seniority/ethylene_cc-pvdz/pes_fci.dat

56 lines
1.4 KiB
Plaintext
Raw Normal View History

2022-01-14 17:05:13 +01:00
1.5 -77.21452292
1.6 -77.53661271
1.7 -77.77826215
1.8 -77.95805506
1.9 -78.09043833
2.0 -78.18650886
2.1 -78.25429019
2.2 -78.30052549
2.3 -78.33029575
2.4 -78.34745049
2.5 -78.35533331
2.52053 -78.35584460
2.6 -78.35571526
2.7 -78.35092732
2.8 -78.34231904
2.9 -78.33085163
3.0 -78.31753610
3.1 -78.30328458
3.2 -78.28832862
3.3 -78.27269228
3.4 -78.25768622
3.5 -78.24286005
3.6 -78.22816568
3.7 -78.21444592
3.8 -78.20117790
3.9 -78.18885039
4.0 -78.17746098
4.2 -78.15639273
4.4 -78.13870694
4.6 -78.12455516
4.8 -78.11261822
5.0 -78.10363711
5.2 -78.09649502
5.4 -78.09133691
5.6 -78.08748305
5.8 -78.08462481
6.0 -78.08221237
6.2 -78.08091237
6.4 -78.07971296
6.6 -78.07902530
6.8 -78.07822767
7.0 -78.07796479
7.2 -78.07759635
7.4 -78.07746102
7.6 -78.07729677
7.8 -78.07706364
8.0 -78.07688972
9.0 -78.07677157
10.0 -78.07688948
11.0 -78.07674833
12.0 -78.07694704
13.0 -78.07665465
14.0 -78.07675420
15.0 -78.07661068
16.0 -78.07685356