Chiral Kinetic Resolution

RUN YOUR MODEL IN SIX STEPS
0) Before we start, most worksheets have special comments in cells

to help you out. You can recognize the comments by the red, small triangle
in the upper-right hand corner like the one this cell has. Just move your pointer over
the cell to see the comment. To see all the comments, under the "View" menu, select the
"Comments" menu item
1) Click the "model" worksheet tab below and enter your reactions in
the cells provided.
2) Click the "CONTROL" worksheet tab below and click
the "Make Species Spreadsheet from Model"
3) Click the "species" worksheet tab below and edit the initial concentrations, type a "Y" in the
"Display Output ?" column for any species you wish to plot.
4) Click the "parm" worksheet tab and enter your desired simulation time in the DAYS,HOURS,
MINUTES, SECONDS cells
5) Click the "CONTROL" worksheet tab below and click
the "RUN" button. If you do not have a registration key, you will also
have to press the ENTER key three times in the KINTECUS window
(ie, click in the KINTECUS window, press ENTER three times)
6) Click the "Plot Results" button on the CONTROL worksheet. That's it!!
8) OPTIONAL: If you wish to include temperature evolution plots and reverse rate
autocalculations, type -THERM on the Kintecus Switches cell located on the CONTROL
worksheet. See the excel file "Combustion_workbook_OH.xls" as an example!
9) OPTIONAL: If you wish to FIT experimental data to a model, enter your data in the "fitdata"
worksheet, with Time(s) as the first column, first row. The species names should follow the
Time(s) heading on the same row. Place your species/temperature data under the appropriate
species column (if a species is missing data for a time point, place an N in the cell). Append a
question mark, "?", to the end of values you wish for Kintecus to regress/fit. Type the additional
switch "FIT:2:3:FITDATA.TXT" in the KINTECUS SWITCHES cell located on the CONTROL
worksheet. You can also tryFIT:1:3:FITDATA.TXT , -FIT:1:1:FITDATA.TXT and
FIT:2:1:FITDATA.TXT. Run Kintecus. You can see the "Enzyme_Regression_Fitting.xls" file as an
example!!
10) OPTIONAL: If you wish to do sensitivity analysis just use the SENSIT:1 on the command
line.
11) Prefixing the name of a worksheet with an "O_" will cause the entire worksheet to be
written out as a tab-delimited text file. This allows you to save your perturbation files,
databases, periodic tables, chemname files to be store in the Excel workbook.
See the wolfrum or the GRI-MECH Excel workbook for an an example!
12) OPTIONAL: You can calculate uncertainty bands just by adding the -conf switch on the
command line. If you are in Excel, you will automatically see these plotted!
13) There are many other interesting things you can do with your model, so please
be sure to read the Kintecus.pdf documentation!
Kintecus_Plot
2.00E+00
1.80E+00
1.60E+00
Concentration
1.40E+00
1.20E+00
(R)-Sub
(R,R)-Product
(S)-Sub
(R,S)-Product
(S,R)-Product
(S,S)-Product
1.00E+00
8.00E-01
6.00E-01
4.00E-01
2.00E-01
0.00E+00
0.00E+00
1.00E+01 2.00E+01
3.00E+01 4.00E+01
Time(s)
5.00E+01
6.00E+01
7.00E+01
Time(s)
0.00E+00
1.00E-01
2.00E-01
3.00E-01
4.00E-01
5.00E-01
6.00E-01
7.00E-01
8.00E-01
9.00E-01
1.00E+00
1.10E+00
1.20E+00
1.30E+00
1.40E+00
1.50E+00
1.60E+00
1.70E+00
1.80E+00
1.90E+00
2.00E+00
2.10E+00
2.20E+00
2.30E+00
2.40E+00
2.50E+00
2.60E+00
2.70E+00
2.80E+00
2.90E+00
3.00E+00
3.10E+00
3.20E+00
3.30E+00
3.40E+00
3.50E+00
3.60E+00
3.70E+00
3.80E+00
3.90E+00
4.00E+00
