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	hartrees
Energy at 0K	-230.229471
Energy at 298.15K
Nuclear repulsion energy	194.530536

Number	Element	Mulliken
1	C	0.056
2	C	-0.288
3	C	-0.288
4	C	-0.212
5	C	-0.212
6	C	-0.226
7	H	0.241
8	H	0.241
9	H	0.230
10	H	0.230
11	H	0.227

	x	y	z	Total
	0.000	0.000	-0.898	0.898
CHELPG
AIM
ESP

	x	y	z
x	0.000	0.000	0.000
y	0.000	0.000	0.000
z	0.000	0.000	0.000

<r²>	121.933
(<r²>)^1/2	11.042

All results from a given calculation for C₆H₅ (phenyl)

using model chemistry: mPW1PW91/3-21G

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 C6H5 (phenyl)

using model chemistry: mPW1PW91/3-21G

States and conformations

All results from a given calculation for C₆H₅ (phenyl)