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	hartrees
Energy at 0K	-282.831096
Energy at 298.15K	-282.838316
HF Energy	-282.831096
Nuclear repulsion energy	181.029263

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	4052	3641	110.13
2	A'	3740	3360	2.99
3	A'	3237	2909	19.87
4	A'	2035	1828	385.93
5	A'	1851	1663	25.40
6	A'	1610	1447	9.20
7	A'	1570	1411	36.42
8	A'	1447	1300	19.39
9	A'	1309	1176	298.91
10	A'	1232	1107	40.01
11	A'	1044	938	198.00
12	A'	909	817	80.57
13	A'	698	627	15.68
14	A'	504	453	34.13
15	A'	281	253	10.82
16	A"	3820	3433	5.03
17	A"	3276	2943	15.52
18	A"	1515	1361	0.02
19	A"	1297	1165	2.11
20	A"	1008	906	6.63
21	A"	708	636	137.95
22	A"	552	496	38.53
23	A"	261	234	60.26
24	A"	83	75	5.31

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.551	0.000
O2	1.157	0.822	0.000
O3	-0.956	1.476	0.000
C4	-0.573	-0.851	0.000
N5	0.403	-1.908	0.000
H6	-0.545	2.335	0.000
H7	-1.219	-0.943	0.866
H8	-1.219	-0.943	-0.866
H9	1.000	-1.833	0.801
H10	1.000	-1.833	-0.801

	C1	O2	O3	C4	N5	H6	H7	H8	H9	H10
C1		1.1877	1.3298	1.5153	2.4924	1.8646	2.1147	2.1147	2.7064	2.7064
O2	1.1877		2.2116	2.4065	2.8319	2.2767	3.0840	3.0840	2.7770	2.7770
O3	1.3298	2.2116		2.3581	3.6467	0.9525	2.5829	2.5829	3.9257	3.9257
C4	1.5153	2.4065	2.3581		1.4391	3.1860	1.0846	1.0846	2.0197	2.0197
N5	2.4924	2.8319	3.6467	1.4391		4.3475	2.0771	2.0771	1.0015	1.0015
H6	1.8646	2.2767	0.9525	3.1860	4.3475		3.4570	3.4570	4.5159	4.5159
H7	2.1147	3.0840	2.5829	1.0846	2.0771	3.4570		1.7328	2.3915	2.9146
H8	2.1147	3.0840	2.5829	1.0846	2.0771	3.4570	1.7328		2.9146	2.3915
H9	2.7064	2.7770	3.9257	2.0197	1.0015	4.5159	2.3915	2.9146		1.6020
H10	2.7064	2.7770	3.9257	2.0197	1.0015	4.5159	2.9146	2.3915	1.6020

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O3	H6	108.439	C1	C4	N5	115.028
C1	C4	H7	107.697	C1	C4	H8	107.697
O2	C1	O3	122.817	O2	C1	C4	125.390
O3	C1	C4	111.792	C4	N5	H9	110.410
C4	N5	H10	110.410	N5	C4	H7	109.986
N5	C4	H8	109.986	H7	C4	H8	106.031
H9	N5	H10	106.217

All results from a given calculation for H₂NCH₂COOH (Glycine)

using model chemistry: HF/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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Number	Element	Mulliken
1	C	0.714
2	O	-0.559
3	O	-0.694
4	C	-0.229
5	N	-0.817
6	H	0.467
7	H	0.210
8	H	0.210
9	H	0.349
10	H	0.349

	x	y	z
x	4.977	-0.240	0.000
y	-0.240	4.737	0.000
z	0.000	0.000	3.555

<r²>	116.237
(<r²>)^1/2	10.781

All results from a given calculation for H2NCH2COOH (Glycine)

using model chemistry: HF/6-31G*

States and conformations

All results from a given calculation for H₂NCH₂COOH (Glycine)