4.10E+00
4.20E+00
4.30E+00
4.40E+00
4.50E+00
4.60E+00
4.70E+00
4.80E+00
4.90E+00
(R)-Sub
1.67E+00
9.27E-01
5.25E-01
3.05E-01
1.84E-01
1.17E-01
7.83E-02
5.58E-02
4.21E-02
3.34E-02
2.74E-02
2.31E-02
1.98E-02
1.72E-02
1.51E-02
1.32E-02
1.17E-02
1.03E-02
9.09E-03
8.04E-03
7.11E-03
6.29E-03
5.57E-03
4.93E-03
4.36E-03
3.86E-03
3.41E-03
3.02E-03
2.67E-03
2.37E-03
2.09E-03
1.85E-03
1.64E-03
1.45E-03
1.28E-03
1.14E-03
1.01E-03
8.91E-04
7.88E-04
6.98E-04
6.18E-04
5.47E-04
4.84E-04
4.28E-04
3.79E-04
3.35E-04
2.97E-04
2.63E-04
2.32E-04
2.06E-04
(R,R)-Produ(S)-Sub
0.00E+00 1.67E+00
7.37E-01 1.50E+00
1.15E+00 1.34E+00
1.39E+00 1.19E+00
1.53E+00 1.06E+00
1.61E+00 9.41E-01
1.67E+00 8.34E-01
1.71E+00 7.39E-01
1.74E+00 6.54E-01
1.76E+00 5.79E-01
1.78E+00 5.13E-01
1.79E+00 4.54E-01
1.80E+00 4.02E-01
1.81E+00 3.55E-01
1.82E+00 3.15E-01
1.83E+00 2.78E-01
1.84E+00 2.46E-01
1.85E+00 2.18E-01
1.85E+00 1.93E-01
1.86E+00 1.71E-01
1.86E+00 1.51E-01
1.87E+00 1.34E-01
1.87E+00 1.18E-01
1.87E+00 1.05E-01
1.87E+00 9.28E-02
1.88E+00 8.21E-02
1.88E+00 7.27E-02
1.88E+00 6.43E-02
1.88E+00 5.69E-02
1.88E+00 5.04E-02
1.89E+00 4.46E-02
1.89E+00 3.95E-02
1.89E+00 3.49E-02
1.89E+00 3.09E-02
1.89E+00 2.74E-02
1.89E+00 2.42E-02
1.89E+00 2.14E-02
1.89E+00 1.90E-02
1.89E+00 1.68E-02
1.89E+00 1.49E-02
1.89E+00 1.31E-02
1.89E+00 1.16E-02
1.89E+00 1.03E-02
1.89E+00 9.11E-03
1.89E+00 8.07E-03
1.89E+00 7.14E-03
1.89E+00 6.32E-03
1.89E+00 5.59E-03
1.89E+00 4.95E-03
1.89E+00 4.38E-03
(R,S)-Produ(S,R)-Produ(S,S)-Product
0.00E+00 0.00E+00 0.00E+00
8.56E-03 1.52E-01 5.88E-03
1.34E-02 2.89E-01 1.12E-02
1.61E-02 4.11E-01 1.59E-02
1.77E-02 5.19E-01 2.01E-02
1.87E-02 6.16E-01 2.38E-02
1.94E-02 7.01E-01 2.71E-02
1.98E-02 7.77E-01 3.00E-02
2.02E-02 8.44E-01 3.26E-02
2.04E-02 9.03E-01 3.49E-02
2.06E-02 9.56E-01 3.69E-02
2.08E-02 1.00E+00 3.87E-02
2.09E-02 1.04E+00 4.03E-02
2.11E-02 1.08E+00 4.17E-02
2.12E-02 1.11E+00 4.29E-02
2.13E-02 1.14E+00 4.40E-02
2.14E-02 1.17E+00 4.50E-02
2.14E-02 1.19E+00 4.59E-02
2.15E-02 1.21E+00 4.67E-02
2.15E-02 1.23E+00 4.73E-02
2.16E-02 1.24E+00 4.79E-02
2.16E-02 1.25E+00 4.85E-02
2.17E-02 1.27E+00 4.89E-02
2.17E-02 1.28E+00 4.93E-02
2.18E-02 1.29E+00 4.97E-02
2.18E-02 1.30E+00 5.00E-02
2.18E-02 1.30E+00 5.03E-02
2.18E-02 1.31E+00 5.06E-02
2.18E-02 1.32E+00 5.08E-02
2.19E-02 1.32E+00 5.10E-02
2.19E-02 1.32E+00 5.12E-02
2.19E-02 1.33E+00 5.13E-02
2.19E-02 1.33E+00 5.15E-02
2.19E-02 1.34E+00 5.16E-02
2.19E-02 1.34E+00 5.17E-02
2.19E-02 1.34E+00 5.18E-02
2.19E-02 1.34E+00 5.19E-02
2.19E-02 1.34E+00 5.20E-02
2.20E-02 1.35E+00 5.20E-02
2.20E-02 1.35E+00 5.21E-02
2.20E-02 1.35E+00 5.21E-02
2.20E-02 1.35E+00 5.22E-02
2.20E-02 1.35E+00 5.22E-02
2.20E-02 1.35E+00 5.23E-02
2.20E-02 1.35E+00 5.23E-02
2.20E-02 1.35E+00 5.23E-02
2.20E-02 1.35E+00 5.23E-02
2.20E-02 1.36E+00 5.24E-02
2.20E-02 1.36E+00 5.24E-02
2.20E-02 1.36E+00 5.24E-02
5.00E+00
5.10E+00
5.20E+00
5.30E+00
5.40E+00
5.50E+00
5.60E+00
5.70E+00
5.80E+00
5.90E+00
6.00E+00
6.10E+00
6.20E+00
6.30E+00
6.40E+00
6.50E+00
6.60E+00
6.70E+00
6.80E+00
6.90E+00
7.00E+00
7.10E+00
7.20E+00
7.30E+00
7.40E+00
7.50E+00
7.60E+00
7.70E+00
7.80E+00
7.90E+00
8.00E+00
8.10E+00
8.20E+00
8.30E+00
8.40E+00
8.50E+00
8.60E+00
8.70E+00
8.80E+00
8.90E+00
9.00E+00
9.10E+00
9.20E+00
9.30E+00
9.40E+00
9.50E+00
9.60E+00
9.70E+00
9.80E+00
9.90E+00
1.00E+01
1.82E-04
1.61E-04
1.43E-04
1.26E-04
1.12E-04
9.89E-05
8.75E-05
7.74E-05
6.85E-05
6.07E-05
5.37E-05
4.75E-05
4.20E-05
3.72E-05
3.29E-05
2.92E-05
2.58E-05
2.28E-05
2.02E-05
1.79E-05
1.58E-05
1.40E-05
1.24E-05
1.10E-05
