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	hartrees
Energy at 0K	-322.796345
Energy at 298.15K	-322.806057
Nuclear repulsion energy	245.562829

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3882	3882	245.44
2	A	3694	3694	5.94
3	A	3245	3245	27.00
4	A	3210	3210	10.23
5	A	3205	3205	35.44
6	A	3162	3162	19.98
7	A	3118	3118	60.63
8	A	1996	1996	395.92
9	A	1598	1598	21.04
10	A	1578	1578	5.89
11	A	1572	1572	22.13
12	A	1557	1557	8.88
13	A	1537	1537	0.87
14	A	1504	1504	430.58
15	A	1434	1434	30.15
16	A	1363	1363	6.55
17	A	1311	1311	4.71
18	A	1259	1259	24.29
19	A	1223	1223	25.35
20	A	1200	1200	16.00
21	A	1060	1060	19.97
22	A	1044	1044	13.56
23	A	942	942	30.34
24	A	911	911	59.27
25	A	772	772	87.37
26	A	691	691	4.17
27	A	619	619	16.12
28	A	499	499	12.03
29	A	388	388	3.36
30	A	286	286	3.41
31	A	215	215	2.44
32	A	132	132	2.96
33	A	84	84	7.12

Atom	x (Å)	y (Å)	z (Å)
N1	1.196	0.266	-0.323
C2	2.526	-0.066	0.164
C3	0.175	-0.695	0.053
C4	-1.214	-0.071	0.023
O5	-1.212	1.253	0.115
O6	-2.207	-0.718	-0.041
H7	1.222	0.345	-1.325
H8	0.154	-1.601	-0.550
H9	2.864	-1.057	-0.148
H10	3.235	0.672	-0.199
H11	0.346	-0.996	1.085
H12	2.530	-0.031	1.249
H13	-0.291	1.521	0.117

	N1	C2	C3	C4	O5	O6	H7	H8	H9	H10	H11	H12	H13
N1		1.4545	1.4514	2.4579	2.6388	3.5537	1.0056	2.1501	2.1360	2.0824	2.0726	2.0831	1.9951
C2	1.4545		2.4362	3.7426	3.9637	4.7822	2.0212	2.9142	1.0922	1.0852	2.5428	1.0862	3.2334
C3	1.4514	2.4362		1.5226	2.3914	2.3841	2.0188	1.0887	2.7212	3.3605	1.0884	2.7239	2.2653
C4	2.4579	3.7426	1.5226		1.3273	1.1866	2.8147	2.1303	4.1992	4.5157	2.1015	3.9402	1.8434
O5	2.6388	3.9637	2.3914	1.3273		2.2129	2.9700	3.2327	4.6921	4.4951	2.9020	4.1151	0.9593
O6	3.5537	4.7822	2.3841	1.1866	2.2129		3.8127	2.5718	5.0841	5.6187	2.8041	4.9577	2.9513
H7	1.0056	2.0212	2.0188	2.8147	2.9700	3.8127		2.3512	2.4590	2.3297	2.8933	2.9119	2.3983
H8	2.1501	2.9142	1.0887	2.1303	3.2327	2.5718	2.3512		2.7938	3.8447	1.7535	3.3690	3.2236
H9	2.1360	1.0922	2.7212	4.1992	4.6921	5.0841	2.4590	2.7938		1.7683	2.8047	1.7655	4.0829
H10	2.0824	1.0852	3.3605	4.5157	4.4951	5.6187	2.3297	3.8447	1.7683		3.5739	1.7565	3.6399
H11	2.0726	2.5428	1.0884	2.1015	2.9020	2.8041	2.8933	1.7535	2.8047	3.5739		2.3937	2.7708
H12	2.0831	1.0862	2.7239	3.9402	4.1151	4.9577	2.9119	3.3690	1.7655	1.7565	2.3937		3.4128
H13	1.9951	3.2334	2.2653	1.8434	0.9593	2.9513	2.3983	3.2236	4.0829	3.6399	2.7708	3.4128

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	H9	113.250	N1	C2	H10	109.297
N1	C2	H12	109.295	N1	C3	C4	111.450
N1	C3	H8	114.910	N1	C3	H11	108.543
C2	N1	C3	113.941	C2	N1	H7	109.134
C3	N1	H7	109.157	C3	C4	O5	113.914
C3	C4	O6	122.799	C4	C3	H8	108.185
C4	C3	H11	105.995	C4	O5	H13	106.330
O5	C4	O6	123.255	H8	C3	H11	107.313
H9	C2	H10	108.607	H9	C2	H12	108.277
H10	C2	H12	107.980

All results from a given calculation for CH₃NHCH₂COOH (Sarcosine)

using model chemistry: CISD/6-311G**

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: CISD/6-311G**

States and conformations

All results from a given calculation for CH₃NHCH₂COOH (Sarcosine)