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	hartrees
Energy at 0K	-923.538719
Energy at 298.15K
HF Energy	-923.409593
Nuclear repulsion energy	290.202380

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'	2315	2315	0.00	481.39	0.00	0.01
2	A'	2300	2300	0.00	68.07	0.69	0.81
3	A'	1078	1078	0.00	19.34	0.75	0.86
4	A'	996	996	0.00	15.84	0.75	0.86
5	A'	676	676	0.00	1.03	0.06	0.11
6	A'	495	495	0.00	14.80	0.09	0.17
7	A"	2303	2303	422.30	0.00	0.75	0.86
8	A"	972	972	239.02	0.00	0.75	0.86
9	A"	783	783	131.06	0.00	0.75	0.86
10	A"	220	220	0.40	0.00	0.75	0.86
11	A"	58	58	0.05	0.00	0.75	0.86
12	E'	2310	2310	269.72	55.13	0.75	0.86
12	E'	2310	2310	269.74	55.13	0.75	0.86
13	E'	2298	2298	63.04	0.82	0.75	0.86
13	E'	2298	2298	63.01	0.82	0.75	0.86
14	E'	1038	1038	28.53	4.97	0.75	0.86
14	E'	1038	1038	28.51	4.98	0.75	0.86
15	E'	1009	1009	502.11	2.94	0.75	0.86
15	E'	1009	1009	502.14	2.94	0.75	0.86
16	E'	984	984	443.47	32.27	0.75	0.86
16	E'	984	984	443.49	32.27	0.75	0.86
17	E'	711	711	0.91	12.88	0.75	0.86
17	E'	711	711	0.91	12.88	0.75	0.86
18	E'	190	190	0.47	0.10	0.75	0.86
18	E'	190	190	0.47	0.10	0.75	0.86
19	E"	2300	2300	0.00	87.04	0.75	0.86
19	E"	2300	2300	0.00	87.04	0.75	0.86
20	E"	965	965	0.00	26.98	0.75	0.86
20	E"	965	965	0.00	26.98	0.75	0.86
21	E"	713	713	0.00	14.03	0.75	0.86
21	E"	713	713	0.00	14.03	0.75	0.86
22	E"	73	73	0.00	0.48	0.75	0.86
22	E"	73	73	0.00	0.48	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	0.000
Si2	0.000	1.753	0.000
Si3	-1.518	-0.876	0.000
Si4	1.518	-0.876	0.000
H5	-1.416	2.194	0.000
H6	-1.192	-2.324	0.000
H7	2.609	0.129	0.000
H8	0.671	2.313	1.198
H9	0.671	2.313	-1.198
H10	-2.339	-0.575	1.198
H11	-2.339	-0.575	-1.198
H12	1.668	-1.738	1.198
H13	1.668	-1.738	-1.198

	N1	Si2	Si3	Si4	H5	H6	H7	H8	H9	H10	H11	H12	H13
N1		1.7528	1.7528	1.7528	2.6117	2.6117	2.6117	2.6900	2.6900	2.6900	2.6900	2.6900	2.6900
Si2	1.7528		3.0359	3.0359	1.4835	4.2472	3.0725	1.4832	1.4832	3.5108	3.5108	4.0497	4.0497
Si3	1.7528	3.0359		3.0359	3.0725	1.4835	4.2472	4.0497	4.0497	1.4832	1.4832	3.5108	3.5108
Si4	1.7528	3.0359	3.0359		4.2472	3.0725	1.4835	3.5108	3.5108	4.0497	4.0497	1.4832	1.4832
H5	2.6117	1.4835	3.0725	4.2472		4.5237	4.5237	2.4096	2.4096	3.1558	3.1558	5.1388	5.1388
H6	2.6117	4.2472	1.4835	3.0725	4.5237		4.5237	5.1388	5.1388	2.4096	2.4096	3.1558	3.1558
H7	2.6117	3.0725	4.2472	1.4835	4.5237	4.5237		3.1558	3.1558	5.1388	5.1388	2.4096	2.4096
H8	2.6900	1.4832	4.0497	3.5108	2.4096	5.1388	3.1558		2.3965	4.1715	4.8109	4.1715	4.8109
H9	2.6900	1.4832	4.0497	3.5108	2.4096	5.1388	3.1558	2.3965		4.8109	4.1715	4.8109	4.1715
H10	2.6900	3.5108	1.4832	4.0497	3.1558	2.4096	5.1388	4.1715	4.8109		2.3965	4.1715	4.8109
H11	2.6900	3.5108	1.4832	4.0497	3.1558	2.4096	5.1388	4.8109	4.1715	2.3965		4.8109	4.1715
H12	2.6900	4.0497	3.5108	1.4832	5.1388	3.1558	2.4096	4.1715	4.8109	4.1715	4.8109		2.3965
H13	2.6900	4.0497	3.5108	1.4832	5.1388	3.1558	2.4096	4.8109	4.1715	4.8109	4.1715	2.3965

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	Si2	H5	107.321	N1	Si2	H8	112.195
N1	Si2	H9	112.195	N1	Si3	H6	107.321
N1	Si3	H10	112.195	N1	Si3	H11	112.195
N1	Si4	H7	107.321	N1	Si4	H12	112.195
N1	Si4	H13	112.195	Si2	N1	Si3	120.000
Si2	N1	Si4	120.000	Si3	N1	Si4	120.000
H5	Si2	H8	108.626	H5	Si2	H9	108.626
H6	Si3	H10	108.626	H6	Si3	H11	108.626
H7	Si4	H12	108.626	H7	Si4	H13	108.626
H8	Si2	H9	107.778	H10	Si3	H11	107.778
H12	Si4	H13	107.778

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

using model chemistry: B2PLYP=FULL/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 N(SiH3)3 (trisilylamine)

using model chemistry: B2PLYP=FULL/3-21G*

States and conformations

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