9.71E-06
8.59E-06
7.61E-06
6.73E-06
5.96E-06
5.27E-06
4.67E-06
4.13E-06
3.66E-06
3.24E-06
2.86E-06
2.53E-06
2.24E-06
1.98E-06
1.76E-06
1.55E-06
1.38E-06
1.22E-06
1.08E-06
9.54E-07
8.44E-07
7.47E-07
6.61E-07
5.85E-07
5.18E-07
4.58E-07
4.06E-07
1.89E+00
1.89E+00
1.89E+00
1.89E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
3.88E-03
3.43E-03
3.04E-03
2.69E-03
2.38E-03
2.10E-03
1.86E-03
1.65E-03
1.46E-03
1.29E-03
1.14E-03
1.01E-03
8.95E-04
7.92E-04
7.01E-04
6.21E-04
5.49E-04
4.86E-04
4.30E-04
3.81E-04
3.37E-04
2.98E-04
2.64E-04
2.34E-04
2.07E-04
1.83E-04
1.62E-04
1.43E-04
1.27E-04
1.12E-04
9.93E-05
8.79E-05
7.78E-05
6.89E-05
6.10E-05
5.39E-05
4.77E-05
4.23E-05
3.74E-05
3.31E-05
2.93E-05
2.59E-05
2.29E-05
2.03E-05
1.80E-05
1.59E-05
1.41E-05
1.25E-05
1.10E-05
9.76E-06
8.64E-06
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
5.24E-02
5.24E-02
5.24E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
1.01E+01
1.02E+01
1.03E+01
1.04E+01
1.05E+01
1.06E+01
1.07E+01
1.08E+01
1.09E+01
1.10E+01
1.11E+01
1.12E+01
1.13E+01
1.14E+01
1.15E+01
1.16E+01
1.17E+01
1.18E+01
1.19E+01
1.20E+01
1.21E+01
1.22E+01
1.23E+01
1.24E+01
1.25E+01
1.26E+01
1.27E+01
1.28E+01
1.29E+01
1.30E+01
1.31E+01
1.32E+01
1.33E+01
1.34E+01
1.35E+01
1.36E+01
1.37E+01
1.38E+01
1.39E+01
1.40E+01
1.41E+01
1.42E+01
1.43E+01
1.44E+01
1.45E+01
1.46E+01
1.47E+01
1.48E+01
1.49E+01
1.50E+01
1.51E+01
3.59E-07
3.18E-07
2.81E-07
2.49E-07
2.20E-07
1.95E-07
1.73E-07
1.53E-07
1.35E-07
1.20E-07
1.06E-07
9.37E-08
8.29E-08
7.34E-08
6.50E-08
5.75E-08
5.09E-08
4.50E-08
3.99E-08
3.53E-08
3.12E-08
2.76E-08
2.45E-08
2.16E-08
1.92E-08
1.70E-08
1.50E-08
1.33E-08
1.18E-08
1.04E-08
9.20E-09
8.15E-09
7.21E-09
6.38E-09
5.65E-09
5.00E-09
4.42E-09
3.91E-09
3.46E-09
3.07E-09
2.71E-09
2.40E-09
2.13E-09
1.88E-09
1.66E-09
1.47E-09
1.30E-09
1.15E-09
1.02E-09
9.04E-10
8.00E-10
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
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1.90E+00
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1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
7.64E-06
6.76E-06
5.99E-06
5.30E-06
4.69E-06
4.15E-06
3.67E-06
3.25E-06
2.88E-06
2.55E-06
2.25E-06
1.99E-06
1.77E-06
1.56E-06
1.38E-06
1.22E-06
1.08E-06
9.59E-07
8.48E-07
7.51E-07
6.65E-07
5.88E-07
5.20E-07
4.61E-07
4.08E-07
3.61E-07
3.19E-07
2.83E-07
2.50E-07
2.21E-07
1.96E-07
1.73E-07
1.53E-07
1.36E-07
1.20E-07
1.06E-07
9.42E-08
8.33E-08
7.38E-08
6.53E-08
5.78E-08
5.11E-08
4.52E-08
4.00E-08
3.54E-08
3.14E-08
2.78E-08
2.46E-08
2.17E-08
1.92E-08
1.70E-08
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
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6.77E-33
5.99E-33
5.30E-33
4.69E-33
4.15E-33
3.68E-33
3.25E-33
2.88E-33
2.55E-33
2.26E-33
2.00E-33
1.77E-33
1.56E-33
1.38E-33
1.22E-33
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
3.45E-30
3.05E-30
2.70E-30
2.39E-30
2.12E-30
1.87E-30
1.66E-30
1.47E-30
1.30E-30
1.15E-30
1.02E-30
9.00E-31
7.97E-31
7.05E-31
6.24E-31
5.52E-31
4.89E-31
4.33E-31
3.83E-31
3.39E-31
3.00E-31
2.65E-31
2.35E-31
2.08E-31
1.84E-31
1.63E-31
1.44E-31
1.28E-31
1.13E-31
9.99E-32
8.84E-32
7.82E-32
6.93E-32
6.13E-32
5.42E-32
4.80E-32
4.25E-32
3.76E-32
3.33E-32
2.95E-32
2.61E-32
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
Kintecus Control Spreadsheet Page
James Ianni:
NOTE** Most cells have comments which can be permanently shown on screen (like the one in this cell) by right
clicking the cell and selecting "Show Comment", to hide, right click cell and select "Hide Comment"
Once you click the

