diff --git a/Be2_cc-pvtz/pes_ooCIo1.dat b/Be2_cc-pvtz/pes_ooCIo1.dat
index d410951..d4dccad 100644
--- a/Be2_cc-pvtz/pes_ooCIo1.dat
+++ b/Be2_cc-pvtz/pes_ooCIo1.dat
@@ -4,9 +4,9 @@
 2.3          -29.20815800
 2.4          -29.21142216
 2.5          -29.21413546
-2.6          -29.21616937
-2.7          -29.21875252
-2.8          -29.22100230
+2.6          -29.21660922
+2.7          -29.21891460
+2.8          -29.22102909
 2.9          -29.22297028
 3.0          -29.22468989
 3.1          -29.22618679
diff --git a/F2_cc-pvdz/fit_eq.sh b/F2_cc-pvdz/fit_eq.sh
index 3493cf1..c1d965c 100755
--- a/F2_cc-pvdz/fit_eq.sh
+++ b/F2_cc-pvdz/fit_eq.sh
@@ -154,7 +154,7 @@ if [[ $(grep 'a24 ' a0.dat) ]]; then grep '3   ' det_CIo.dat | cut -c 4- >> det.
 paste det.dat a.dat D.dat > det_aD.dat
 
 grep 'FCI'      det_aD.dat | sed 's/FCI/1 /g'     >  det_aD_FCI.dat
-grep 'FCI'      det_aD.dat | sed 's/FCI/1.0E9 /g' >> det_aD_FCI.dat
+grep 'FCI'      det_aD.dat | sed 's/FCI/1.0E10/g' >> det_aD_FCI.dat
 
 grep 'RHF'      det_aD.dat | sed 's/RHF/0 /g'      >  det_aD_CI.dat
 grep 'hfCIS '   det_aD.dat | sed 's/hfCIS /1 /g'   >> det_aD_CI.dat
@@ -253,7 +253,7 @@ grep 'xe24 ' xe0.dat | sed 's/xe24/ooCIo3   /g' >> xe.dat
 paste det.dat xe.dat D.dat > det_xe.dat
 
 grep 'FCI' det_xe.dat | sed 's/FCI/1 /g'   >  det_xe_FCI.dat
-grep 'FCI' det_xe.dat | sed 's/FCI/1E9 /g' >> det_xe_FCI.dat
+grep 'FCI' det_xe.dat | sed 's/FCI/1E10/g' >> det_xe_FCI.dat
 
 grep 'RHF'      det_xe.dat | sed 's/RHF/0 /g'      >  det_xe_CI.dat
 grep 'hfCIS '   det_xe.dat | sed 's/hfCIS /1 /g'   >> det_xe_CI.dat
diff --git a/F2_cc-pvdz/pes_ooCIo3.dat b/F2_cc-pvdz/pes_ooCIo3.dat
new file mode 100644
index 0000000..fe46eb0
--- /dev/null
+++ b/F2_cc-pvdz/pes_ooCIo3.dat
@@ -0,0 +1,41 @@
+0.95        -198.67411666
+1.0         -198.80170777
+1.05        -198.89376243
+1.1         -198.95964863
+1.2         -199.03996503
+1.25        -199.06254688
+1.35        -199.08579214
+1.45        -199.09193926
+1.5         -199.09148173
+1.55        -199.08942559
+1.6         -199.08664945
+1.65        -199.08322950
+1.7         -199.08322904
+1.9         -199.08322923
+2.1         -199.08322921
+2.2         -199.08322907
+2.3         -199.08312212
+2.4         -199.08322936
+2.5         -199.08322911
+2.6         -199.08322922
+2.7         -199.08322922
+2.8         -199.08327457
+2.9         -199.08322924
+3.0         -199.08304423
+3.1         -199.08322934
+3.2         -199.08322917
+3.3         -199.08322937
+3.4         -199.08322930
+3.5         -199.08322893
+4.0         -199.08322933
+4.5         -199.08322911
+5.0         -199.08328695
+5.5         -199.08322914
+6.0         -199.08322896
+6.5         -199.08322960
+7.0         -199.08322915
+7.5         -199.07992038
+8.0         -199.08322905
+8.5         -199.08323125
+9.0         -199.08322905
+9.5         -199.08322932
diff --git a/F2_cc-pvdz/plot_error.gnu b/F2_cc-pvdz/plot_error.gnu
index 1578ee9..3a94815 100644
--- a/F2_cc-pvdz/plot_error.gnu
+++ b/F2_cc-pvdz/plot_error.gnu
@@ -88,6 +88,7 @@ plot '< paste pes_fci.dat pes_rhf.dat'      using 1:($4-$2) w l ls 1 notitle, \
      '< paste pes_fci.dat pes_ooCIo1.5.dat' using 1:($4-$2) w l ls 5 notitle, \
      '< paste pes_fci.dat pes_ooCIo2.dat'   using 1:($4-$2) w l ls 4 notitle, \
      '< paste pes_fci.dat pes_ooCIo2.5.dat' using 1:($4-$2) w l ls 5 notitle, \
+     '< paste pes_fci.dat pes_ooCIo3.dat'   using 1:($4-$2) w l ls 4 notitle, \
      '< paste pes_fci.dat pes_fci.dat'      using 1:($4-$2) w l ls 2 notitle
 
