forked from lijiext/lammps
503 lines
7.9 KiB
Plaintext
503 lines
7.9 KiB
Plaintext
# DATE: 2020-06-21 UNITS: metal CONTRIBUTOR: Aidan Thompson athomps@sandia.gov CITATION: none
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# LAMMPS SNAP coefficients for Quadratic W
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# nelements ncoeff
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1 496
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0.000000000000
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-0.000019342340
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0.000039964908
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-0.000450771142
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-0.000233498664
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-0.000519872659
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-0.000089734174
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-0.000106353291
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-0.000035475344
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-0.000254116041
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-0.000520021242
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0.000065038801
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-0.000304498225
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-0.000032230341
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-0.000007420702
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-0.000159369530
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-0.000144907916
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0.000078858361
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-0.000238070583
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-0.000050556167
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-0.000008662153
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0.000017439967
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-0.000028764863
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0.000022504717
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0.000001821340
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-0.000089967846
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-0.000106392838
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0.000013771852
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0.000070228097
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-0.000024152909
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-0.000006036274
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-4.2551325e-05
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0.0001982986695
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5.4994526e-05
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0.0001760061375
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0.0005287969295
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-0.00045677476
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-0.007136016296
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0.0003868434375
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-0.0006071085215
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-0.000554512177
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-0.0006596292555
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-0.0007585367005
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7.62333015e-05
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0.0002137614635
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0.000379897335
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0.0005441952125
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0.000128413515
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5.74706545e-05
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0.0002303380555
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-0.0005759952885
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-0.0001530888095
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-0.0001614394285
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-3.80386335e-05
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-0.0006390699265
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-2.44191e-05
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-0.000627990564
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-0.000199645294
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-3.63524105e-05
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-0.0004350939225
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-0.000230192872
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-0.000456462716
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-0.00096561205
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-0.0016793622125
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0.008264605054
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0.005768043843
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0.0259523273965
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0.002379667484
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0.001798185681
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0.001411261095
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0.0046629902735
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-0.001249069583
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-0.003518728846
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-0.00152218625
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-0.0005803019955
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-0.002443813614
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0.003302653151
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-0.0035163183225
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0.005378221661
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-0.0005157550285
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0.0005802384085
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-8.4625189e-05
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-0.0003100449505
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0.0016035457395
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-0.006841896086
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0.00327970803
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0.000517873278
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0.000462624598
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0.001556398782
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0.000629663951
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0.004036847861
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0.000410623118
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0.0033671740175
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0.0060744662315
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0.0460285453095
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0.0106979441315
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0.006457375952
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-0.0043000712405
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-0.0196789547465
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-0.009589713549
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-0.0152983426785
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0.003041488452
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-0.0032366707575
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-0.0119067345335
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0.0049313311815
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-0.0030034838505
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8.7700383e-05
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0.0007061505055
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0.0097234329625
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0.007217090323
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0.000235882459
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-0.0033595857445
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-0.0168665065145
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0.017786509719
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0.001877013067
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0.0006351836775
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0.004600906728
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0.012509628713
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-0.003427408333
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-0.0014640751665
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-0.003888408385
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-0.0062058291515
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-0.001642104699
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-0.00105774282
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-0.0059780195505
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-0.001753939287
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0.000479345105
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-0.0019904699045
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4.98541965e-05
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-0.0041212491675
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-0.0042906641465
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-0.002351418317
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-0.0106697325275
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-0.000648222198
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-0.002286882867
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-0.000626754824
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-0.00073748291
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0.0016922435575
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0.0037496719655
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0.004656851048
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-0.0002176673305
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-0.0006739876965
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-0.0006208869175
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7.61738615e-05
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0.0019258401385
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0.005690172208
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0.007318906809
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-0.035200169396
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0.009167226287
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-0.000404285392
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-0.00348855982
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-0.0024229238155
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0.0022336200925
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-0.012584737991
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0.0016262069595
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0.0048016592015
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0.0004657340115
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0.0025051890895
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-0.0104101829395
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0.016176490711
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-0.0094539511845
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-0.002289487018
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-0.0002052188655
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-0.007085549731
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0.02162608233
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-0.002238154953
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0.0190676087705
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0.0002139442795
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0.0010403767345
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0.003360683249
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0.003153376576
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-0.001249764819
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-0.068537163077
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0.0023354667295
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0.001767860664
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-0.0033006265215
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0.0146223252485
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-0.003180595809
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0.0069092040305
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0.0010583439885
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-0.003447267898
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-0.001106713702
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0.00523272471
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-0.010758599437
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-0.001822397317
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0.018487732527
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-0.0024400507145
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-0.007514714512
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-0.003947742615
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0.012413627732
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0.003092235017
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0.018069399047
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-0.0035369320715
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0.0011168541665
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-0.0014980962775
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-1.2944254e-05
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-0.041955689351
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0.0023033776335
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-0.040725631204
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-0.0693632023935
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0.020674975135
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-0.0341006922645
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-0.006059344895
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0.002385437006
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-0.004177512167
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-0.0146544701995
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-0.0008310261785
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-0.010934674355
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0.006492824537
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-0.014812643723
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0.004033748718
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-0.004155996547
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-0.013113411806
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-0.0088014221285
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0.0037541341
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-0.000805304258
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0.006318190602
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0.012552958042
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0.004200553135
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-0.00681355806
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-0.001852228976
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0.0017381476065
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-0.002643779529
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0.0049358851655
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0.001522146164
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0.002260955858
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-0.000839707664
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0.0008487292955
