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	hartrees
Energy at 0K	-211.897336
Energy at 298.15K	-211.908896
HF Energy	-211.160283
Nuclear repulsion energy	189.933348

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3533	3365	0.47
2	A'	3185	3034	44.89
3	A'	3141	2992	10.54
4	A'	3119	2971	36.55
5	A'	2989	2847	129.90
6	A'	1524	1451	1.03
7	A'	1496	1425	4.87
8	A'	1403	1336	2.75
9	A'	1324	1261	1.15
10	A'	1256	1196	2.22
11	A'	1232	1173	7.74
12	A'	1088	1036	0.35
13	A'	1023	974	3.04
14	A'	965	919	3.27
15	A'	932	888	13.25
16	A'	915	871	58.94
17	A'	777	740	19.75
18	A'	585	557	32.54
19	A'	324	309	4.21
20	A"	3167	3016	0.47
21	A"	3138	2989	59.37
22	A"	3108	2961	17.26
23	A"	2987	2845	36.43
24	A"	1505	1434	1.00
25	A"	1472	1402	0.73
26	A"	1433	1365	3.59
27	A"	1329	1266	13.80
28	A"	1304	1242	9.12
29	A"	1245	1186	6.48
30	A"	1206	1149	0.88
31	A"	1151	1096	9.95
32	A"	1112	1059	0.01
33	A"	957	911	0.19
34	A"	877	835	2.13
35	A"	626	596	0.52
36	A"	63	60	0.11

Atom	x (Å)	y (Å)	z (Å)
N1	0.572	-1.079	0.000
H2	0.447	-2.095	0.000
C3	-0.110	-0.474	1.149
C4	-0.110	-0.474	-1.149
C5	-0.110	1.022	0.778
C6	-0.110	1.022	-0.778
H7	-1.159	-0.829	1.261
H8	-1.159	-0.829	-1.261
H9	0.426	-0.688	2.088
H10	0.426	-0.688	-2.088
H11	0.801	1.507	1.163
H12	0.801	1.507	-1.163
H13	-0.978	1.549	1.204
H14	-0.978	1.549	-1.204

	N1	H2	C3	C4	C5	C6	H7	H8	H9	H10	H11	H12	H13	H14
N1		1.0237	1.4664	1.4664	2.3420	2.3420	2.1569	2.1569	2.1291	2.1291	2.8455	2.8455	3.2803	3.2803
H2	1.0237		2.0636	2.0636	3.2608	3.2608	2.4034	2.4034	2.5177	2.5177	3.8025	3.8025	4.0941	4.0941
C3	1.4664	2.0636		2.2973	1.5412	2.4390	1.1140	2.6527	1.1023	3.2875	2.1806	3.1781	2.2020	3.2221
C4	1.4664	2.0636	2.2973		2.4390	1.5412	2.6527	1.1140	3.2875	1.1023	3.1781	2.1806	3.2221	2.2020
C5	2.3420	3.2608	1.5412	2.4390		1.5555	2.1823	2.9473	2.2201	3.3799	1.1015	2.1983	1.1018	2.2272
C6	2.3420	3.2608	2.4390	1.5412	1.5555		2.9473	2.1823	3.3799	2.2201	2.1983	1.1015	2.2272	1.1018
H7	2.1569	2.4034	1.1140	2.6527	2.1823	2.9473		2.5229	1.7936	3.7083	3.0515	3.8963	2.3853	3.4302
H8	2.1569	2.4034	2.6527	1.1140	2.9473	2.1823	2.5229		3.7083	1.7936	3.8963	3.0515	3.4302	2.3853
H9	2.1291	2.5177	1.1023	3.2875	2.2201	3.3799	1.7936	3.7083		4.1757	2.4118	3.9411	2.7853	4.2208
H10	2.1291	2.5177	3.2875	1.1023	3.3799	2.2201	3.7083	1.7936	4.1757		3.9411	2.4118	4.2208	2.7853
H11	2.8455	3.8025	2.1806	3.1781	1.1015	2.1983	3.0515	3.8963	2.4118	3.9411		2.3267	1.7800	2.9619
H12	2.8455	3.8025	3.1781	2.1806	2.1983	1.1015	3.8963	3.0515	3.9411	2.4118	2.3267		2.9619	1.7800
H13	3.2803	4.0941	2.2020	3.2221	1.1018	2.2272	2.3853	3.4302	2.7853	4.2208	1.7800	2.9619		2.4086
H14	3.2803	4.0941	3.2221	2.2020	2.2272	1.1018	3.4302	2.3853	4.2208	2.7853	2.9619	1.7800	2.4086

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C3	C5	102.248	N1	C3	H7	112.697
N1	C3	H9	111.169	N1	C4	C6	102.248
N1	C4	H8	112.697	N1	C4	H10	111.169
H2	N1	C3	110.668	H2	N1	C4	110.668
C3	N1	C4	103.124	C3	C5	C6	103.925
C3	C5	H11	110.094	C3	C5	H13	111.767
C4	C6	C5	103.925	C4	C6	H12	110.094
C4	C6	H14	111.767	C5	C3	H7	109.493
C5	C3	H9	113.192	C5	C6	H12	110.493
C5	C6	H14	112.775	C6	C4	H8	109.493
C6	C4	H10	113.192	C6	C5	H11	110.493
C6	C5	H13	112.775	H7	C3	H9	108.050
H8	C4	H10	108.050	H11	C5	H13	107.784
H12	C6	H14	107.784

All results from a given calculation for C₄H₉N (Pyrrolidine)

using model chemistry: MP2/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 C4H9N (Pyrrolidine)

using model chemistry: MP2/cc-pVDZ

States and conformations

All results from a given calculation for C₄H₉N (Pyrrolidine)