TABLE
0,1
"EXCEL"
VECTORS
0,203
""
TUPLES
0,155
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DATA
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""
-1,0
BOT
1,0
"Name Data Set: Experimental design for the substrates of haloalkane dehalogenases data set;"
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-1,0
BOT
1,0
"What: 110 properties, 196 compounds;"
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-1,0
BOT
1,0
"Source: Damborsky J., Laboratory of Biomolecular Structure and Dynamics, Masaryk University, Kotlarska 2, 611 37 Brno, Czech Republic, jiri@chemi.muni.cz;"
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1,0
"Iw5 "
1,0
"Iw6 "
1,0
"Iw7 "
1,0
"Iw8 "
1,0
"Cw1 "
1,0
"Cw2 "
1,0
"Cw3 "
1,0
"Cw4 "
1,0
"Cw5 "
1,0
"Cw6 "
1,0
"Cw7 "
1,0
"Cw8 "
1,0
"Emin1"
1,0
"Emin2"
1,0
"Emin3"
1,0
"D12"
1,0
"D13"
1,0
"D23"
1,0
"D1 "
1,0
"D2 "
1,0
"D3 "
1,0
"D4 "
1,0
"D5 "
1,0
"D6 "
1,0
"D7 "
1,0
"D8 "
1,0
"ID1 "
1,0
"ID2 "
1,0
"ID3 "
1,0
"ID4 "
1,0
"ID5 "
1,0
"ID6 "
1,0
"ID7 "
1,0
"ID8 "
1,0
"HL1"
1,0
"HL2"
1,0
"A"
1,0
"CP"
1,0
"POL2"
1,0
"CME"
1,0
"EA"
1,0
"SE"
1,0
"BL"
1,0
"BO"
1,0
"BS"
1,0
"Qx"
1,0
"HOMOx"
1,0
"LUMOx"
1,0
"EFDx"
1,0
"NFDx"
1,0
"RFDx"
1,0
"ESDx"
1,0
"NSDx"
1,0
"RSDx"
1,0
"Qc"
1,0
"HOMOc"
1,0
"LUMOc"
1,0
"EFDc"
1,0
"NFDc"
1,0
"RFDc"
1,0
"ESDc"
1,0
"NSDc"
1,0
"RSDc"
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
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1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
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1,0
""
1,0
""
1,0
""
1,0
""
1,0
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1,0
""
1,0
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1,0
""
1,0
""
1,0
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1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,1
V
1,0
"1-chloromethane"
0,50.488
V
0,-24
V
0,1.339
V
0,0.916
V
0,1.09
V
0,0.3354
V
0,0.7031
V
0,50
V
0,37
V
0,0.56
V
0,6.08
V
0,6.08
V
0,11.55
V
0,1.07
V
0,1.07
V
0,55
V
0,0.88
V
0,0.94
V
0,11.31
V
0,1.48
V
0,2.00
V
0,3.02
V
0,16
V
0,3.3
V
0,65
V
0,3.42
V
0,-543.5
V
0,-18.95
V
0,1.6010
V
0,-11.3369
V
0,1.510
V
0,-1.456
V
0,-1.344
V
0,-3.456
V
0,-0.677
V
0,-2.113
V
0,-1.428
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.408
V
0,-0.579
V
0,-0.746
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-1.729
V
0,-1.210
V
0,-0.509
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.734
V
0,-0.727
V
0,-0.720
V
0,0.832
V
0,-0.670
V
0,0.459
V
0,-0.609
V
0,0.114
V
0,0.518
V
0,1.403
V
0,1.443
V
0,-0.597
V
0,-0.663
V
0,-0.447
V
0,-0.347
V
0,0.595
V
0,0.687
V
0,0.467
V
0,-1.313
V
0,-0.183
V
0,-0.980
V
0,-0.736
V
0,-0.381
V
0,-0.392
V
0,-0.929
V
0,-0.262
V
0,-1.552
V
0,0.118
V
0,-1.598
V
0,0.118
V
0,1.741
V
0,0.987
V
0,0.001
V
0,-0.117
V
0,0.757
V
0,0.430
V
0,1.515
V
0,0.858
V
0,1.186
V
0,1.260
V
0,0.241
V
0,0.218
V
0,-0.177
V
0,0.096
V
0,0.555
V
0,0.192
V
0,1.109
V
0,0.650
V
0,0.533
V
0,0.738
V
0,0.205
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
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1,0
""
1,0
""
1,0
""
1,0
""
1,0