Kintecus will Run. T
the ESCAPE key (E
type a Control-C (h
C key) in the Kinte
Kintecus.
Kintecus Registration/Unlocking Key (enter in the cell below)
Kintecus PATH (where Kintecus.exe and your files are located at. ie. C:\KINTECUS\ )
C:\Kintecus\
Kintecus Switches
-show -ig:mass -obeymaxint
I am using the German/Russian version of Excel =
James Ianni:
Once you click the RUN button below,
Kintecus will Run. To stop Kintecus, press
the ESCAPE key (Esc Key) FIRST! THEN
type a Control-C (hold Ctrl key, press the
C key) in the Kintecus Window to halt
Kintecus.
#
#
#
#
#
#
#
Model Description SpreadSheet

This example is taken from M. Kitmura, M. Tokunaga and R, Noyori, JACS, 1993, 115(1),pg144-152
"Quantitative Expression of Dynamic Kinetic Resolution of Chirally Labile Enantiomers:
Stereoselective Hydrogenation of 2-Substituted 3-Oxo Carboxylic Esters Catalyzed
by BINAP-Ruthenium(II) Complexes"
5.86 (R)-Sub ==> (R,R)-Product

0.233 (R)-Sub ==> (S)-Sub
0.233 (S)-Sub ==> (R)-Sub
0.068 (R)-Sub ==> (R,S)-Product
0.963 (S)-Sub ==> (S,R)-Product
0.0372 (S)-Sub ==> (S,S)-Product
# do not remove this END
END
The rate constants for these reactions are from the asymetric
hydrogenation of 2-(methoxycarbonyl) cycloheptanone to the
ester alcohol by catalyzed by BINAP-Ruthenium(II) .
ri, JACS, 1993, 115(1),pg144-152

ly Labile Enantiomers:
Esters Catalyzed
are from the asymetric

cycloheptanone to the
thenium(II) .
#
# Species
#
(R)-Sub
(R,R)-Product
(S)-Sub
(R,S)-Product
(S,R)-Product
(S,S)-Product
END
#
#
#
#
#
#
Species Description Spreadsheet