 ###################################################################################
diff --git a/F2_cc-pvdz/plot_pes.gnu b/F2_cc-pvdz/plot_pes.gnu
index 44f8c68..395c81d 100644
--- a/F2_cc-pvdz/plot_pes.gnu
+++ b/F2_cc-pvdz/plot_pes.gnu
@@ -122,6 +122,7 @@ plot 'pes_rhf.dat'      w l ls 1 notitle, \
      'pes_ooCIo1.5.dat' w l ls 5 notitle, \
      'pes_ooCIo2.dat'   w l ls 4 notitle, \
      'pes_ooCIo2.5.dat' w l ls 5 notitle, \
+     'pes_ooCIo3.dat'   w l ls 4 notitle, \
      'pes_fci.dat'      w l ls 2 notitle
 
 ###################################################################################
diff --git a/H8_cc-pvdz/pes_CISDTQ.dat b/H8_cc-pvdz/pes_CISDTQ.dat
index 9d6a519..d9bd373 100644
--- a/H8_cc-pvdz/pes_CISDTQ.dat
+++ b/H8_cc-pvdz/pes_CISDTQ.dat
@@ -50,21 +50,21 @@
 5.3           -3.93724673
 5.4           -3.93790329
 5.5           -3.93851531
-#5.6           -3.97676976
+5.6           -3.93908285
 5.7           -3.93961604
 5.8           -3.94012202
-#5.9           -3.94038278
+5.9           -3.94060339
 6.0            -3.94106391
 #6.1           -3.93960957
 #6.2           -3.93673111
-#6.3           -3.86513806
+6.3           -3.94234878
 #6.4           -4.03895963
 #6.5           -3.93781661
 6.6           -3.94353415
 6.7           -3.94390984
-#6.8           -3.94486071
+6.8           -3.94427435
 6.9           -3.94462960
-#7.0           -3.94076026
+7.0           -3.94498504
 7.5           -3.94652098
 8.0           -3.94774171
 #8.5           -3.94767783
diff --git a/H8_cc-pvdz/pes_ooCISD.dat b/H8_cc-pvdz/pes_ooCISD.dat
index 7870ef7..e7790b0 100644
--- a/H8_cc-pvdz/pes_ooCISD.dat
+++ b/H8_cc-pvdz/pes_ooCISD.dat
@@ -46,3 +46,8 @@
 4.9           -3.76474094
 5.0           -4.00645858
 5.1           -4.00462218
+5.2           -4.00305635
+5.3           -4.00172252
+5.4           -4.00058863
+5.5           -3.99962778
+5.6           -3.99881039
diff --git a/H8_cc-pvdz/pes_ooCIo1.5.dat b/H8_cc-pvdz/pes_ooCIo1.5.dat
index f41d3e9..0ecbbc3 100644
--- a/H8_cc-pvdz/pes_ooCIo1.5.dat
+++ b/H8_cc-pvdz/pes_ooCIo1.5.dat
@@ -16,3 +16,29 @@
 2.1           -4.41804393
 2.15          -4.40609702
 2.2           -4.39324116
+2.25          -4.37964335
+2.3           -4.36541816
+2.4           -4.33560845
+2.5           -4.30463762
+2.6           -4.27311953
+2.7           -4.24152287
+2.8           -4.21021659
+2.9           -4.17946724
+3.0           -4.14945296
+3.1           -4.12031567
+3.2           -4.09221224
+3.3           -4.06516377
+3.4           -4.03918766
+3.5           -4.01429567
+3.6           -3.99047740
+3.7           -3.96771121
+3.8           -3.94596589
+3.9           -3.92520457
+4.0           -3.90538805
+4.1           -3.88647567
+4.2           -3.86842890
+4.3           -3.85120620
+4.4           -3.83476833
+4.5           -3.81908266
+4.6           -3.80411459
+4.7           -3.78982876
diff --git a/H8_cc-pvdz/pes_ooCIo2.dat b/H8_cc-pvdz/pes_ooCIo2.dat
new file mode 100644
index 0000000..1263c3c
--- /dev/null
+++ b/H8_cc-pvdz/pes_ooCIo2.dat
@@ -0,0 +1,26 @@
+1.0           -3.44264191
+1.1           -3.80394822
+1.2           -4.05321075
+1.3           -4.22379281
+1.4           -4.33809435
+1.5           -4.41165353
+1.6           -4.45544910
+1.7           -4.47722664
+1.75          -4.48181406
+1.8           -4.48292621
+1.85          -4.48109504
+1.9           -4.47708231
+1.95          -4.47024232
+2.0           -4.46242175
+2.05          -4.45241887
+2.1           -4.44160247
+2.15          -4.42947635
+2.2           -4.41646807
+2.25          -4.40272791
+2.3           -4.38840002
+2.4           -4.35845694
+2.5           -4.32739405
+2.6           -4.29597604
+2.7           -4.26461423
+2.8           -4.23363769
+2.9           -4.20336457
diff --git a/H8_cc-pvdz/plot_error.gnu b/H8_cc-pvdz/plot_error.gnu
index a384857..089e396 100644
--- a/H8_cc-pvdz/plot_error.gnu
+++ b/H8_cc-pvdz/plot_error.gnu
@@ -17,11 +17,11 @@ xmax=10.0
 #set xrange[0.95:5.0]
 set xrange[1.0:10.0]
 