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0.002671028789
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-0.000193952538
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0.003111368392
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0.0007482047125
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0.0020401970905
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0.000530116057
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-0.0022777656015
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-0.0045238154695
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0.0018290760485
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-0.0003309336725
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0.00293571563
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0.000172269209
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0.001414752092
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0.0005614625055
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0.000441310903
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-0.002473120026
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-0.015420836338
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-0.0058494470115
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-0.013440044608
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-0.009774364656
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-0.0019064948385
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-1.70476245e-05
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0.0049669399345
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-0.0050880033155
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0.001600486319
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-0.0018417989075
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-0.0111031210975
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0.0007780738275
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-0.004930202896
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-0.002537539117
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-0.0090246084865
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-0.002694202287
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-0.0062002945005
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0.0031924710865
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0.0021120090085
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-0.003067483203
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-0.0002847253785
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-0.016407568729
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-0.0012875748665
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-0.0136223073595
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-0.00152438356
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0.0012803681485
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-0.002216406572
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-0.001518786423
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-0.004453055438
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-0.0078894618465
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0.001421143537
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-0.0050288776725
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0.001199592632
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-0.002661588749
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-0.004357715347
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0.009525078378
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0.0026286979515
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0.0043289788665
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0.0004994005155
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0.003791227565
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0.0004056536255
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0.0033347889035
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-0.000464347336
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-0.0069517390965
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-0.0079588750315
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-0.004154738239
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0.006620101338
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0.008608842617
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0.0056131740625
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0.0011860229985
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0.007580086232
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0.003260306951
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0.000979553031
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-0.0044626742655
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-0.005235925737
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-0.0161268610495
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-0.0069229581565
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0.003724916317
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0.0023613845
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0.0013633397005
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0.001433661889
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-0.0009859245845
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-0.019516619562
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-0.0051345232355
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-0.0003792145305
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-0.009160883563
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-0.0052408213305
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-0.000837343292
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-0.010077898583
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-0.000297970588
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-0.000858261403
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-0.0001092992995
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-0.002443805024
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-0.0025107490965
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-0.0062944996435
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0.0026546548665
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0.0006955853785
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0.000103592795
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0.000708964143
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0.0019193670325
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-0.0001578612265
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-0.005585721575
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-0.000421551186
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0.0022745774245
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-0.004927140737
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0.0004199419505
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-0.0037407737345
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0.002130170551
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-0.0030979189135
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-0.0019395201255
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0.0067944948975
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-0.000359694345
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-0.0002144026575
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0.0025529098515
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0.0001917158465
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-0.000540725939
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0.001239653721
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0.00159659403
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-5.5652017e-05
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4.5092483e-05
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0.002495602056
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-0.0035351180395
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0.0009665743545
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-0.0023236857675
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-0.0014564171785
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-0.0008165505935
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-0.000118027852
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0.002536872662
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0.0009829535115
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0.0019442113705
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0.000664158062
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0.000326715061
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0.00019900621
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0.0004767582395
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0.000900303081
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-2.91049685e-05
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-0.004411179905
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-0.004064521081
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0.00692497271
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-0.005195674108
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-0.006544598492
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0.0029896960935
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0.000425073164
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-8.0017505e-05
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0.000846844414
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0.003287511416
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-0.009662064447
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0.0014047560985
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-0.0008689313915
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0.0009517570465
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0.000152017235
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1.6514158e-05
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0.00066355894
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0.0067775973265
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0.0021844858475
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0.0056757292145
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0.0054950676515
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0.0002498690125
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-0.006315915302
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-0.0059966827865
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-0.0034483171305
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0.0073702392255
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0.007591193081
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0.0004062066825
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0.000913827769
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0.000622164767
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0.0002438011115
|
|
0.01119218957
|
|
0.010457943327
|
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-0.002352405766
|
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-0.000761350789
|
|
0.000146360756
|
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-0.00052151391
|
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-0.001421163661
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-0.0098259784665
|
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-0.001387664408
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-0.0010876399735
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0.000794093996
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0.003036965154
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-0.0017118732635
|
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-0.0015837318195
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-0.006679253783
|
|
0.000882488727
|
|
0.0093074758655
|
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0.0013319314085
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-0.011547004122
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-0.003864301947
|
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-0.007112747006
|
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-0.00330951085
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-0.0007122545915
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-0.001201815256
|
|
0.0041789351005
|
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-0.0001805522685
|
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-0.0007465084205
|
|
0.008838667361
|
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0.0048153576585
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-9.8403371e-05
|
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-0.010102205467
|
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-0.0090783851625
|
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-0.0014465915755
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0.0056402904815
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0.004713889865
|
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-0.000958685828
|
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0.002844420936
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0.000886932857
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|
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0.000144967791
|
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0.004783753466
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|
0.00091901227
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0.0013117699705
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0.002096120671
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|
0.0008896279815
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8.3058685e-05
|
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0.002360101467
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0.003364314747
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0.0002189774835
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|
0.0020460979
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|
0.001376213073
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|
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|
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|
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|
|
0.0007377551475
|
|
0.001358126396
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-0.000866748663
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0.011124487718
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|
0.005228666165
|
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-0.001490438881
|
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-0.0008813532175
|
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-0.0001303988565
|
|
0.0007163794045
|
|
0.004674505138
|
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-0.000722641184
|
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-0.002023585289
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|
0.001547283689
|
|
0.000753938405
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|
0.000470918236
|
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-0.0003316097225
|
|
-0.0002293860925
|
|
6.90841455e-05
|
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-0.001301344263
|
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-0.0004029179255
|
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6.69084325e-05
|
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-0.000142497889
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0.0002207077485
|
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-0.000201523756
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