Residence
Time in CSTR(s)
Initial
Conc.
0
0
0
0
0
0
1.665
0.000
1.665
0.000
0.000
0.000
Display Output
(Y/N) ?
Yes
Yes
Yes
Yes
Yes
Yes
External
Conc.
0
0
0
0
0
0
SSA ?
(Y/N)
No
No
No
No
No
No
Constant File?
(Filename/#/No) Comments
No
No
No
No
No
No
Parameter Description SpreadSheet
#
# See .pdf file for an explanation of each field
#
# Starting Integration Time
Maximum Integration Time
1.00E-06
Ea UNITS (Kcal, KJ,J,CAL,K)
1.00E-01 KCAL
#
#Temperature (K) or Filename
Pressure (Constant ? (Yes/No) ) Volume Profile (Filename/No)
298 NOPE
# Simulation Length:
#
DAYS
Hours
NO
Minutes
0
0
0
#
#hv(filename)
Sampling Interval (s)
Percent(%)
None1
1
0
# THESE FIELDS BELOW (X0) ARE CURRENTLY NOT USED, LEAVE THEM AT 0
# CSTR/PFR inlet Flow
Temperature
X0
X0
0
0
0
#
END
SpreadSheet
X0
Conc. Units(moles/L, moles/cc, molecules/cc)
MOLES/LITER
External Heat Source/Sink # OR Profile (Filename)
X0
OR Condutance:Extern. Temp OR Conductance:Ext.Temp.
No
Seconds
PicoSeconds
60.0
Accuracy
0
X0
1.00E-08
X0
X0
0
(R)-Sub
1.67E+00
9.27E-01
5.25E-01
3.05E-01
1.84E-01
1.17E-01
7.83E-02
5.58E-02
4.21E-02
3.34E-02
2.74E-02
2.31E-02
1.98E-02
1.72E-02
1.51E-02
1.32E-02
1.17E-02
1.03E-02
9.09E-03
8.04E-03
7.11E-03
6.29E-03
5.57E-03
4.93E-03
4.36E-03
3.86E-03
3.41E-03
3.02E-03
2.67E-03
2.37E-03
2.09E-03
1.85E-03
1.64E-03
1.45E-03
1.28E-03
1.14E-03
1.01E-03
8.91E-04
7.88E-04
6.98E-04
6.18E-04
5.47E-04
4.84E-04
4.28E-04
3.79E-04
3.35E-04
2.97E-04
2.63E-04
2.32E-04
(R,R)-Prod (S)-Sub
(R,S)-Produ(S,R)-Product(S,S)-Product
0.00E+00 1.67E+00 0.00E+00
0.00E+00 0.00E+00
7.37E-01 1.50E+00 8.56E-03
1.52E-01 5.88E-03
1.15E+00 1.34E+00 1.34E-02
2.89E-01 1.12E-02
1.39E+00 1.19E+00 1.61E-02
4.11E-01 1.59E-02
1.53E+00 1.06E+00 1.77E-02
5.19E-01 2.01E-02
1.61E+00 9.41E-01 1.87E-02
6.16E-01 2.38E-02
1.67E+00 8.34E-01 1.94E-02
7.01E-01 2.71E-02
1.71E+00 7.39E-01 1.98E-02
7.77E-01 3.00E-02
1.74E+00 6.54E-01 2.02E-02
8.44E-01 3.26E-02
1.76E+00 5.79E-01 2.04E-02
9.03E-01 3.49E-02
1.78E+00 5.13E-01 2.06E-02
9.56E-01 3.69E-02
1.79E+00 4.54E-01 2.08E-02
1.00E+00 3.87E-02
1.80E+00 4.02E-01 2.09E-02
1.04E+00 4.03E-02
1.81E+00 3.55E-01 2.11E-02
1.08E+00 4.17E-02
1.82E+00 3.15E-01 2.12E-02
1.11E+00 4.29E-02
1.83E+00 2.78E-01 2.13E-02
1.14E+00 4.40E-02
1.84E+00 2.46E-01 2.14E-02
1.17E+00 4.50E-02
1.85E+00 2.18E-01 2.14E-02
1.19E+00 4.59E-02
1.85E+00 1.93E-01 2.15E-02
1.21E+00 4.67E-02
1.86E+00 1.71E-01 2.15E-02
1.23E+00 4.73E-02
1.86E+00 1.51E-01 2.16E-02
1.24E+00 4.79E-02
1.87E+00 1.34E-01 2.16E-02
1.25E+00 4.85E-02
1.87E+00 1.18E-01 2.17E-02
1.27E+00 4.89E-02
1.87E+00 1.05E-01 2.17E-02
1.28E+00 4.93E-02
1.87E+00 9.28E-02 2.18E-02
1.29E+00 4.97E-02
1.88E+00 8.21E-02 2.18E-02
1.30E+00 5.00E-02
1.88E+00 7.27E-02 2.18E-02
1.30E+00 5.03E-02
1.88E+00 6.43E-02 2.18E-02
1.31E+00 5.06E-02
1.88E+00 5.69E-02 2.18E-02
1.32E+00 5.08E-02
1.88E+00 5.04E-02 2.19E-02
1.32E+00 5.10E-02
1.89E+00 4.46E-02 2.19E-02
1.32E+00 5.12E-02
1.89E+00 3.95E-02 2.19E-02
1.33E+00 5.13E-02
1.89E+00 3.49E-02 2.19E-02
1.33E+00 5.15E-02
1.89E+00 3.09E-02 2.19E-02
1.34E+00 5.16E-02
1.89E+00 2.74E-02 2.19E-02
1.34E+00 5.17E-02
1.89E+00 2.42E-02 2.19E-02
1.34E+00 5.18E-02
1.89E+00 2.14E-02 2.19E-02
1.34E+00 5.19E-02
1.89E+00 1.90E-02 2.19E-02
1.34E+00 5.20E-02
1.89E+00 1.68E-02 2.20E-02
1.35E+00 5.20E-02
1.89E+00 1.49E-02 2.20E-02
1.35E+00 5.21E-02
1.89E+00 1.31E-02 2.20E-02
1.35E+00 5.21E-02
1.89E+00 1.16E-02 2.20E-02
1.35E+00 5.22E-02
1.89E+00 1.03E-02 2.20E-02
1.35E+00 5.22E-02
1.89E+00 9.11E-03 2.20E-02
1.35E+00 5.23E-02
1.89E+00 8.07E-03 2.20E-02
1.35E+00 5.23E-02
1.89E+00 7.14E-03 2.20E-02
1.35E+00 5.23E-02
1.89E+00 6.32E-03 2.20E-02
1.35E+00 5.23E-02
1.89E+00 5.59E-03 2.20E-02
1.36E+00 5.24E-02
1.89E+00 4.95E-03 2.20E-02
1.36E+00 5.24E-02
120.0%
% (Ee or Diaster. or SEL)
Time(s)
0.00E+00
1.00E-01
2.00E-01
3.00E-01
4.00E-01
5.00E-01
6.00E-01
7.00E-01
8.00E-01
9.00E-01
1.00E+00
1.10E+00
1.20E+00
1.30E+00
1.40E+00
1.50E+00
1.60E+00
1.70E+00
1.80E+00
1.90E+00
2.00E+00
2.10E+00
2.20E+00
2.30E+00
2.40E+00
2.50E+00
2.60E+00
2.70E+00
2.80E+00
2.90E+00
3.00E+00
3.10E+00
3.20E+00
3.30E+00
3.40E+00
3.50E+00
3.60E+00
3.70E+00
3.80E+00
3.90E+00
4.00E+00
4.10E+00
4.20E+00
4.30E+00
4.40E+00
4.50E+00
4.60E+00
4.70E+00
4.80E+00
100.0%
80.0%
60.0%
Ee%(
Ee%(
Ee%(
% Dia
% SE
40.0%
20.0%
0.0%
0.00%
20.00%
40.00%
60.00%
% Conversion
4.90E+00
5.00E+00
5.10E+00
5.20E+00
5.30E+00
5.40E+00
5.50E+00
5.60E+00
5.70E+00
5.80E+00
5.90E+00
6.00E+00
6.10E+00
6.20E+00
6.30E+00
6.40E+00
6.50E+00
6.60E+00
6.70E+00
6.80E+00
6.90E+00
7.00E+00
7.10E+00
7.20E+00
7.30E+00
7.40E+00
7.50E+00
7.60E+00
7.70E+00
7.80E+00
7.90E+00
8.00E+00
8.10E+00
8.20E+00
8.30E+00
8.40E+00
8.50E+00
8.60E+00
8.70E+00
8.80E+00
8.90E+00
9.00E+00
9.10E+00
9.20E+00
9.30E+00
9.40E+00
9.50E+00
9.60E+00
9.70E+00
9.80E+00
9.90E+00
2.06E-04
1.82E-04
1.61E-04
1.43E-04
1.26E-04
1.12E-04
9.89E-05
8.75E-05
7.74E-05
6.85E-05
6.07E-05
5.37E-05
4.75E-05
4.20E-05
3.72E-05
3.29E-05
