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	hartrees
Energy at 0K	-206.339566
Energy at 298.15K	-206.349621
HF Energy	-205.360655
Nuclear repulsion energy	137.969801

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3577	3577
2	A	3477	3477
3	A	3070	3070
4	A	1640	1640
5	A	1353	1353
6	A	930	930
7	A	857	857
8	A	552	552
9	A	301	301
10	E	3578	3578
10	E	3578	3578
11	E	3483	3483
11	E	3482	3482
12	E	1651	1651
12	E	1651	1651
13	E	1422	1422
13	E	1422	1422
14	E	1226	1226
14	E	1225	1225
15	E	1052	1052
15	E	1052	1052
16	E	893	893
16	E	892	892
17	E	442	442
17	E	442	442
18	E	254	254
18	E	254	254

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.373
H2	0.000	0.000	1.465
N3	0.000	1.392	-0.054
N4	1.205	-0.696	-0.054
N5	-1.205	-0.696	-0.054
H6	0.877	1.829	0.215
H7	1.145	-1.674	0.215
H8	-2.022	-0.155	0.215
H9	-0.054	1.438	-1.069
H10	1.273	-0.672	-1.069
H11	-1.219	-0.766	-1.069

	C1	H2	N3	N4	N5	H6	H7	H8	H9	H10	H11
C1		1.0928	1.4559	1.4559	1.4559	2.0342	2.0342	2.0342	2.0369	2.0369	2.0369
H2	1.0928		2.0608	2.0608	2.0608	2.3826	2.3826	2.3826	2.9143	2.9143	2.9143
N3	1.4559	2.0608		2.4108	2.4108	1.0158	3.2835	2.5602	1.0168	2.6285	2.6777
N4	1.4559	2.0608	2.4108		2.4108	2.5602	1.0158	3.2835	2.6777	1.0168	2.6285
N5	1.4559	2.0608	2.4108	2.4108		3.2835	2.5602	1.0158	2.6285	2.6777	1.0168
H6	2.0342	2.3826	1.0158	2.5602	3.2835		3.5127	3.5127	1.6329	2.8389	3.5735
H7	2.0342	2.3826	3.2835	1.0158	2.5602	3.5127		3.5127	3.5735	1.6329	2.8389
H8	2.0342	2.3826	2.5602	3.2835	1.0158	3.5127	3.5127		2.8389	3.5735	1.6329
H9	2.0369	2.9143	1.0168	2.6777	2.6285	1.6329	3.5735	2.8389		2.4930	2.4930
H10	2.0369	2.9143	2.6285	1.0168	2.6777	2.8389	1.6329	3.5735	2.4930		2.4930
H11	2.0369	2.9143	2.6777	2.6285	1.0168	3.5735	2.8389	1.6329	2.4930	2.4930

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H6	109.482	C1	N3	H9	109.646
C1	N4	H7	109.482	C1	N4	H10	109.646
C1	N5	H8	109.482	C1	N5	H11	109.646
H2	C1	N3	107.053	H2	C1	N4	107.053
H2	C1	N5	107.053	N3	C1	N4	111.777
N3	C1	N5	111.777	N4	C1	N5	111.777
H6	N3	H9	106.898	H7	N4	H10	106.898
H8	N5	H11	106.898

All results from a given calculation for CH₇N₃ (triaminomethane)

using model chemistry: MP4=FULL/6-311+G(3df,2p)

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: MP4=FULL/6-311+G(3df,2p)

States and conformations

All results from a given calculation for CH₇N₃ (triaminomethane)