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	hartrees
Energy at 0K	-205.961707
Energy at 298.15K	-205.971961
HF Energy	-205.264898
Nuclear repulsion energy	137.343362

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3518	3415
2	A	3417	3317
3	A	3074	2984
4	A	1700	1650
5	A	1404	1363
6	A	999	970
7	A	893	867
8	A	561	544
9	A	319	309
10	E	3518	3415
10	E	3518	3415
11	E	3420	3320
11	E	3420	3320
12	E	1713	1662
12	E	1713	1662
13	E	1451	1408
13	E	1451	1408
14	E	1255	1219
14	E	1255	1218
15	E	1082	1050
15	E	1082	1050
16	E	969	941
16	E	969	940
17	E	448	435
17	E	448	435
18	E	304	295
18	E	304	295

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.370
H2	0.000	0.000	1.469
N3	0.000	1.400	-0.056
N4	1.212	-0.700	-0.056
N5	-1.212	-0.700	-0.056
H6	0.883	1.824	0.244
H7	1.138	-1.676	0.244
H8	-2.021	-0.147	0.244
H9	0.014	1.427	-1.082
H10	1.228	-0.726	-1.082
H11	-1.243	-0.701	-1.082

	C1	H2	N3	N4	N5	H6	H7	H8	H9	H10	H11
C1		1.0991	1.4628	1.4628	1.4628	2.0300	2.0300	2.0300	2.0352	2.0352	2.0352
H2	1.0991		2.0697	2.0697	2.0697	2.3676	2.3676	2.3676	2.9224	2.9224	2.9224
N3	1.4628	2.0697		2.4240	2.4240	1.0243	3.2933	2.5625	1.0261	2.6602	2.6473
N4	1.4628	2.0697	2.4240		2.4240	2.5625	1.0243	3.2933	2.6473	1.0261	2.6602
N5	1.4628	2.0697	2.4240	2.4240		3.2933	2.5625	1.0243	2.6602	2.6473	1.0261
H6	2.0300	2.3676	1.0243	2.5625	3.2933		3.5094	3.5094	1.6338	2.8941	3.5565
H7	2.0300	2.3676	3.2933	1.0243	2.5625	3.5094		3.5094	3.5565	1.6338	2.8941
H8	2.0300	2.3676	2.5625	3.2933	1.0243	3.5094	3.5094		2.8941	3.5565	1.6338
H9	2.0352	2.9224	1.0261	2.6473	2.6602	1.6338	3.5565	2.8941		2.4711	2.4711
H10	2.0352	2.9224	2.6602	1.0261	2.6473	2.8941	1.6338	3.5565	2.4711		2.4711
H11	2.0352	2.9224	2.6473	2.6602	1.0261	3.5565	2.8941	1.6338	2.4711	2.4711

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H6	108.120	C1	N3	H9	108.433
C1	N4	H7	108.120	C1	N4	H10	108.433
C1	N5	H8	108.120	C1	N5	H11	108.433
H2	C1	N3	106.919	H2	C1	N4	106.919
H2	C1	N5	106.919	N3	C1	N4	111.898
N3	C1	N5	111.898	N4	C1	N5	111.898
H6	N3	H9	105.659	H7	N4	H10	105.659
H8	N5	H11	105.660

All results from a given calculation for CH₇N₃ (triaminomethane)

using model chemistry: CCSD(T)=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: CCSD(T)=FULL/6-31G*

States and conformations

All results from a given calculation for CH₇N₃ (triaminomethane)