2.92E-05
2.58E-05
2.28E-05
2.02E-05
1.79E-05
1.58E-05
1.40E-05
1.24E-05
1.10E-05
9.71E-06
8.59E-06
7.61E-06
6.73E-06
5.96E-06
5.27E-06
4.67E-06
4.13E-06
3.66E-06
3.24E-06
2.86E-06
2.53E-06
2.24E-06
1.98E-06
1.76E-06
1.55E-06
1.38E-06
1.22E-06
1.08E-06
9.54E-07
8.44E-07
7.47E-07
6.61E-07
5.85E-07
5.18E-07
4.58E-07
1.89E+00
1.89E+00
1.89E+00
1.89E+00
1.89E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
4.38E-03
3.88E-03
3.43E-03
3.04E-03
2.69E-03
2.38E-03
2.10E-03
1.86E-03
1.65E-03
1.46E-03
1.29E-03
1.14E-03
1.01E-03
8.95E-04
7.92E-04
7.01E-04
6.21E-04
5.49E-04
4.86E-04
4.30E-04
3.81E-04
3.37E-04
2.98E-04
2.64E-04
2.34E-04
2.07E-04
1.83E-04
1.62E-04
1.43E-04
1.27E-04
1.12E-04
9.93E-05
8.79E-05
7.78E-05
6.89E-05
6.10E-05
5.39E-05
4.77E-05
4.23E-05
3.74E-05
3.31E-05
2.93E-05
2.59E-05
2.29E-05
2.03E-05
1.80E-05
1.59E-05
1.41E-05
1.25E-05
1.10E-05
9.76E-06
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
5.24E-02
5.24E-02
5.24E-02
5.24E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
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3.16E-28
2.80E-28
2.48E-28
2.19E-28
1.94E-28
1.72E-28
1.52E-28
1.35E-28
1.19E-28
1.05E-28
9.33E-29
8.26E-29
7.31E-29
6.47E-29
5.72E-29
5.07E-29
4.48E-29
3.97E-29
3.51E-29
3.11E-29
2.75E-29
2.43E-29
2.15E-29
1.91E-29
1.69E-29
1.49E-29
1.32E-29
1.17E-29
1.04E-29
9.16E-30
8.11E-30
7.18E-30
6.35E-30
5.62E-30
4.98E-30
4.40E-30
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.59E+01
5.60E+01
5.61E+01
5.62E+01
5.63E+01
5.64E+01
5.65E+01
5.66E+01
5.67E+01
5.68E+01
5.69E+01
5.70E+01
5.71E+01
5.72E+01
5.73E+01
5.74E+01
5.75E+01
5.76E+01
5.77E+01
5.78E+01
5.79E+01
5.80E+01
5.81E+01
5.82E+01
5.83E+01
5.84E+01
5.85E+01
5.86E+01
5.87E+01
5.88E+01
5.89E+01
5.90E+01
5.91E+01
5.92E+01
5.93E+01
5.94E+01
5.95E+01
5.96E+01
5.97E+01
5.98E+01
5.99E+01
6.00E+01
1.83E-31
1.62E-31
1.43E-31
1.27E-31
1.12E-31
9.94E-32
8.80E-32
7.79E-32
6.89E-32
6.10E-32
5.40E-32
4.78E-32
4.23E-32
3.74E-32
3.31E-32
2.93E-32
2.59E-32
2.30E-32
2.03E-32
1.80E-32
1.59E-32
1.41E-32
1.25E-32
1.10E-32
9.76E-33
8.64E-33
7.65E-33
6.77E-33
5.99E-33
5.30E-33
4.69E-33
4.15E-33
3.68E-33
3.25E-33
2.88E-33
2.55E-33
2.26E-33
2.00E-33
1.77E-33
1.56E-33
1.38E-33
1.22E-33
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
1.90E+00
3.90E-30
3.45E-30
3.05E-30
2.70E-30
2.39E-30
2.12E-30
1.87E-30
1.66E-30
1.47E-30
1.30E-30
1.15E-30
1.02E-30
9.00E-31
7.97E-31
7.05E-31
6.24E-31
5.52E-31
4.89E-31
4.33E-31
3.83E-31
3.39E-31
3.00E-31
2.65E-31
2.35E-31
2.08E-31
1.84E-31
1.63E-31
1.44E-31
1.28E-31
1.13E-31
9.99E-32
8.84E-32
7.82E-32
6.93E-32
6.13E-32
5.42E-32
4.80E-32
4.25E-32
3.76E-32
3.33E-32
2.95E-32
2.61E-32
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
2.20E-02
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
1.36E+00
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
5.25E-02
0.00%
% Conversion
Ee%(S) Ee%(RR) Ee%(SR)
0.00%
0.0%
#DIV/0!
#DIV/0!
27.15%
23.6%
98.4%
89.36%
43.97%
43.7%
98.1%
91.17%
54.97%
59.3%
97.7%
92.46%
62.61%
70.4%
97.4%
93.40%
68.23%
77.9%
97.1%
94.10%
72.60%
82.8%
96.8%
94.62%
76.14%
86.0%
96.5%
95.02%
79.09%
87.9%
96.3%
95.33%
81.61%
89.1%
96.1%
95.58%
83.78%
89.9%
95.9%
95.78%
85.68%
90.3%
95.8%
95.93%
87.34%
90.6%
95.6%
96.07%
88.81%
90.8%
95.5%
96.17%
90.10%
90.9%
95.4%
96.26%
Ee%(S)
91.24%
90.9%
95.3%
96.34%
Ee%(RR)
92.25%
91.0%
95.2%
96.40%
Ee%(SR)
93.14%
91.0%
95.1%
96.46%
93.93%
91.0%
95.1%
96.50%
% Diastereoselectivity
94.63%
91.0%
95.0%
96.54%
% SEL
95.25%
91.0%
95.0%
96.58%
95.79%
91.0%
94.9%
96.61%
96.28%
91.0%
94.9%
96.63%
96.70%
91.0%
94.9%
96.66%
97.08%
91.0%
94.8%
96.67%
97.42%
91.0%
94.8%
96.69%
97.72%
91.0%
94.8%
96.71%
97.98%
91.0%
94.8%
96.72%
98.21%
91.0%
94.7%
96.73%
98.42%
91.0%
94.7%
96.74%
98.60%
91.0%
94.7%
96.75%
98.76%
91.0%
94.7%
96.76%
98.90%
91.0%
94.7%
96.77%
99.03%
91.0%
94.7%
96.77%
99.14%
91.0%
94.7%
96.78%
99.24%
91.0%
94.7%
96.78%
99.33%
91.0%
94.7%
96.79%
99.40%
91.0%
94.7%
96.79%
99.47%
91.0%
94.6%
96.79%
99.53%
91.0%
94.6%
96.79%
99.59%
91.0%
94.6%
96.80%
99.63%
91.0%
94.6%
96.80%
99.68%
91.0%
94.6%
96.80%
99.71%
91.0%
94.6%
96.80%
99.75%
91.0%
94.6%
96.80%
99.78%
91.0%
94.6%
96.81%
99.80%
91.0%
94.6%
96.81%
99.82%
91.0%
94.6%
96.81%
99.84%
91.0%
94.6%
96.81%
40.00%
60.00%
% Conversion
80.00%
% Diastereoselectivity
#DIV/0!
82.2%
79.4%
76.7%
74.2%
72.1%
70.2%
68.6%
67.2%
66.0%
65.0%
64.2%
63.4%
62.8%
62.2%
61.8%
61.4%
61.0%
60.7%
60.4%
60.2%
60.0%
59.8%
59.7%
59.5%
59.4%
59.3%
59.2%
59.1%
59.0%
59.0%
58.9%
58.9%
58.8%
58.8%
58.8%
58.7%
58.7%
58.7%
58.7%
58.6%
58.6%
58.6%
58.6%
58.6%
58.6%
58.6%
58.6%
58.6%
100.00%
P(R/S)
#DIV/0!
4.7149
3.8786
3.2889
2.8646
2.5531
2.3202
2.1428
2.0054
1.8974
1.8111
1.7414
1.6845
1.6374
1.5982
1.5653
1.5375
1.5139
1.4936
1.4763
1.4614
1.4484
1.4372
1.4275
1.4190
1.4116
1.4051
1.3994
1.3945
1.3901
1.3863
1.3829
1.3799
1.3773
1.3750
1.3730
1.3712
1.3696
1.3682
1.3670
1.3659
1.3650
1.3641
1.3634
1.3627
1.3621
1.3616
1.3611
1.3607
