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	hartrees
Energy at 0K	-283.702015
Energy at 298.15K	-283.709046
HF Energy	-282.859579
Nuclear repulsion energy	178.729152

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3789	3635	57.42
2	A'	3501	3359	0.21
3	A'	3081	2956	17.58
4	A'	1866	1790	251.51
5	A'	1686	1617	14.09
6	A'	1465	1406	8.47
7	A'	1446	1387	29.99
8	A'	1337	1283	6.76
9	A'	1207	1158	200.23
10	A'	1168	1121	85.03
11	A'	1007	966	139.74
12	A'	858	823	46.32
13	A'	644	618	12.83
14	A'	471	452	30.21
15	A'	264	254	8.16
16	A"	3573	3428	0.63
17	A"	3128	3001	11.47
18	A"	1408	1351	0.67
19	A"	1193	1144	1.37
20	A"	935	897	1.99
21	A"	665	638	95.23
22	A"	518	497	32.22
23	A"	255	245	46.17
24	A"	71	68	4.10

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.550	0.000
O2	1.183	0.812	0.000
O3	-0.971	1.496	0.000
C4	-0.587	-0.857	0.000
N5	0.398	-1.930	0.000
H6	-0.502	2.347	0.000
H7	-1.248	-0.946	0.882
H8	-1.248	-0.946	-0.882
H9	1.017	-1.781	0.803
H10	1.017	-1.781	-0.803

	C1	O2	O3	C4	N5	H6	H7	H8	H9	H10
C1		1.2117	1.3551	1.5251	2.5120	1.8657	2.1387	2.1387	2.6670	2.6670
O2	1.2117		2.2598	2.4333	2.8521	2.2793	3.1271	3.1271	2.7196	2.7196
O3	1.3551	2.2598		2.3840	3.6892	0.9722	2.6110	2.6110	3.9156	3.9156
C4	1.5251	2.4333	2.3840		1.4568	3.2056	1.1055	1.1055	2.0178	2.0178
N5	2.5120	2.8521	3.6892	1.4568		4.3708	2.1109	2.1109	1.0247	1.0247
H6	1.8657	2.2793	0.9722	3.2056	4.3708		3.4901	3.4901	4.4712	4.4712
H7	2.1387	3.1271	2.6110	1.1055	2.1109	3.4901		1.7642	2.4148	2.9438
H8	2.1387	3.1271	2.6110	1.1055	2.1109	3.4901	1.7642		2.9438	2.4148
H9	2.6670	2.7196	3.9156	2.0178	1.0247	4.4712	2.4148	2.9438		1.6067
H10	2.6670	2.7196	3.9156	2.0178	1.0247	4.4712	2.9438	2.4148	1.6067

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O3	H6	105.389	C1	C4	N5	114.772
C1	C4	H7	107.713	C1	C4	H8	107.713
O2	C1	O3	123.278	O2	C1	C4	125.129
O3	C1	C4	111.593	C4	N5	H9	107.527
C4	N5	H10	107.527	N5	C4	H7	110.183
N5	C4	H8	110.183	H7	C4	H8	105.859
H9	N5	H10	103.245

All results from a given calculation for H₂NCH₂COOH (Glycine)

using model chemistry: QCISD/cc-pVDZ

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 H2NCH2COOH (Glycine)

using model chemistry: QCISD/cc-pVDZ

States and conformations

All results from a given calculation for H₂NCH₂COOH (Glycine)