mirror of
https://github.com/triqs/dft_tools
synced 2024-08-29 23:33:43 +02:00
![Oleg E. Peil](/assets/img/avatar_default.png)
The calculation of the example was redone to generate LOCPROJ in a new format (valid starting from VASP 5.4.2).
508 lines
18 KiB
Plaintext
508 lines
18 KiB
Plaintext
1 1 0 1
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0.1333597E+02 0.2587511E-09 0.2587511E-09 0.2587511E-09 0.4000000E-15
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1.000000000000000E-004
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CAR
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unknown system
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13.00000000 -2.00000000 501 7.60874112 1.00000000
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-2.000 0.0000E+00 0.6000E+01
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-1.970 0.0000E+00 0.6000E+01
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-1.940 0.0000E+00 0.6000E+01
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-1.910 0.0000E+00 0.6000E+01
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-1.880 0.0000E+00 0.6000E+01
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-1.850 0.0000E+00 0.6000E+01
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-1.820 0.0000E+00 0.6000E+01
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-1.790 0.0000E+00 0.6000E+01
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-1.760 0.0000E+00 0.6000E+01
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-1.730 0.0000E+00 0.6000E+01
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-1.700 0.0000E+00 0.6000E+01
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-1.670 0.0000E+00 0.6000E+01
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-1.640 0.0000E+00 0.6000E+01
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-1.610 0.0000E+00 0.6000E+01
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-1.580 0.0000E+00 0.6000E+01
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-1.550 0.0000E+00 0.6000E+01
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-1.520 0.0000E+00 0.6000E+01
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-1.490 0.0000E+00 0.6000E+01
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-1.460 0.0000E+00 0.6000E+01
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-1.430 0.0000E+00 0.6000E+01
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-1.400 0.0000E+00 0.6000E+01
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-1.370 0.0000E+00 0.6000E+01
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-1.340 0.0000E+00 0.6000E+01
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-1.310 0.0000E+00 0.6000E+01
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-1.280 0.0000E+00 0.6000E+01
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-1.250 0.0000E+00 0.6000E+01
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-1.220 0.0000E+00 0.6000E+01
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-1.190 0.0000E+00 0.6000E+01
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-1.160 0.0000E+00 0.6000E+01
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-1.130 0.0000E+00 0.6000E+01
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-1.100 0.0000E+00 0.6000E+01
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-1.070 0.0000E+00 0.6000E+01
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-1.040 0.0000E+00 0.6000E+01
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-1.010 0.0000E+00 0.6000E+01
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-0.980 0.0000E+00 0.6000E+01
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-0.950 0.0000E+00 0.6000E+01
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-0.920 0.0000E+00 0.6000E+01
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-0.890 0.0000E+00 0.6000E+01
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-0.860 0.0000E+00 0.6000E+01
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-0.830 0.0000E+00 0.6000E+01
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-0.800 0.0000E+00 0.6000E+01
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-0.770 0.0000E+00 0.6000E+01
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-0.740 0.0000E+00 0.6000E+01
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-0.710 0.0000E+00 0.6000E+01
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-0.680 0.0000E+00 0.6000E+01
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-0.650 0.6251E-04 0.6000E+01
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-0.620 0.2552E-03 0.6000E+01
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-0.590 0.5782E-03 0.6000E+01
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-0.560 0.1031E-02 0.6000E+01
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-0.530 0.1615E-02 0.6000E+01
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-0.500 0.2329E-02 0.6000E+01
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-0.470 0.3173E-02 0.6000E+01
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-0.440 0.4147E-02 0.6000E+01
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-0.410 0.5251E-02 0.6000E+01
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-0.380 0.6486E-02 0.6001E+01
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-0.350 0.7851E-02 0.6001E+01
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-0.320 0.9346E-02 0.6001E+01
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-0.290 0.1097E-01 0.6001E+01
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-0.260 0.1273E-01 0.6002E+01
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-0.230 0.1461E-01 0.6002E+01
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-0.200 0.1663E-01 0.6003E+01
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-0.170 0.1878E-01 0.6003E+01
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-0.140 0.2105E-01 0.6004E+01
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-0.110 0.2346E-01 0.6004E+01
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-0.080 0.2600E-01 0.6005E+01
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-0.050 0.2866E-01 0.6006E+01
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-0.020 0.3146E-01 0.6007E+01
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0.010 0.3439E-01 0.6008E+01
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0.040 0.3745E-01 0.6009E+01
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0.070 0.4064E-01 0.6010E+01
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0.100 0.4395E-01 0.6011E+01
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0.130 0.4740E-01 0.6013E+01
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0.160 0.5098E-01 0.6014E+01
