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	hartrees
Energy at 0K	-205.906026
Energy at 298.15K	-205.916309
HF Energy	-205.266060
Nuclear repulsion energy	137.783281

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3590	3382	0.01
2	A	3479	3278	3.37
3	A	3134	2953	31.34
4	A	1705	1606	58.12
5	A	1407	1326	1.47
6	A	989	931	10.98
7	A	903	851	1.00
8	A	567	534	24.37
9	A	325	307	87.07
10	E	3590	3383	0.71
10	E	3590	3383	0.71
11	E	3484	3283	0.11
11	E	3484	3283	0.11
12	E	1717	1618	26.79
12	E	1717	1618	26.79
13	E	1462	1377	28.48
13	E	1462	1377	28.48
14	E	1264	1191	63.96
14	E	1264	1191	63.96
15	E	1087	1024	40.45
15	E	1087	1024	40.45
16	E	961	905	244.14
16	E	961	905	244.14
17	E	453	427	42.31
17	E	453	427	42.31
18	E	306	289	22.68
18	E	306	289	22.68

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.368
H2	0.000	0.000	1.463
N3	0.000	1.395	-0.055
N4	1.208	-0.697	-0.055
N5	-1.208	-0.697	-0.055
H6	0.878	1.823	0.241
H7	1.140	-1.672	0.241
H8	-2.018	-0.151	0.241
H9	-0.001	1.429	-1.077
H10	1.238	-0.714	-1.077
H11	-1.237	-0.715	-1.077

	C1	H2	N3	N4	N5	H6	H7	H8	H9	H10	H11
C1		1.0949	1.4575	1.4575	1.4575	2.0272	2.0272	2.0272	2.0319	2.0319	2.0319
H2	1.0949		2.0618	2.0618	2.0618	2.3635	2.3635	2.3635	2.9141	2.9141	2.9141
N3	1.4575	2.0618		2.4155	2.4155	1.0207	3.2846	2.5589	1.0219	2.6493	2.6501
N4	1.4575	2.0618	2.4155		2.4155	2.5589	1.0207	3.2846	2.6501	1.0219	2.6493
N5	1.4575	2.0618	2.4155	2.4155		3.2846	2.5589	1.0207	2.6493	2.6501	1.0219
H6	2.0272	2.3635	1.0207	2.5589	3.2846		3.5043	3.5043	1.6323	2.8810	3.5566
H7	2.0272	2.3635	3.2846	1.0207	2.5589	3.5043		3.5043	3.5566	1.6323	2.8810
H8	2.0272	2.3635	2.5589	3.2846	1.0207	3.5043	3.5043		2.8810	3.5566	1.6323
H9	2.0319	2.9141	1.0219	2.6501	2.6493	1.6323	3.5566	2.8810		2.4743	2.4743
H10	2.0319	2.9141	2.6493	1.0219	2.6501	2.8810	1.6323	3.5566	2.4743		2.4743
H11	2.0319	2.9141	2.6501	2.6493	1.0219	3.5566	2.8810	1.6323	2.4743	2.4743

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H6	108.480	C1	N3	H9	108.801
C1	N4	H7	108.480	C1	N4	H10	108.801
C1	N5	H8	108.480	C1	N5	H11	108.801
H2	C1	N3	106.896	H2	C1	N4	106.896
H2	C1	N5	106.896	N3	C1	N4	111.919
N3	C1	N5	111.919	N4	C1	N5	111.919
H6	N3	H9	106.096	H7	N4	H10	106.096
H8	N5	H11	106.096

All results from a given calculation for CH₇N₃ (triaminomethane)

using model chemistry: MP2=FULL/6-31G*

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 CH7N3 (triaminomethane)

using model chemistry: MP2=FULL/6-31G*

States and conformations

All results from a given calculation for CH₇N₃ (triaminomethane)