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	hartrees
Energy at 0K	-319.362785
Energy at 298.15K	-319.371875
HF Energy	-318.171890
Counterpoise corrected energy
CP Energy at 298.15K
Counterpoise optimized geometry corrected energy
CP opt. Energy at 298.15K
Nuclear repulsion energy	230.097961

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3758	3576	111.96
2	A	3722	3541	86.29
3	A	3579	3405	11.23
4	A	3387	3223	814.26
5	A	3193	3039	686.56
6	A	3122	2970	84.32
7	A	3034	2887	159.81
8	A	1783	1697	565.95
9	A	1738	1654	91.86
10	A	1663	1583	2.76
11	A	1646	1566	1.09
12	A	1434	1365	20.86
13	A	1430	1360	21.81
14	A	1375	1309	33.17
15	A	1357	1291	101.58
16	A	1163	1106	78.05
17	A	1116	1062	0.60
18	A	1104	1051	3.78
19	A	1073	1021	13.76
20	A	1057	1006	0.06
21	A	877	834	39.37
22	A	793	755	19.72
23	A	743	707	104.69
24	A	640	609	9.67
25	A	584	556	7.84
26	A	480	456	92.98
27	A	326	310	70.14
28	A	231	220	80.90
29	A	178	169	1.49
30	A	149	141	0.85
31	A	143	136	14.80
32	A	77	73	107.15
33	A	35	33	0.62

Atom	x (Å)	y (Å)	z (Å)
H1	0.557	1.212	0.026
N2	1.570	1.095	0.036
N3	-1.475	1.182	-0.019
C4	2.117	-0.131	-0.008
O5	1.498	-1.184	-0.059
C6	-2.121	0.073	-0.029
N7	-1.524	-1.133	0.102
H8	-0.514	-1.200	0.058
H9	2.162	1.902	0.081
H10	3.218	-0.113	0.007
H11	-2.113	1.963	-0.092
H12	-3.208	0.013	-0.114
H13	-2.054	-1.957	-0.104

	H1	N2	N3	C4	O5	C6	N7	H8	H9	H10	H11	H12	H13
H1		1.0194	2.0329	2.0595	2.5760	2.9114	3.1365	2.6393	1.7475	2.9731	2.7763	3.9541	4.1084
N2	1.0194		3.0465	1.3436	2.2819	3.8304	3.8128	3.0991	1.0022	2.0440	3.7860	4.9009	4.7393
N3	2.0329	3.0465		3.8251	3.7997	1.2839	2.3185	2.5694	3.7090	4.8688	1.0115	2.0925	3.1931
C4	2.0595	1.3436	3.8251		1.2226	4.2437	3.7783	2.8405	2.0356	1.1010	4.7215	5.3285	4.5541
O5	2.5760	2.2819	3.7997	1.2226		3.8312	3.0266	2.0149	3.1596	2.0276	4.7903	4.8560	3.6348
C6	2.9114	3.8304	1.2839	4.2437	3.8312		1.3518	2.0520	4.6588	5.3429	1.8919	1.0917	2.0323
N7	3.1365	3.8128	2.3185	3.7783	3.0266	1.3518		1.0135	4.7746	4.8516	3.1579	2.0484	1.0011
H8	2.6393	3.0991	2.5694	2.8405	2.0149	2.0520	1.0135		4.0961	3.8871	3.5476	2.9597	1.7238
H9	1.7475	1.0022	3.7090	2.0356	3.1596	4.6588	4.7746	4.0961		2.2763	4.2791	5.6959	5.7181
H10	2.9731	2.0440	4.8688	1.1010	2.0276	5.3429	4.8516	3.8871	2.2763		5.7224	6.4286	5.5861
H11	2.7763	3.7860	1.0115	4.7215	4.7903	1.8919	3.1579	3.5476	4.2791	5.7224		2.2368	3.9211
H12	3.9541	4.9009	2.0925	5.3285	4.8560	1.0917	2.0484	2.9597	5.6959	6.4286	2.2368		2.2835
H13	4.1084	4.7393	3.1931	4.5541	3.6348	2.0323	1.0011	1.7238	5.7181	5.5861	3.9211	2.2835

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H1	N2	C4	120.670	H1	N2	H9	119.639
H1	N3	C6	121.085	H1	N3	H11	128.355
N2	H1	N3	172.471	N2	C4	O5	125.481
N2	C4	H10	113.091	N3	C6	N7	123.190
N3	C6	H12	123.289	C4	N2	H9	119.691
C4	O5	H8	120.672	O5	C4	H10	121.428
O5	H8	N7	175.700	C6	N3	H11	110.457
C6	N7	H8	119.665	C6	N7	H13	118.724
N7	C6	H12	113.497	H8	N7	H13	117.664

All results from a given calculation for HCONH₂CN₂H₄ (formamide aminomethanimine dimer)

using model chemistry: MP2/Def2TZVPP

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 HCONH2CN2H4 (formamide aminomethanimine dimer)

using model chemistry: MP2/Def2TZVPP

States and conformations

All results from a given calculation for HCONH₂CN₂H₄ (formamide aminomethanimine dimer)