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	hartrees
Energy at 0K	-928.247942
Energy at 298.15K
HF Energy	-928.247942
Nuclear repulsion energy	290.453036

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	2249	2147	0.00	754.83	0.00	0.00
2	A'	2237	2136	0.00	96.21	0.70	0.82
3	A'	1016	970	0.00	7.58	0.73	0.84
4	A'	960	916	0.00	7.84	0.74	0.85
5	A'	653	623	0.00	0.50	0.28	0.44
6	A'	485	463	0.00	16.33	0.06	0.12
7	A"	2239	2138	446.85	0.00	0.75	0.86
8	A"	943	901	171.23	0.00	0.75	0.86
9	A"	739	706	111.30	0.00	0.75	0.86
10	A"	169	162	1.28	0.00	0.75	0.86
11	A"	86	82	0.09	0.00	0.75	0.86
12	E'	2248	2146	265.79	72.61	0.75	0.86
12	E'	2248	2146	265.84	72.60	0.75	0.86
13	E'	2233	2132	80.84	2.63	0.75	0.86
13	E'	2233	2132	80.84	2.63	0.75	0.86
14	E'	1010	964	124.06	2.36	0.75	0.86
14	E'	1010	964	124.06	2.36	0.75	0.86
15	E'	970	926	206.43	7.85	0.75	0.86
15	E'	970	926	206.44	7.85	0.75	0.86
16	E'	941	899	553.13	18.94	0.75	0.86
16	E'	941	899	553.14	18.94	0.75	0.86
17	E'	690	659	1.79	12.21	0.75	0.86
17	E'	690	659	1.79	12.21	0.75	0.86
18	E'	169	161	0.43	0.22	0.75	0.86
18	E'	169	161	0.43	0.22	0.75	0.86
19	E"	2236	2135	0.00	131.44	0.75	0.86
19	E"	2236	2135	0.00	131.42	0.75	0.86
20	E"	941	899	0.00	20.07	0.75	0.86
20	E"	941	899	0.00	20.08	0.75	0.86
21	E"	686	655	0.00	11.21	0.75	0.86
21	E"	686	655	0.00	11.21	0.75	0.86
22	E"	77	74	0.00	0.91	0.75	0.86
22	E"	77	74	0.00	0.91	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	0.000
Si2	0.000	1.750	0.000
Si3	-1.516	-0.875	0.000
Si4	1.516	-0.875	0.000
H5	-1.422	2.193	0.000
H6	-1.188	-2.328	0.000
H7	2.610	0.135	0.000
H8	0.683	2.295	1.206
H9	0.683	2.295	-1.206
H10	-2.329	-0.556	1.206
H11	-2.329	-0.556	-1.206
H12	1.646	-1.739	1.206
H13	1.646	-1.739	-1.206

	N1	Si2	Si3	Si4	H5	H6	H7	H8	H9	H10	H11	H12	H13
N1		1.7500	1.7500	1.7500	2.6136	2.6136	2.6136	2.6806	2.6806	2.6806	2.6806	2.6806	2.6806
Si2	1.7500		3.0311	3.0311	1.4892	4.2475	3.0694	1.4890	1.4890	3.4919	3.4919	4.0416	4.0416
Si3	1.7500	3.0311		3.0311	3.0694	1.4892	4.2475	4.0416	4.0416	1.4890	1.4890	3.4919	3.4919
Si4	1.7500	3.0311	3.0311		4.2475	3.0694	1.4892	3.4919	3.4919	4.0416	4.0416	1.4890	1.4890
H5	2.6136	1.4892	3.0694	4.2475		4.5269	4.5269	2.4280	2.4280	3.1356	3.1356	5.1306	5.1306
H6	2.6136	4.2475	1.4892	3.0694	4.5269		4.5269	5.1306	5.1306	2.4280	2.4280	3.1356	3.1356
H7	2.6136	3.0694	4.2475	1.4892	4.5269	4.5269		3.1356	3.1356	5.1306	5.1306	2.4280	2.4280
H8	2.6806	1.4890	4.0416	3.4919	2.4280	5.1306	3.1356		2.4114	4.1468	4.7970	4.1468	4.7970
H9	2.6806	1.4890	4.0416	3.4919	2.4280	5.1306	3.1356	2.4114		4.7970	4.1468	4.7970	4.1468
H10	2.6806	3.4919	1.4890	4.0416	3.1356	2.4280	5.1306	4.1468	4.7970		2.4114	4.1468	4.7970
H11	2.6806	3.4919	1.4890	4.0416	3.1356	2.4280	5.1306	4.7970	4.1468	2.4114		4.7970	4.1468
H12	2.6806	4.0416	3.4919	1.4890	5.1306	3.1356	2.4280	4.1468	4.7970	4.1468	4.7970		2.4114
H13	2.6806	4.0416	3.4919	1.4890	5.1306	3.1356	2.4280	4.7970	4.1468	4.7970	4.1468	2.4114

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	Si2	H5	107.305	N1	Si2	H8	111.456
N1	Si2	H9	111.456	N1	Si3	H6	107.305
N1	Si3	H10	111.456	N1	Si3	H11	111.456
N1	Si4	H7	107.305	N1	Si4	H12	111.456
N1	Si4	H13	111.456	Si2	N1	Si3	120.000
Si2	N1	Si4	120.000	Si3	N1	Si4	120.000
H5	Si2	H8	109.222	H5	Si2	H9	109.222
H6	Si3	H10	109.222	H6	Si3	H11	109.222
H7	Si4	H12	109.222	H7	Si4	H13	109.222
H8	Si2	H9	108.145	H10	Si3	H11	108.145
H12	Si4	H13	108.145

All results from a given calculation for N(SiH₃)₃ (trisilylamine)

using model chemistry: HSEh1PBE/6-31+G**

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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Number	Element	Mulliken
1	N	-1.059
2	Si	0.631
3	Si	0.631
4	Si	0.631
5	H	-0.095
6	H	-0.095
7	H	-0.095
8	H	-0.091
9	H	-0.091
10	H	-0.091
11	H	-0.091
12	H	-0.091
13	H	-0.091

	x	y	z
x	12.474	-0.000	0.000
y	-0.000	12.474	0.000
z	0.000	0.000	10.744

<r²>	224.546
(<r²>)^1/2	14.985

All results from a given calculation for N(SiH3)3 (trisilylamine)

using model chemistry: HSEh1PBE/6-31+G**

States and conformations

All results from a given calculation for N(SiH₃)₃ (trisilylamine)