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TZV
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README,
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al,
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as,
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The text file is also avilable here
$basis
*
br TZV
# br (17s13p6d) / [6s5p2d] {842111/64111/51}
# SCF energy is -2572.3897960692 a.u. (virial theorem = 1.999999990)
# R. Ahlrichs, Sept. 93
*
8 s
565073.25256 .23660314690E-03
84701.723179 .18348332508E-02
19276.271900 .95465849860E-02
5456.4284576 .38877142153E-01
1776.9503500 .12718314231
639.19398276 .30437662191
248.78823961 .44490940497
98.678305494 .24381643058
4 s
606.07824568 -.26527158709E-01
188.45598484 -.12484584809
31.497144506 .56468683559
13.736008320 .55555268564
2 s
21.203212766 -.24940920493
3.7616420178 .71213119743
1 s
1.7735933962 1.0000000000
1 s
.45197413664 1.0000000000
1 s
.16613377099 1.0000000000
6 p
3019.6955723 .24971049798E-02
715.35481126 .20419267596E-01
229.98328751 .96897148309E-01
86.167844615 .28053901252
34.667870802 .44606390473
14.113870307 .24410073923
4 p
57.085653082 -.21855950710E-01
8.8193845840 .32707075320
3.9340302872 .57855229520
1.7998830384 .33570987698
1 p
.66899410512 1.0000000000
1 p
.27136238231 1.0000000000
1 p
.10083790243 1.0000000000
5 d
168.85370257 .89663981988E-02
49.977949919 .62062059316E-01
18.274913338 .21474732384
7.2455694631 .40335336746
2.8562315025 .42208813080
1 d
1.0459621144 .17874813267
*
$end
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