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1,0
""
1,0
""
1,0
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1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,2
V
1,0
"1-chloroethane"
0,64.514
V
0,12
V
0,1.368
V
0,0.898
V
0,1.58
V
0,0.0906
V
0,0.2015
V
0,65
V
0,50
V
0,2.64
V
0,15.07
V
0,16.61
V
0,9.35
V
0,1.64
V
0,1.49
V
0,96
V
0,1.22
V
0,0.98
V
0,16.06
V
0,2.51
V
0,3.25
V
0,4.02
V
0,58
V
0,4.8
V
0,85
V
0,5.75
V
0,-699.3
V
0,-26.16
V
0,1.4981
V
0,-11.1526
V
0,1.692
V
0,-1.065
V
0,-1.055
V
0,-1.481
V
0,-1.033
V
0,-1.728
V
0,-1.294
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.548
V
0,-0.458
V
0,-0.746
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-1.370
V
0,-1.062
V
0,-0.509
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.660
V
0,-0.660
V
0,-0.658
V
0,1.124
V
0,1.183
V
0,-1.026
V
0,-0.808
V
0,-1.148
V
0,-0.980
V
0,-1.298
V
0,-0.991
V
0,-0.857
V
0,-0.663
V
0,-0.447
V
0,-0.569
V
0,-0.507
V
0,-0.258
V
0,0.454
V
0,-0.782
V
0,-1.211
V
0,-0.980
V
0,-0.736
V
0,-0.381
V
0,-0.392
V
0,-1.034
V
0,-0.262
V
0,-1.181
V
0,1.019
V
0,-1.498
V
0,1.019
V
0,1.758
V
0,0.967
V
0,0.003
V
0,-0.129
V
0,0.648
V
0,0.417
V
0,1.378
V
0,0.831
V
0,1.105
V
0,1.298
V
0,0.243
V
0,0.222
V
0,-0.113
V
0,0.118
V
0,0.534
V
0,0.204
V
0,1.066
V
0,0.635
V
0,0.529
V
0,0.756
V
0,0.206
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,3
V
1,0
"1-chloropropane"
0,78.541
V
0,46
V
0,1.388
V
0,0.892
V
0,2.07
V
0,0.0245
V
0,0.0581
V
0,79
V
0,63
V
0,3.28
V
0,34.57
V
0,36.19
V
0,16.31
V
0,1.55
V
0,1.48
V
0,157
V
0,1.69
V
0,0.82
V
0,20.58
V
0,3.53
V
0,4.50
V
0,4.75
V
0,136
V
0,6.3
V
0,104
V
0,8.03
V
0,-855.2
V
0,-33.00
V
0,1.5161
V
0,-11.1363
V
0,1.726
V
0,-0.700
V
0,-0.650
V
0,-1.077
V
0,-0.452
V
0,-1.315
V
0,-1.168
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.461
V
0,-0.395
V
0,-0.746
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-1.231
V
0,-0.971
V
0,-0.509
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.645
V
0,-0.632
V
0,-0.662
V
0,1.197
V
0,0.592
V
0,0.664
V
0,-0.507
V
0,-0.862
V
0,-0.668
V
0,-1.054
V
0,-1.133
V
0,-0.857
V
0,-0.663
V
0,-0.447
V
0,-0.292
V
0,-0.472
V
0,0.052
V
0,0.435
V
0,-0.353
V
0,-1.211
V
0,-0.980
V
0,-0.736
V
0,-0.381
V
0,-0.392
V
0,-1.126
V
0,-0.262
V
0,-0.810
V
0,1.681
V
0,-1.518
V
0,1.681
V
0,1.757
V
0,0.969
V
0,0.004
V
0,-0.127
V
0,0.603
V
0,0.418
V
0,1.217
V
0,0.830
V
0,1.023
V
0,1.296
V
0,0.242
V
0,0.222
V
0,-0.114
V
0,0.120
V
0,0.533
V
0,0.208
V
0,1.061
V
0,0.634
V
0,0.541
V
0,0.755
V
0,0.207
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,4
V
1,0
"1-chlorobutane"
0,92.568
V
0,78
V
0,1.402
V
0,0.886
V
0,2.56
V
0,0.0066
V
0,0.0166
V
0,93
V
0,76
V
0,4.96
V
0,62.22
V
0,64.98
V
0,20.36
V
0,1.62
V
0,1.56
V
0,216
V
0,2.09
V
0,0.79
V
0,25.19
V
0,4.54
V
0,5.75
V
0,5.30
V
0,259
V
0,7.8
V
0,123
V
0,10.36
V
0,-1011.0
V
0,-39.82
V
0,1.5096
V
0,-11.1335
V
0,1.743
V
0,-0.318
V
0,-0.300
V
0,-0.268
V
0,-0.233
V
0,-0.973
V
0,-0.979
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
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V
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V