% SEL
#DIV/0!
81.6%
78.6%
75.8%
73.3%
71.0%
69.1%
67.4%
66.0%
64.7%
63.7%
62.8%
62.0%
61.4%
60.8%
60.3%
59.9%
59.5%
59.2%
58.9%
58.7%
58.5%
58.3%
58.1%
58.0%
57.9%
57.8%
57.7%
57.6%
57.5%
57.4%
57.4%
57.3%
57.3%
57.2%
57.2%
57.2%
57.1%
57.1%
57.1%
57.1%
57.1%
57.0%
57.0%
57.0%
57.0%
57.0%
57.0%
57.0%
99.86%
99.88%
99.89%
99.90%
99.92%
99.93%
99.93%
99.94%
99.95%
99.95%
99.96%
99.96%
99.97%
99.97%
99.98%
99.98%
99.98%
99.98%
99.98%
99.99%
99.99%
99.99%
99.99%
99.99%
99.99%
99.99%
99.99%
99.99%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
96.81%
96.81%
96.81%
96.81%
96.81%
96.81%
96.81%
96.81%
96.81%
96.81%
96.81%
96.81%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
1.3604
1.3601
1.3598
1.3595
1.3593
1.3591
1.3590
1.3588
1.3587
1.3586
1.3584
1.3584
1.3583
1.3582
1.3581
1.3581
1.3580
1.3580
1.3580
1.3579
1.3579
1.3579
1.3578
1.3578
1.3578
1.3578
1.3578
1.3577
1.3577
1.3577
1.3577
1.3577
1.3577
1.3577
1.3577
1.3577
1.3577
1.3577
1.3577
1.3577
1.3577
1.3577
1.3577
1.3577
1.3577
1.3577
1.3577
1.3576
1.3576
1.3576
1.3576
57.0%
57.0%
57.0%
57.0%
57.0%
57.0%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
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100.00%
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100.00%
100.00%
100.00%
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100.00%
100.00%
100.00%
100.00%
100.00%
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100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
91.0%
91.0%
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91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
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91.0%
91.0%
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91.0%
91.0%
91.0%
94.6%
94.6%
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94.6%
96.82%
96.82%
96.82%
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96.82%
96.82%
96.82%
96.82%
96.82%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
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56.9%
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56.9%
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56.9%
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56.9%
56.9%
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56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
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100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
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91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
94.6%
94.6%
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94.6%
94.6%
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94.6%
94.6%
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94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
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94.6%
94.6%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
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96.82%
96.82%
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96.82%
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96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
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96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
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56.9%
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56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
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56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
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91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
94.6%
94.6%
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94.6%
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94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
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94.6%
94.6%
94.6%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
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96.82%
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96.82%
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96.82%
96.82%
96.82%
96.82%
96.82%
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96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
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56.9%
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56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
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56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
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91.0%
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91.0%
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91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
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94.6%
94.6%
94.6%
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94.6%
94.6%