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0.190 0.5469E-01 0.6016E+01
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0.220 0.5853E-01 0.6018E+01
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0.250 0.6250E-01 0.6019E+01
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0.280 0.6660E-01 0.6021E+01
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0.310 0.7083E-01 0.6023E+01
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0.340 0.7519E-01 0.6026E+01
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0.370 0.7968E-01 0.6028E+01
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0.400 0.8430E-01 0.6030E+01
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0.430 0.8906E-01 0.6033E+01
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0.460 0.9394E-01 0.6036E+01
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0.490 0.9895E-01 0.6039E+01
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0.520 0.1041E+00 0.6042E+01
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0.550 0.1094E+00 0.6045E+01
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0.580 0.1148E+00 0.6048E+01
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0.610 0.1203E+00 0.6052E+01
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0.640 0.1260E+00 0.6055E+01
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0.670 0.1318E+00 0.6059E+01
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0.700 0.1377E+00 0.6063E+01
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0.730 0.1437E+00 0.6068E+01
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0.760 0.1499E+00 0.6072E+01
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0.790 0.1562E+00 0.6077E+01
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0.820 0.1627E+00 0.6081E+01
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0.850 0.1693E+00 0.6086E+01
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0.880 0.1760E+00 0.6091E+01
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0.910 0.1828E+00 0.6097E+01
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0.940 0.1898E+00 0.6102E+01
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0.970 0.1969E+00 0.6108E+01
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1.000 0.2041E+00 0.6114E+01
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1.030 0.2114E+00 0.6120E+01
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1.060 0.2189E+00 0.6127E+01
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1.090 0.2265E+00 0.6134E+01
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1.120 0.2343E+00 0.6141E+01
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1.150 0.2422E+00 0.6148E+01
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1.180 0.2502E+00 0.6155E+01
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1.210 0.2583E+00 0.6163E+01
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1.240 0.2666E+00 0.6171E+01
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1.270 0.2750E+00 0.6179E+01
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1.300 0.2835E+00 0.6187E+01
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1.330 0.2922E+00 0.6196E+01
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1.360 0.3010E+00 0.6205E+01
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1.390 0.3099E+00 0.6214E+01
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1.420 0.3189E+00 0.6223E+01
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1.450 0.3281E+00 0.6233E+01
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1.480 0.3374E+00 0.6243E+01
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1.510 0.3468E+00 0.6253E+01
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1.540 0.3564E+00 0.6264E+01
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1.570 0.3661E+00 0.6275E+01
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1.600 0.3760E+00 0.6286E+01
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1.630 0.3859E+00 0.6297E+01
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1.660 0.3960E+00 0.6309E+01
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1.690 0.4062E+00 0.6321E+01
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1.720 0.4166E+00 0.6333E+01
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1.750 0.4271E+00 0.6346E+01
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1.780 0.4377E+00 0.6359E+01
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1.810 0.4484E+00 0.6372E+01
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1.840 0.4593E+00 0.6386E+01
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1.870 0.4703E+00 0.6400E+01
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1.900 0.4814E+00 0.6414E+01
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1.930 0.4927E+00 0.6429E+01
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1.960 0.5041E+00 0.6443E+01
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1.990 0.5156E+00 0.6459E+01
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2.020 0.5273E+00 0.6474E+01
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2.050 0.5390E+00 0.6490E+01
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2.080 0.5510E+00 0.6507E+01
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2.110 0.5630E+00 0.6523E+01
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2.140 0.5752E+00 0.6541E+01
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2.170 0.5875E+00 0.6558E+01
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2.200 0.5999E+00 0.6576E+01
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2.230 0.6125E+00 0.6594E+01
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2.260 0.6252E+00 0.6613E+01
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2.290 0.6380E+00 0.6632E+01
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2.320 0.6510E+00 0.6651E+01
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2.350 0.6641E+00 0.6671E+01
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2.380 0.6773E+00 0.6691E+01
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2.410 0.6906E+00 0.6711E+01
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2.440 0.7041E+00 0.6732E+01
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2.470 0.7177E+00 0.6753E+01
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2.500 0.7314E+00 0.6775E+01
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2.530 0.7453E+00 0.6797E+01
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2.560 0.7593E+00 0.6820E+01
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2.590 0.7734E+00 0.6843E+01
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2.620 0.7877E+00 0.6866E+01
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2.650 0.8021E+00 0.6890E+01