0,-0.311
V
0,-0.509
V
0,-0.470
V
0,-0.746
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-1.167
V
0,-0.837
V
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V
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V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.612
V
0,-0.609
V
0,-0.591
V
0,1.131
V
0,-1.032
V
0,1.279
V
0,-0.241
V
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V
0,-0.404
V
0,-0.855
V
0,-0.707
V
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V
0,-0.663
V
0,-0.447
V
0,-0.401
V
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V
0,0.024
V
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V
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V
0,0.849
V
0,-0.980
V
0,-0.736
V
0,-0.381
V
0,-0.392
V
0,0.256
V
0,-0.262
V
0,-0.440
V
0,2.330
V
0,-1.512
V
0,2.330
V
0,1.757
V
0,0.969
V
0,0.003
V
0,-0.127
V
0,0.597
V
0,0.417
V
0,1.077
V
0,0.827
V
0,0.952
V
0,1.296
V
0,0.242
V
0,0.222
V
0,-0.114
V
0,0.119
V
0,0.529
V
0,0.179
V
0,1.053
V
0,0.616
V
0,0.540
V
0,0.755
V
0,0.207
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,5
V
1,0
"1-chloropentane"
0,106.595
V
0,107
V
0,1.412
V
0,0.882
V
0,3.05
V
0,0.0018
V
0,0.0048
V
0,107
V
0,89
V
0,5.67
V
0,103.47
V
0,106.39
V
0,29.34
V
0,1.61
V
0,1.56
V
0,309
V
0,2.49
V
0,0.72
V
0,29.79
V
0,5.55
V
0,7.00
V
0,5.73
V
0,436
V
0,9.3
V
0,134
V
0,12.68
V
0,-1166.8
V
0,-46.67
V
0,1.5094
V
0,-11.1334
V
0,1.763
V
0,0.049
V
0,0.087
V
0,0.036
V
0,0.235
V
0,-0.597
V
0,-0.806
V
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V
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V
0,-0.430
V
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V
0,-0.533
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V
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V
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V
0,-0.950
V
0,1.191
V
0,1.310
V
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V
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V
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V
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V
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V
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V
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V
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V
0,-0.980
V
0,-0.736
V
0,-0.381
V
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V
0,0.337
V
0,-0.262
V
0,-0.069
V
0,2.978
V
0,-1.512
V
0,2.978
V
0,1.761
V
0,0.968
V
0,0.003
V
0,-0.127
V
0,0.598
V
0,0.416
V
0,0.935
V
0,0.825
V
0,0.880
V
0,1.296
V
0,0.242
V
0,0.222
V
0,-0.114
V
0,0.119
V
0,0.529
V
0,0.160
V
0,1.051
V
0,0.606
V
0,0.540
V
0,0.755
V
0,0.207
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,6
V
1,0
"1-chlorohexane"
0,120.622
V
0,133
V
0,1.420
V
0,0.879
V
0,3.54
V
0,4.83E-04 
V
0,1.38E-03 
V
0,121
V
0,102
V
0,7.18
V
0,157.06
V
0,160.94
V
0,35.08
V
0,1.60
V
0,1.57
V
0,369
V
0,2.88
V
0,0.70
V
0,34.39
V
0,6.55
V
0,8.25
V
0,6.08
V
0,676
V
0,10.8
V
0,160
V
0,15.02
V
0,-1322.7
V
0,-53.51
V
0,1.5069
V
0,-11.1334
V
0,1.771
V
0,0.430
V
0,0.398
V