-ymin=1.0e-4
+ymin=1.0e-3
 ymax=1.0
 # VIEW 1
 set logscale y
-set yrange[1.0e-4:1.0]
+set yrange[1.0e-3:1.0]
 set format y "10^{%T}"
 
 # VIEW 2
diff --git a/ethylene_cc-pvdz/pes_ooCIS.dat b/ethylene_cc-pvdz/pes_ooCIS.dat
index f3e7756..2923aeb 100644
--- a/ethylene_cc-pvdz/pes_ooCIS.dat
+++ b/ethylene_cc-pvdz/pes_ooCIS.dat
@@ -31,10 +31,10 @@
 4.8          -77.78246546
 5.0          -77.76349711
 5.2          -77.74618578
-5.4          -77.73036272
-5.6          -77.71587711
-5.8          -77.70259501
-6.0          -77.69039650
+5.4          -77.75021828
+5.6          -77.75585060
+5.8          -77.76034073
+6.0          -77.76395397
 6.2          -77.76688989
 6.4          -77.76929692
 6.6          -77.77128725
@@ -44,3 +44,12 @@
 7.4          -77.77645064
 7.6          -77.77726332
 7.8          -77.77794502
+8.0          -77.77851817
+9.0          -77.78033580
+10.0         -77.78129847
+11.0         -77.78191177
+12.0         -77.78232383
+13.0         -77.78260622
+14.0         -77.78280616
+15.0         -77.78295080
+16.0         -77.78305758
diff --git a/ethylene_cc-pvdz/pes_ooCIo2.5.dat b/ethylene_cc-pvdz/pes_ooCIo2.5.dat
index 5499266..1cb01ea 100644
--- a/ethylene_cc-pvdz/pes_ooCIo2.5.dat
+++ b/ethylene_cc-pvdz/pes_ooCIo2.5.dat
@@ -3,3 +3,5 @@
 2.4          -78.32070928
 2.5          -78.32731246
 2.52053      -78.32771016
+2.6          -78.32672973
+2.7	     -78.32073233
diff --git a/ethylene_cc-pvdz/pes_ooCIs0.dat b/ethylene_cc-pvdz/pes_ooCIs0.dat
index 5671b84..09cdff3 100644
--- a/ethylene_cc-pvdz/pes_ooCIs0.dat
+++ b/ethylene_cc-pvdz/pes_ooCIs0.dat
@@ -26,13 +26,13 @@
 3.9          -78.01226506
 4.0          -78.00037586
 4.2          -77.97899188
-4.4          -77.82918643
-4.6          -77.84720120
-4.8          -77.86124598
-5.0          -77.87222382
-5.2          -77.88081133
-5.4          -77.88755983
-5.6          -77.89289658
+4.4          -77.96060826
+4.6          -77.94505960
+4.8          -77.93212505
+5.0          -77.92154007
+5.2          -77.91302676
+5.4          -77.90630996
+5.6          -77.90103777
 5.8          -77.89715467
 6.0          -77.90058549
 6.2          -77.90337850
diff --git a/ethylene_cc-pvdz/plot_error.gnu b/ethylene_cc-pvdz/plot_error.gnu
index fd59c25..8aeba30 100644
--- a/ethylene_cc-pvdz/plot_error.gnu
+++ b/ethylene_cc-pvdz/plot_error.gnu
@@ -80,6 +80,7 @@ plot '< paste pes_fci.dat pes_rhf.dat'      using 1:($4-$2) w l ls 1 notitle, \
      '< paste pes_fci.dat pes_ooCIo1.dat'   using 1:($4-$2) w l ls 4 notitle, \
      '< paste pes_fci.dat pes_ooCIo1.5.dat' using 1:($4-$2) w l ls 5 notitle, \
      '< paste pes_fci.dat pes_ooCIo2.dat'   using 1:($4-$2) w l ls 4 notitle, \
+     '< paste pes_fci.dat pes_ooCIo2.5.dat' using 1:($4-$2) w l ls 5 notitle, \
      '< paste pes_fci.dat pes_fci.dat'      using 1:($4-$2) w l ls 2 notitle
 
 ###################################################################################