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	hartrees
Energy at 0K	-62.547920
Energy at 298.15K	-62.557450
HF Energy	-61.622623
Nuclear repulsion energy	135.853611

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3521	3355	2.53
2	A	3462	3299	274.34
3	A	3187	3037	23.91
4	A	3145	2997	13.08
5	A	3141	2993	29.96
6	A	3075	2929	18.84
7	A	3040	2897	64.28
8	A	1815	1729	301.81
9	A	1547	1474	10.82
10	A	1532	1460	15.33
11	A	1520	1448	20.01
12	A	1502	1431	13.43
13	A	1486	1416	0.73
14	A	1439	1371	397.69
15	A	1366	1301	10.57
16	A	1304	1243	5.40
17	A	1238	1180	13.96
18	A	1190	1134	18.49
19	A	1165	1110	34.06
20	A	1142	1088	23.02
21	A	1020	972	31.48
22	A	985	938	13.11
23	A	927	884	68.26
24	A	879	838	24.46
25	A	795	757	73.56
26	A	642	612	3.85
27	A	569	542	8.69
28	A	470	447	8.48
29	A	379	361	2.72
30	A	285	272	3.30
31	A	211	201	2.31
32	A	136	129	2.87
33	A	79	75	7.18

Atom	x (Å)	y (Å)	z (Å)
N1	1.201	0.280	-0.325
C2	2.549	-0.080	0.167
C3	0.177	-0.715	0.050
C4	-1.224	-0.074	0.024
O5	-1.193	1.283	0.118
O6	-2.260	-0.717	-0.038
H7	1.234	0.333	-1.345
H8	0.159	-1.619	-0.573
H9	2.866	-1.087	-0.143
H10	3.268	0.652	-0.209
H11	0.361	-1.024	1.086
H12	2.548	-0.033	1.260
H13	-0.227	1.505	0.113

	N1	C2	C3	C4	O5	O6	H7	H8	H9	H10	H11	H12	H13
N1		1.4789	1.4763	2.4751	2.6339	3.6137	1.0222	2.1805	2.1612	2.1032	2.0968	2.1027	1.9323
C2	1.4789		2.4585	3.7752	3.9832	4.8557	2.0462	2.9378	1.1000	1.0932	2.5544	1.0937	3.1971
C3	1.4763	2.4585		1.5406	2.4240	2.4389	2.0398	1.0980	2.7217	3.3901	1.0967	2.7480	2.2578
C4	2.4751	3.7752	1.5406		1.3603	1.2218	2.8418	2.1577	4.2166	4.5558	2.1311	3.9691	1.8693
O5	2.6339	3.9832	2.4240	1.3603		2.2723	2.9886	3.2755	4.7078	4.5175	2.9457	4.1273	0.9917
O6	3.6137	4.8557	2.4389	1.2218	2.2723		3.8754	2.6367	5.1411	5.6981	2.8684	5.0272	3.0160
H7	1.0222	2.0462	2.0398	2.8418	2.9886	3.8754		2.3586	2.4748	2.3518	2.9178	2.9404	2.3734
H8	2.1805	2.9378	1.0980	2.1577	3.2755	2.6367	2.3586		2.7928	3.8680	1.7739	3.4036	3.2222
H9	2.1612	1.1000	2.7217	4.2166	4.7078	5.1411	2.4748	2.7928		1.7860	2.7915	1.7830	4.0436
H10	2.1032	1.0932	3.3901	4.5558	4.5175	5.6981	2.3518	3.8680	1.7860		3.5975	1.7737	3.6118
H11	2.0968	2.5544	1.0967	2.1311	2.9457	2.8684	2.9178	1.7739	2.7915	3.5975		2.4079	2.7732
H12	2.1027	1.0937	2.7480	3.9691	4.1273	5.0272	2.9404	3.4036	1.7830	1.7737	2.4079		3.3736
H13	1.9323	3.1971	2.2578	1.8693	0.9917	3.0160	2.3734	3.2222	4.0436	3.6118	2.7732	3.3736

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	H9	113.050	N1	C2	H10	108.787
N1	C2	H12	108.719	N1	C3	C4	110.235
N1	C3	H8	114.992	N1	C3	H11	108.258
C2	N1	C3	112.596	C2	N1	H7	108.411
C3	N1	H7	108.074	C3	C4	O5	113.207
C3	C4	O6	123.573	C4	C3	H8	108.557
C4	C3	H11	106.597	C4	O5	H13	104.164
O5	C4	O6	123.192	H8	C3	H11	107.853
H9	C2	H10	109.043	H9	C2	H12	108.741
H10	C2	H12	108.402

All results from a given calculation for CH₃NHCH₂COOH (Sarcosine)

using model chemistry: MP2/CEP-121G*

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 CH3NHCH2COOH (Sarcosine)

using model chemistry: MP2/CEP-121G*

States and conformations

All results from a given calculation for CH₃NHCH₂COOH (Sarcosine)