0,0.805
V
0,0.322
V
0,-0.233
V
0,-0.639
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.544
V
0,-0.535
V
0,-0.746
V
0,-0.533
V
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V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-0.991
V
0,-0.670
V
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V
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V
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V
0,-0.451
V
0,-0.401
V
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V
0,-0.587
V
0,-0.584
V
0,-0.586
V
0,1.097
V
0,-0.601
V
0,1.369
V
0,0.304
V
0,-0.095
V
0,0.166
V
0,-0.312
V
0,-0.362
V
0,-0.337
V
0,-0.663
V
0,-0.447
V
0,-0.405
V
0,-0.526
V
0,-0.042
V
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V
0,-0.888
V
0,-0.626
V
0,-0.980
V
0,-0.736
V
0,-0.381
V
0,-0.392
V
0,0.660
V
0,-0.262
V
0,0.301
V
0,3.619
V
0,-1.511
V
0,3.619
V
0,1.756
V
0,0.969
V
0,0.004
V
0,-0.127
V
0,0.599
V
0,0.416
V
0,0.806
V
0,0.824
V
0,0.815
V
0,1.296
V
0,0.242
V
0,0.222
V
0,-0.114
V
0,0.120
V
0,0.528
V
0,0.139
V
0,1.049
V
0,0.594
V
0,0.540
V
0,0.755
V
0,0.207
V
1,0
""
1,0
""
1,0
""
1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,7
V
1,0
"1-chloroheptane"
0,134.649
V
0,160
V
0,1.425
V
0,0.881
V
0,4.03
V
0,1.30E-04 
V
0,3.96E-04 
V
0,135
V
0,115
V
0,7.94
V
0,227.51
V
0,231.61
V
0,46.12
V
0,1.61
V
0,1.58
V
0,492
V
0,3.28
V
0,0.63
V
0,38.99
V
0,7.55
V
0,9.50
V
0,6.37
V
0,988
V
0,12.3
V
0,175
V
0,17.36
V
0,-1478.5
V
0,-60.36
V
0,1.5066
V
0,-11.1330
V
0,1.780
V
0,0.769
V
0,0.815
V
0,0.631
V
0,0.989
V
0,0.152
V
0,-0.519
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.506
V
0,-0.513
V
0,-0.746
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-0.985
V
0,-0.654
V
0,-0.509
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
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V
0,-0.610
V
0,-0.597
V
0,-0.577
V
0,-1.100
V
0,-0.955
V
0,-1.195
V
0,0.594
V
0,0.088
V
0,0.507
V
0,0.042
V
0,-1.072
V
0,-0.857
V
0,-0.663
V
0,-0.447
V
0,-0.154
V
0,-0.234
V
0,0.287
V
0,-0.496
V
0,0.806
V
0,-1.211
V
0,-0.980
V
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V
0,-0.381
V
0,-0.392
V
0,0.129
V
0,-0.262
V
0,0.672
V
0,4.259
V
0,-1.510
V
0,4.259
V
0,1.757
V
0,0.969
V
0,0.004
V
0,-0.127
V
0,0.597
V
0,0.416
V
0,0.700
V
0,0.823
V
0,0.761
V
0,1.296
V
0,0.242
V
0,0.222
V
0,-0.114
V
0,0.119
V
0,0.528
V
0,0.122
V
0,1.048
V
0,0.585
V
0,0.540
V
0,0.755
V
0,0.207
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
""
1,0
""
1,0
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1,0
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1,0
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1,0
""
1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,8
V
1,0
"1-chlorooctane"
0,148.675
V
0,183
V
0,1.430
V
0,0.875
V
0,4.52
V
0,3.52E-05 
V
0,1.14E-04 
V
0,149
V
0,128
V
0,9.37
V
0,314.29
V
0,319.26
V
0,53.25
V
0,1.59
V
0,1.56
V
0,553
V
0,3.67
V
0,0.62
V
0,43.59
V
0,8.56
V
0,10.75
V
0,6.61
V
0,1381
V
0,13.8
V
0,196
V
0,19.70
V
0,-1634.3
V
0,-67.20
V
0,1.5065
V
0,-11.1329
V
0,1.782
V
0,1.134
V
0,1.217
V
0,0.699
V
0,1.488
V
0,0.492