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94.6%
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94.6%
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94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
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96.82%
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96.82%
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96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
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96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
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91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
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91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
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94.6%
94.6%
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94.6%
94.6%
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94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
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94.6%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
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96.82%
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96.82%
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96.82%
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96.82%
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96.82%
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96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
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96.82%
96.82%
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96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
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94.6%
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94.6%
94.6%
94.6%
94.6%
94.6%
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94.6%
94.6%
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94.6%
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94.6%
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94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
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96.82%
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96.82%
96.82%
96.82%
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96.82%
96.82%
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96.82%
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96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
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91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
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94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
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96.82%
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96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
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96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
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91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
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91.0%
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91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
94.6%
94.6%
94.6%
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94.6%
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94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
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94.6%
94.6%
94.6%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
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96.82%
96.82%
96.82%
96.82%
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96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
100.00%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
91.0%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
94.6%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
96.82%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
58.5%
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
1.3576
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%
56.9%

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RUN YOUR MODEL IN SIX STEPS

0) Before we start, most worksheets have special comments in cells

Kintecus Control Spreadsheet Page

Once you click the

Kintecus Registration/Unlocking Key (enter in the cell below)

I am using the German/Russian version of Excel =

Model Description SpreadSheet

5.86 (R)-Sub ==> (R,R)-Product

ri, JACS, 1993, 115(1),pg144-152

are from the asymetric

Species Description Spreadsheet

Parameter Description SpreadSheet

Maximum Integration Time

Ea UNITS (Kcal, KJ,J,CAL,K)

Pressure (Constant ? (Yes/No) ) Volume Profile (Filename/No)

Conc. Units(moles/L, moles/cc, molecules/cc)

% (Ee or Diaster. or SEL)

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