seniority/ethylene_cc-pvdz/pes_s0.dat

56 lines
1.4 KiB
Plaintext
Raw Normal View History

2022-02-01 20:49:03 +01:00
1.5 -76.96573534
1.6 -77.28684483
1.7 -77.52709625
1.8 -77.70532789
1.9 -77.83591124
2.0 -77.92986946
2.1 -77.99578600
2.2 -78.04024618
2.3 -78.06825386
2.4 -78.08369229
2.5 -78.08956047
2.52053 -78.08980660
2.6 -78.08823211
2.7 -78.08161732
2.8 -78.07122979
2.9 -78.05824891
3.0 -78.04359279
3.1 -78.02786913
3.2 -78.01156179
3.3 -77.99492727
3.4 -77.97816331
3.5 -77.96153324
3.6 -77.94542324
3.7 -77.93025790
3.8 -77.91630964
3.9 -77.90360660
4.0 -77.89202876
4.2 -77.87166890
4.4 -77.85438806
4.6 -77.83976942
4.8 -77.82753005
5.0 -77.81745597
5.2 -77.80927195
5.4 -77.80267574
5.6 -77.79736983
5.8 -77.79324583
6.0 -77.79030583
6.2 -77.78814063
6.4 -77.78651487
6.6 -77.78531413
6.8 -77.78444701
7.0 -77.78383286
7.2 -77.78340240
7.4 -77.78310175
7.6 -77.78289140
7.8 -77.78273903
8.0 -77.78262138
9.0 -77.78224318
10.0 -77.78205534
11.0 -77.78198134
12.0 -77.78192986
13.0 -77.78188465
14.0 -77.78184166
15.0 -77.78179819
16.0 -77.78176095