V
0,-0.348
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.497
V
0,-0.516
V
0,-0.746
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-1.016
V
0,-0.606
V
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V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
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V
0,-0.611
V
0,-0.596
V
0,-0.574
V
0,-1.100
V
0,-0.955
V
0,-1.195
V
0,0.861
V
0,0.331
V
0,0.847
V
0,0.274
V
0,-1.052
V
0,-0.792
V
0,-0.663
V
0,-0.447
V
0,-0.081
V
0,-0.121
V
0,0.316
V
0,-0.425
V
0,0.963
V
0,1.898
V
0,-0.980
V
0,-0.736
V
0,-0.381
V
0,-0.392
V
0,0.503
V
0,-0.262
V
0,1.043
V
0,4.899
V
0,-1.510
V
0,4.899
V
0,1.755
V
0,0.969
V
0,0.004
V
0,-0.126
V
0,0.589
V
0,0.416
V
0,0.608
V
0,0.822
V
0,0.715
V
0,1.296
V
0,0.242
V
0,0.222
V
0,-0.114
V
0,0.118
V
0,0.528
V
0,0.106
V
0,1.046
V
0,0.576
V
0,0.540
V
0,0.755
V
0,0.207
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,9
V
1,0
"1-chlorononane"
0,162.702
V
0,203
V
0,1.436
V
0,0.870
V
0,5.02
V
0,9.26E-06 
V
0,3.26E-05 
V
0,163
V
0,141
V
0,10.16
V
0,421.36
V
0,426.57
V
0,66.38
V
0,1.60
V
0,1.58
V
0,704
V
0,4.07
V
0,0.54
V
0,48.19
V
0,9.56
V
0,12.00
V
0,6.82
V
0,1864
V
0,15.3
V
0,213
V
0,22.05
V
0,-1790.2
V
0,-74.05
V
0,1.5058
V
0,-11.1326
V
0,1.789
V
0,1.511
V
0,1.568
V
0,1.046
V
0,1.748
V
0,0.867
V
0,-0.181
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.509
V
0,-0.532
V
0,-0.746
V
0,-0.533
V
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V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-0.957
V
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V
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V
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V
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V
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V
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V
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V
0,-0.610
V
0,-0.596
V
0,-0.574
V
0,1.197
V
0,-1.241
V
0,1.398
V
0,1.160
V
0,0.614
V
0,1.112
V
0,0.573
V
0,-1.052
V
0,-0.792
V
0,-0.663
V
0,-0.447
V
0,-0.076
V
0,-0.163
V
0,0.407
V
0,-0.452
V
0,1.546
V
0,-0.024
V
0,-0.980
V
0,-0.736
V
0,-0.381
V
0,-0.392
V
0,0.803
V
0,-0.262
V
0,1.413
V
0,5.541
V
0,-1.506
V
0,5.541
V
0,1.756
V
0,0.969
V
0,0.003
V
0,-0.126
V
0,0.583
V
0,0.416
V
0,0.538
V
0,0.821
V
0,0.680
V
0,1.296
V
0,0.242
V
0,0.222
V
0,-0.114
V
0,0.117
V
0,0.528
V
0,0.095
V
0,1.045
V
0,0.570
V
0,0.541
V
0,0.755
V
0,0.207
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,10
V
1,0
"1-chlorodecane"
0,176.729
V
0,223
V
0,1.436
V
0,0.868
V
0,5.51
V
0,2.50E-06 
V
0,9.39E-06 
V
0,177
V
0,154
V
0,11.51
V
0,548.57
V
0,554.59
V
0,74.80
V
0,1.57
V
0,1.55
V
0,764
V
0,4.47
V
0,0.54
V
0,52.79
V
0,10.56
V
0,13.25
V
0,7.00
V
0,2446
V
0,16.8
V
0,236
V
0,24.39
V
0,-1946.0
V
0,-80.89
V
0,1.5054
V
0,-11.1328
V
0,1.789
V
0,1.884
V
0,2.024
V
0,0.886
V
0,2.387
V
0,1.248
V
0,-0.019
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.557
V
0,-0.571
V
0,-0.746
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-0.993
V
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V
