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	hartrees
Energy at 0K	-457.698081
Energy at 298.15K	-457.708036
HF Energy	-457.299688
Nuclear repulsion energy	176.769143

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3137	2973	33.94
2	A₁	3055	2896	21.99
3	A₁	1585	1502	9.78
4	A₁	1448	1372	4.30
5	A₁	1053	998	42.26
6	A₁	670	635	0.15
7	A₁	311	295	0.15
8	A₂	3149	2985	0.00
9	A₂	1561	1480	0.00
10	A₂	868	823	0.00
11	A₂	202	191	0.00
12	E	3150	2986	13.23
12	E	3150	2986	13.23
13	E	3136	2973	3.86
13	E	3136	2973	3.86
14	E	3058	2899	11.58
14	E	3058	2899	11.58
15	E	1576	1494	10.82
15	E	1576	1494	10.82
16	E	1566	1485	5.98
16	E	1566	1485	5.98
17	E	1425	1351	6.20
17	E	1425	1351	6.20
18	E	1036	982	23.37
18	E	1036	982	23.37
19	E	920	872	1.05
19	E	920	872	1.05
20	E	729	692	10.09
20	E	729	692	10.09
21	E	265	252	0.10
21	E	265	252	0.10
22	E	219	208	0.01
22	E	219	208	0.01

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	0.610
C2	0.000	1.628	-0.281
C3	1.410	-0.814	-0.281
C4	-1.410	-0.814	-0.281
H5	0.000	1.495	-1.371
H6	-0.887	2.205	0.004
H7	0.887	2.205	0.004
H8	1.295	-0.747	-1.371
H9	2.353	-0.334	0.004
H10	1.466	-1.871	0.004
H11	-1.295	-0.747	-1.371
H12	-1.466	-1.871	0.004
H13	-2.353	-0.334	0.004

	P1	C2	C3	C4	H5	H6	H7	H8	H9	H10	H11	H12	H13
P1		1.8558	1.8558	1.8558	2.4823	2.4526	2.4526	2.4823	2.4526	2.4526	2.4823	2.4526	2.4526
C2	1.8558		2.8191	2.8191	1.0982	1.0964	1.0964	2.9163	3.0765	3.8038	2.9163	3.8038	3.0765
C3	1.8558	2.8191		2.8191	2.9163	3.8038	3.0765	1.0982	1.0964	1.0964	2.9163	3.0765	3.8038
C4	1.8558	2.8191	2.8191		2.9163	3.0765	3.8038	2.9163	3.8038	3.0765	1.0982	1.0964	1.0964
H5	2.4823	1.0982	2.9163	2.9163		1.7843	1.7843	2.5891	3.2821	3.9202	2.5891	3.9202	3.2821
H6	2.4526	1.0964	3.8038	3.0765	1.7843		1.7749	3.9202	4.1163	4.7060	3.2821	4.1163	2.9310
H7	2.4526	1.0964	3.0765	3.8038	1.7843	1.7749		3.2821	2.9310	4.1163	3.9202	4.7060	4.1163
H8	2.4823	2.9163	1.0982	2.9163	2.5891	3.9202	3.2821		1.7843	1.7843	2.5891	3.2821	3.9202
H9	2.4526	3.0765	1.0964	3.8038	3.2821	4.1163	2.9310	1.7843		1.7749	3.9202	4.1163	4.7060
H10	2.4526	3.8038	1.0964	3.0765	3.9202	4.7060	4.1163	1.7843	1.7749		3.2821	2.9310	4.1163
H11	2.4823	2.9163	2.9163	1.0982	2.5891	3.2821	3.9202	2.5891	3.9202	3.2821		1.7843	1.7843
H12	2.4526	3.8038	3.0765	1.0964	3.9202	4.1163	4.7060	3.2821	4.1163	2.9310	1.7843		1.7749
H13	2.4526	3.0765	3.8038	1.0964	3.2821	2.9310	4.1163	3.9202	4.7060	4.1163	1.7843	1.7749

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	C2	H5	111.770	P1	C2	H6	109.659
P1	C2	H7	109.659	P1	C3	H8	111.770
P1	C3	H9	109.659	P1	C3	H10	109.659
P1	C4	H11	111.770	P1	C4	H12	109.659
P1	C4	H13	109.659	C2	P1	C3	98.844
C2	P1	C4	98.844	C3	P1	C4	98.844
H5	C2	H6	108.793	H5	C2	H7	108.793
H6	C2	H7	108.086	H8	C3	H9	108.793
H8	C3	H10	108.793	H9	C3	H10	108.086
H11	C4	H12	108.793	H11	C4	H13	108.793
H12	C4	H13	108.086

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

using model chemistry: MP2=FULL/3-21G*

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: MP2=FULL/3-21G*

States and conformations

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