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	hartrees
Energy at 0K	-460.273470
Energy at 298.15K	-460.283044
HF Energy	-459.595348
Nuclear repulsion energy	175.265986

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3132	3060
2	A₁	3043	2973
3	A₁	1527	1492
4	A₁	1402	1370
5	A₁	1015	991
6	A₁	667	652
7	A₁	291	284
8	A₂	3147	3075
9	A₂	1504	1470
10	A₂	825	806
11	A₂	174	170
12	E	3148	3075
12	E	3148	3075
13	E	3133	3060
13	E	3132	3060
14	E	3045	2975
14	E	3045	2975
15	E	1520	1484
15	E	1519	1484
16	E	1508	1474
16	E	1508	1474
17	E	1378	1346
17	E	1378	1346
18	E	997	974
18	E	997	974
19	E	879	859
19	E	879	859
20	E	728	712
20	E	728	711
21	E	252	247
21	E	251	245
22	E	203	198
22	E	203	198

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	0.626
C2	0.000	1.637	-0.289
C3	1.417	-0.818	-0.289
C4	-1.417	-0.818	-0.289
H5	0.000	1.489	-1.386
H6	-0.894	2.222	-0.005
H7	0.894	2.222	-0.005
H8	1.289	-0.744	-1.386
H9	2.371	-0.337	-0.005
H10	1.477	-1.885	-0.005
H11	-1.289	-0.744	-1.386
H12	-1.477	-1.885	-0.005
H13	-2.371	-0.337	-0.005

	P1	C2	C3	C4	H5	H6	H7	H8	H9	H10	H11	H12	H13
P1		1.8749	1.8749	1.8749	2.5029	2.4766	2.4766	2.5029	2.4766	2.4766	2.5029	2.4766	2.4766
C2	1.8749		2.8349	2.8349	1.1075	1.1053	1.1053	2.9216	3.0979	3.8295	2.9216	3.8295	3.0979
C3	1.8749	2.8349		2.8349	2.9216	3.8295	3.0979	1.1075	1.1053	1.1053	2.9216	3.0979	3.8295
C4	1.8749	2.8349	2.8349		2.9216	3.0979	3.8295	2.9216	3.8295	3.0979	1.1075	1.1053	1.1053
H5	2.5029	1.1075	2.9216	2.9216		1.8011	1.8011	2.5783	3.2956	3.9332	2.5783	3.9332	3.2956
H6	2.4766	1.1053	3.8295	3.0979	1.8011		1.7877	3.9332	4.1480	4.7421	3.2956	4.1480	2.9544
H7	2.4766	1.1053	3.0979	3.8295	1.8011	1.7877		3.2956	2.9544	4.1480	3.9332	4.7421	4.1480
H8	2.5029	2.9216	1.1075	2.9216	2.5783	3.9332	3.2956		1.8011	1.8011	2.5783	3.2956	3.9332
H9	2.4766	3.0979	1.1053	3.8295	3.2956	4.1480	2.9544	1.8011		1.7877	3.9332	4.1480	4.7421
H10	2.4766	3.8295	1.1053	3.0979	3.9332	4.7421	4.1480	1.8011	1.7877		3.2956	2.9544	4.1480
H11	2.5029	2.9216	2.9216	1.1075	2.5783	3.2956	3.9332	2.5783	3.9332	3.2956		1.8011	1.8011
H12	2.4766	3.8295	3.0979	1.1053	3.9332	4.1480	4.7421	3.2956	4.1480	2.9544	1.8011		1.7877
H13	2.4766	3.0979	3.8295	1.1053	3.2956	2.9544	4.1480	3.9332	4.7421	4.1480	1.8011	1.7877

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	C2	H5	111.507	P1	C2	H6	109.692
P1	C2	H7	109.692	P1	C3	H8	111.507
P1	C3	H9	109.692	P1	C3	H10	109.692
P1	C4	H11	111.507	P1	C4	H12	109.692
P1	C4	H13	109.692	C2	P1	C3	98.227
C2	P1	C4	98.227	C3	P1	C4	98.227
H5	C2	H6	108.966	H5	C2	H7	108.966
H6	C2	H7	107.941	H8	C3	H9	108.966
H8	C3	H10	108.966	H9	C3	H10	107.941
H11	C4	H12	108.966	H11	C4	H13	108.966
H12	C4	H13	107.941

All results from a given calculation for P(CH₃)₃ (trimethylphosphine)

using model chemistry: MP4/aug-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 P(CH3)3 (trimethylphosphine)

using model chemistry: MP4/aug-cc-pVDZ

States and conformations

All results from a given calculation for P(CH₃)₃ (trimethylphosphine)