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V
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V
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V
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V
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V
0,-0.312
V
0,-0.604
V
0,-0.591
V
0,-0.577
V
0,-0.446
V
0,1.536
V
0,2.140
V
0,1.441
V
0,0.881
V
0,1.464
V
0,0.872
V
0,-0.950
V
0,-0.759
V
0,-0.663
V
0,-0.447
V
0,-0.231
V
0,-0.364
V
0,0.163
V
0,-0.591
V
0,-0.904
V
0,2.610
V
0,-0.980
V
0,-0.736
V
0,-0.381
V
0,-0.392
V
0,1.171
V
0,-0.262
V
0,1.784
V
0,6.186
V
0,-1.506
V
0,6.186
V
0,1.756
V
0,0.969
V
0,0.003
V
0,-0.126
V
0,0.568
V
0,0.416
V
0,0.478
V
0,0.820
V
0,0.649
V
0,1.296
V
0,0.242
V
0,0.222
V
0,-0.114
V
0,0.114
V
0,0.528
V
0,0.084
V
0,1.044
V
0,0.564
V
0,0.540
V
0,0.755
V
0,0.207
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,11
V
1,0
"1-chlorododecane"
0,204.783
V
0,260
V
0,1.443
V
0,0.867
V
0,6.49
V
0,1.83E-07 
V
0,7.76E-07 
V
0,205
V
0,180
V
0,13.66
V
0,874.38
V
0,881.40
V
0,100.05
V
0,1.56
V
0,1.55
V
0,1016
V
0,5.26
V
0,0.48
V
0,61.99
V
0,12.56
V
0,15.75
V
0,7.29
V
0,3943
V
0,19.8
V
0,274
V
0,29.08
V
0,-2257.7
V
0,-94.58
V
0,1.5053
V
0,-11.1024
V
0,1.793
V
0,2.672
V
0,2.719
V
0,1.607
V
0,2.767
V
0,1.982
V
0,0.360
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.621
V
0,-0.652
V
0,-0.746
V
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BOT
0,12
V
1,0
"1-chlorotetradecane"
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BOT
0,13
V
1,0
"1-chlorohexadecane"
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BOT
0,14
V
1,0
"1-chlorooctadecane"
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0,4.36E-10 
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BOT
0,15
V
1,0
"1-bromomethane"
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BOT
0,16
V
1,0
"1-bromoethane"
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0,39
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1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,17
V
1,0
"1-bromopropane"
0,122.992
V
0,71
V
0,1.434
V
0,1.354
V
0,2.16
V
0,0.0192
V
0,0.0361
V
0,123
V
0,68
V
0,3.31
V
0,50.86
V
0,52.52
V
0,23.93
V
0,1.56
V
0,1.51
V
0,235
V
0,1.76
V
0,1.04
V
0,23.57
V
0,3.90
V
0,4.50
V
0,4.75
V
0,136
V
0,6.1
V
0,105
V
0,8.41
V
0,-834.6
V
0,-19.93
V
0,0.8346
V
0,-10.6894
V
0,1.703
V
0,-0.577
V
0,-0.658
V
0,0.123
V
0,-1.016
V
0,-1.022
V
0,-0.935
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.301
V
0,-0.381
V
0,-0.746
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-0.663
V
0,-0.725
V
0,-0.509
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.585
V
0,-0.575
V
0,-0.577
V
0,1.124
V
0,-1.241
V
0,1.362
V
0,-0.363
V
0,-0.277
V
0,-0.768
V
0,-0.733
V
0,-0.707
V
0,-0.824
V
0,-0.613
V
0,-0.447
V
0,-0.017
V
0,0.311
V
0,-0.045
V
0,-0.135
V
0,-0.509
V
0,1.892
V
0,0.910
V
0,-0.736
V
0,-0.381
V
0,-0.392
V
0,-0.311
V
0,-0.262
V
0,-0.669
V
0,1.788
V
0,-0.834
V
0,1.788
V
0,1.930
V
0,0.978
V
0,0.008
V
0,-0.053
V
0,0.822
V
0,0.466
V
0,1.645
V
0,0.931
V
0,1.288
V
0,1.621
V
0,0.330
V
0,0.255
V
0,-0.215
