408	3.3747	2.1302	3.8975	2.1302	4.2357		4.2357	2.5402	5.0708	2.5402
H9	3.3747	3.3747	1.0408	2.1302	2.1302	3.8975	4.2357	4.2357		2.5402	2.5402	5.0708
H10	4.0300	2.2754	2.2754	1.1732	3.5795	3.5795	5.0708	2.5402	2.5402		4.5471	4.5471
H11	2.2754	4.0300	2.2754	3.5795	1.1732	3.5795	2.5402	5.0708	2.5402	4.5471		4.5471
H12	2.2754	2.2754	4.0300	3.5795	3.5795	1.1732	2.5402	2.5402	5.0708	4.5471	4.5471

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	B5	N3	116.712	N1	B5	H11	121.644
N1	B6	N2	116.712	N1	B6	H12	121.644
N2	B4	N3	116.712	N2	B4	H10	121.644
N2	B6	H12	121.644	N3	B4	H10	121.644
N3	B5	H11	121.644	B4	N2	B6	123.288
B4	N2	H8	118.356	B4	N3	B5	123.288
B4	N3	H9	118.356	B5	N1	B6	123.288
B5	N1	H7	118.356	B5	N3	H9	118.356
B6	N1	H7	118.356	B6	N2	H8	118.356

All results from a given calculation for B₃N₃H₆ (borazine)

using model chemistry: MP2=FULL/STO-3G

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/STO-3G

States and conformations

All results from a given calculation for B₃N₃H₆ (borazine)