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2.680 0.8166E+00 0.6914E+01
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2.710 0.8313E+00 0.6939E+01
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2.740 0.8460E+00 0.6964E+01
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2.770 0.7408E+01 0.7618E+01
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2.800 0.4811E+01 0.7800E+01
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2.830 0.2772E+01 0.7913E+01
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2.860 0.1292E+01 0.7972E+01
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2.890 0.3701E+00 0.7996E+01
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2.920 0.6406E-02 0.8000E+01
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2.950 0.6159E-06 0.8000E+01
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2.980 0.3448E-03 0.8000E+01
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3.010 0.1322E-02 0.8000E+01
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3.040 0.2931E-02 0.8000E+01
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3.070 0.5173E-02 0.8000E+01
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3.100 0.8047E-02 0.8000E+01
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3.130 0.1155E-01 0.8001E+01
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3.160 0.1569E-01 0.8001E+01
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3.190 0.2047E-01 0.8002E+01
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3.220 0.2587E-01 0.8002E+01
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3.250 0.3191E-01 0.8003E+01
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3.280 0.3858E-01 0.8004E+01
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3.310 0.4588E-01 0.8006E+01
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3.340 0.5381E-01 0.8007E+01
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3.370 0.6238E-01 0.8009E+01
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3.400 0.7158E-01 0.8011E+01
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3.430 0.8141E-01 0.8013E+01
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3.460 0.9188E-01 0.8016E+01
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3.490 0.1030E+00 0.8019E+01
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3.520 0.1147E+00 0.8022E+01
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3.550 0.1271E+00 0.8025E+01
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3.580 0.1401E+00 0.8029E+01
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3.610 0.1537E+00 0.8034E+01
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3.640 0.1680E+00 0.8039E+01
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3.670 0.1828E+00 0.8044E+01
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3.700 0.1984E+00 0.8050E+01
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3.730 0.2145E+00 0.8056E+01
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3.760 0.2313E+00 0.8063E+01
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3.790 0.2487E+00 0.8070E+01
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3.820 0.2668E+00 0.8077E+01
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3.850 0.2855E+00 0.8086E+01
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3.880 0.3048E+00 0.8095E+01
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3.910 0.3248E+00 0.8104E+01
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3.940 0.3453E+00 0.8114E+01
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3.970 0.3666E+00 0.8125E+01
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4.000 0.3884E+00 0.8136E+01
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4.030 0.4109E+00 0.8148E+01
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4.060 0.4340E+00 0.8161E+01
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4.090 0.4578E+00 0.8174E+01
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4.120 0.4821E+00 0.8188E+01
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4.150 0.5072E+00 0.8203E+01
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4.180 0.5328E+00 0.8219E+01
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4.210 0.5591E+00 0.8235E+01
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4.240 0.5860E+00 0.8252E+01
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4.270 0.6135E+00 0.8270E+01
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4.300 0.6417E+00 0.8289E+01
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4.330 0.6705E+00 0.8309E+01
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4.360 0.7000E+00 0.8329E+01
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4.390 0.7300E+00 0.8351E+01
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4.420 0.7607E+00 0.8373E+01
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4.450 0.7921E+00 0.8396E+01
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4.480 0.8240E+00 0.8421E+01
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4.510 0.8567E+00 0.8446E+01
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4.540 0.8899E+00 0.8472E+01
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4.570 0.9238E+00 0.8499E+01
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4.600 0.9583E+00 0.8527E+01
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4.630 0.9934E+00 0.8557E+01
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4.660 0.1029E+01 0.8587E+01
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4.690 0.1066E+01 0.8618E+01
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4.720 0.1103E+01 0.8651E+01
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4.750 0.1140E+01 0.8685E+01
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4.780 0.1179E+01 0.8719E+01
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4.810 0.4971E+01 0.8766E+01
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4.840 0.1381E+01 0.9298E+01
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4.870 0.1327E+01 0.9339E+01
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4.900 0.1274E+01 0.9378E+01
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4.930 0.1223E+01 0.9415E+01
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4.960 0.1172E+01 0.9451E+01
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4.990 0.1122E+01 0.9486E+01
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5.020 0.1074E+01 0.9519E+01
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5.050 0.1027E+01 0.9550E+01
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5.080 0.9803E+00 0.9580E+01
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5.110 0.9350E+00 0.9609E+01
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5.140 0.8908E+00 0.9636E+01