V
0,0.066
V
0,0.502
V
0,0.112
V
0,1.004
V
0,0.558
V
0,0.579
V
0,0.802
V
0,0.213
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,18
V
1,0
"1-bromobutane"
0,137.019
V
0,103
V
0,1.439
V
0,1.276
V
0,2.65
V
0,0.0052
V
0,0.0104
V
0,137
V
0,81
V
0,5.18
V
0,91.09
V
0,94.07
V
0,29.56
V
0,1.68
V
0,1.63
V
0,338
V
0,2.15
V
0,1.04
V
0,28.17
V
0,4.91
V
0,5.75
V
0,5.30
V
0,259
V
0,7.6
V
0,123
V
0,10.74
V
0,-990.4
V
0,-26.77
V
0,0.8303
V
0,-10.6880
V
0,1.720
V
0,-0.201
V
0,-0.280
V
0,0.550
V
0,-0.579
V
0,-0.657
V
0,-0.776
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.394
V
0,-0.418
V
0,-0.746
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-0.667
V
0,-0.652
V
0,-0.509
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.571
V
0,-0.557
V
0,-0.557
V
0,1.124
V
0,1.176
V
0,-0.836
V
0,-0.100
V
0,-0.036
V
0,-0.468
V
0,-0.456
V
0,-0.585
V
0,-0.662
V
0,-0.613
V
0,-0.447
V
0,-0.167
V
0,0.131
V
0,-0.180
V
0,-0.312
V
0,-0.620
V
0,-0.013
V
0,0.963
V
0,-0.736
V
0,-0.381
V
0,-0.392
V
0,0.000
V
0,-0.262
V
0,-0.299
V
0,2.426
V
0,-0.829
V
0,2.426
V
0,1.927
V
0,0.978
V
0,0.007
V
0,-0.052
V
0,0.822
V
0,0.466
V
0,1.581
V
0,0.931
V
0,1.256
V
0,1.622
V
0,0.331
V
0,0.255
V
0,-0.215
V
0,0.066
V
0,0.500
V
0,0.108
V
0,1.000
V
0,0.554
V
0,0.578
V
0,0.801
V
0,0.213
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,19
V
1,0
"1-bromopentane"
0,151.046
V
0,130
V
0,1.444
V
0,1.218
V
0,3.14
V
0,0.0014
V
0,0.0030
V
0,151
V
0,93
V
0,5.81
V
0,150.53
V
0,153.60
V
0,42.90
V
0,1.66
V
0,1.62
V
0,483
V
0,2.55
V
0,0.99
V
0,32.77
V
0,5.92
V
0,7.00
V
0,5.73
V
0,436
V
0,9.1
V
0,137
V
0,13.06
V
0,-1146.3
V
0,-33.62
V
0,0.8286
V
0,-10.6881
V
0,1.742
V
0,0.176
V
0,0.137
V
0,0.640
V
0,0.020
V
0,-0.289
V
0,-0.611
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.343
V
0,-0.367
V
0,-0.746
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-0.723
V
0,-0.598
V
0,-0.509
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.566
V
0,-0.551
V
0,-0.539
V
0,1.131
V
0,1.176
V
0,-1.026
V
0,0.187
V
0,0.234
V
0,-0.210
V
0,-0.191
V
0,-0.463
V
0,-0.629
V
0,-0.613
V
0,-0.447
V
0,0.087
V
0,0.466
V
0,0.197
V
0,-0.006
V
0,-0.157
V
0,-0.645
V
0,1.076
V
0,-0.736
V
0,-0.381
V
0,-0.392
V
0,0.111
V
0,-0.262
V
0,0.072
V
0,3.068
V
0,-0.827
V
0,3.068
V
0,1.929
V
0,0.978
V
0,0.008
V
0,-0.052
V
0,0.822
V
0,0.466
V
0,1.516
V
0,0.930
V
0,1.223
V
0,1.622
V
0,0.331
V
0,0.255
V
0,-0.214
V
0,0.066
V
0,0.500
V
0,0.104
V
0,1.000
V
0,0.552
V
0,0.578
V
0,0.802
V
0,0.213
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,20
V
1,0
"1-bromohexane"
0,165.073
V
0,156
V
0,1.448
V
0,1.176
V
0,3.63
V
0,3.79E-04 
V
0,8.54E-04 
V
0,165
V
0,106
V
0,7.56
V
0,226.42
V
0,230.67
V
0,50.72
V
0,1.69
V
0,1.66
V
0,597
V
0,2.94
V
0,0.99
V
0,37.37
V
0,6.92
V
0,8.25
V
0,6.08
V
0,676
V
0,10.6
V
0,161
V
0,15.40
V
0,-1302.1
V
0,-40.45
V
0,0.8249
V
0,-10.6880
V
0,1.751
V
0,0.517
V
0,0.562
V
0,0.429
V
0,0.741
V
0,0.062
V
0,-0.485
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.398
V
0,-0.410
V
0,-0.746
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-0.801
V
0,-0.586
V
0,-0.509
