seniority/H2O_cc-pvdz/pes_s4.dat

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2022-02-03 10:34:08 +01:00
0.6 -75.54138676
0.65 -75.79516840
0.7 -75.96831642
0.75 -76.08400864
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0.85 -76.20384619
0.9 -76.22778698
0.9572 -76.23681706
1.0 -76.23451385
1.05 -76.22500452
1.1 -76.21042758
1.2 -76.17272601
1.3 -76.13066424
1.4 -76.08918242
1.5 -76.05088557
1.6 -76.01689114