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5.170 0.8477E+00 0.9662E+01
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5.200 0.8057E+00 0.9687E+01
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5.230 0.7647E+00 0.9711E+01
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5.260 0.7248E+00 0.9733E+01
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5.290 0.6859E+00 0.9754E+01
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5.320 0.6482E+00 0.9774E+01
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5.350 0.6115E+00 0.9793E+01
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5.380 0.5758E+00 0.9811E+01
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5.410 0.5413E+00 0.9828E+01
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5.440 0.5078E+00 0.9844E+01
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5.470 0.4754E+00 0.9858E+01
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5.500 0.4440E+00 0.9872E+01
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5.530 0.4137E+00 0.9885E+01
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5.560 0.3845E+00 0.9897E+01
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5.590 0.3564E+00 0.9908E+01
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5.620 0.3293E+00 0.9918E+01
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5.650 0.3033E+00 0.9928E+01
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5.680 0.2784E+00 0.9936E+01
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5.710 0.2545E+00 0.9944E+01
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5.740 0.2317E+00 0.9952E+01
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5.770 0.2100E+00 0.9958E+01
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5.800 0.1893E+00 0.9964E+01
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5.830 0.1697E+00 0.9970E+01
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5.860 0.1512E+00 0.9975E+01
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5.890 0.1338E+00 0.9979E+01
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5.920 0.1174E+00 0.9983E+01
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5.950 0.1021E+00 0.9986E+01
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5.980 0.8783E-01 0.9989E+01
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6.010 0.7466E-01 0.9991E+01
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6.040 0.6256E-01 0.9993E+01
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6.070 0.5153E-01 0.9995E+01
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6.100 0.4156E-01 0.9996E+01
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6.130 0.3267E-01 0.9997E+01
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6.160 0.2485E-01 0.9998E+01
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6.190 0.1809E-01 0.9999E+01
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6.220 0.1240E-01 0.9999E+01
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6.250 0.7788E-02 0.1000E+02
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6.280 0.4242E-02 0.1000E+02
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6.310 0.1764E-02 0.1000E+02
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6.340 0.3565E-03 0.1000E+02
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6.370 0.0000E+00 0.1000E+02
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6.400 0.0000E+00 0.1000E+02
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6.430 0.9600E-03 0.1000E+02
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6.460 0.4493E-02 0.1000E+02
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6.490 0.1062E-01 0.1000E+02
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6.520 0.1935E-01 0.1000E+02
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6.550 0.3068E-01 0.1000E+02
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6.580 0.4461E-01 0.1000E+02
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6.610 0.6114E-01 0.1000E+02
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6.640 0.8026E-01 0.1001E+02
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6.670 0.1020E+00 0.1001E+02
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6.700 0.1263E+00 0.1001E+02
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6.730 0.1532E+00 0.1002E+02
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6.760 0.1827E+00 0.1002E+02
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6.790 0.2149E+00 0.1003E+02
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6.820 0.2496E+00 0.1003E+02
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6.850 0.2869E+00 0.1004E+02
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6.880 0.3268E+00 0.1005E+02
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6.910 0.3693E+00 0.1006E+02
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6.940 0.4144E+00 0.1007E+02
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6.970 0.4621E+00 0.1009E+02
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7.000 0.5125E+00 0.1010E+02
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7.030 0.5654E+00 0.1012E+02
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7.060 0.6209E+00 0.1014E+02
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7.090 0.6790E+00 0.1016E+02
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7.120 0.7397E+00 0.1018E+02
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7.150 0.8030E+00 0.1020E+02
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7.180 0.8689E+00 0.1022E+02
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7.210 0.9374E+00 0.1025E+02
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7.240 0.1008E+01 0.1028E+02
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7.270 0.1082E+01 0.1031E+02
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7.300 0.1158E+01 0.1035E+02
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7.330 0.1237E+01 0.1038E+02
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7.360 0.1319E+01 0.1042E+02
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7.390 0.1403E+01 0.1046E+02
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7.420 0.1490E+01 0.1050E+02
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7.450 0.1579E+01 0.1055E+02
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7.480 0.1671E+01 0.1060E+02
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7.510 0.1765E+01 0.1065E+02
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7.540 0.1862E+01 0.1071E+02
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7.570 0.1962E+01 0.1076E+02
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7.600 0.2064E+01 0.1082E+02
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