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.581
V
0,-0.584
V
0,-0.572
V
0,-0.700
V
0,-0.646
V
0,-0.221
V
0,0.470
V
0,0.439
V
0,0.019
V
0,0.020
V
0,-0.869
V
0,-0.792
V
0,-0.663
V
0,-0.447
V
0,-0.071
V
0,0.282
V
0,-0.137
V
0,-0.275
V
0,0.918
V
0,0.468
V
0,-0.980
V
0,-0.736
V
0,-0.381
V
0,-0.392
V
0,-0.043
V
0,-0.262
V
0,0.442
V
0,3.707
V
0,-0.824
V
0,3.707
V
0,1.927
V
0,0.978
V
0,0.007
V
0,-0.052
V
0,0.821
V
0,0.466
V
0,1.442
V
0,0.930
V
0,1.186
V
0,1.622
V
0,0.331
V
0,0.255
V
0,-0.215
V
0,0.066
V
0,0.500
V
0,0.101
V
0,0.999
V
0,0.550
V
0,0.579
V
0,0.802
V
0,0.213
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,21
V
1,0
"1-bromoheptane"
0,179.100
V
0,180
V
0,1.450
V
0,1.140
V
0,4.12
V
0,1.03E-04 
V
0,2.46E-04 
V
0,179
V
0,119
V
0,8.21
V
0,325.28
V
0,329.65
V
0,66.66
V
0,1.68
V
0,1.66
V
0,780
V
0,3.34
V
0,0.94
V
0,41.97
V
0,7.93
V
0,9.50
V
0,6.37
V
0,988
V
0,12.1
V
0,177
V
0,17.74
V
0,-1457.9
V
0,-47.30
V
0,0.8243
V
0,-10.6883
V
0,1.762
V
0,0.896
V
0,0.949
V
0,0.685
V
0,1.142
V
0,0.435
V
0,-0.329
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.406
V
0,-0.411
V
0,-0.746
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-0.792
V
0,-0.549
V
0,-0.509
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.580
V
0,-0.585
V
0,-0.572
V
0,-0.700
V
0,-0.646
V
0,-0.221
V
0,0.727
V
0,0.666
V
0,0.366
V
0,0.274
V
0,-0.869
V
0,-0.857
V
0,-0.663
V
0,-0.447
V
0,0.030
V
0,0.447
V
0,-0.153
V
0,-0.202
V
0,1.700
V
0,-1.211
V
0,-0.980
V
0,-0.736
V
0,-0.381
V
0,-0.392
V
0,0.328
V
0,-0.262
V
0,0.813
V
0,4.362
V
0,-0.826
V
0,4.362
V
0,1.932
V
0,0.977
V
0,0.008
V
0,-0.052
V
0,0.821
V
0,0.465
V
0,1.368
V
0,0.929
V
0,1.149
V
0,1.622
V
0,0.331
V
0,0.255
V
0,-0.214
V
0,0.066
V
0,0.500
V
0,0.096
V
0,0.999
V
0,0.547
V
0,0.578
V
0,0.802
V
0,0.213
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,22
V
1,0
"1-bromooctane"
0,193.126
V
0,201
V
0,1.452
V
0,1.118
V
0,4.61
V
0,2.77E-05 
V
0,7.04E-05 
V
0,193
V
0,132
V
0,9.87
V
0,444.80
V
0,450.28
V
0,75.97
V
0,1.69
V
0,1.67
V
0,893
V
0,3.74
V
0,0.94
V
0,46.57
V
0,8.93
V
0,10.75
V
0,6.61
V
0,1381
V
0,13.6
V
0,198
V
0,20.08
V
0,-1613.8
V
0,-54.15
V
0,0.8237
V
0,-10.6888
V
0,1.763
V
0,1.262
V
0,1.292
V
0,1.035
V
0,1.407
V
0,0.796
V
0,-0.153
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.448
V
0,-0.455
V
0,-0.746
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
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0,23
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1,0
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0,24
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1,0
"1-bromotetradecane"
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0,25
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1,0
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BOT
0,26
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1,0
"1-iodomethane"
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0,27
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1,0
"1-iodoethane"
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1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,28
V
1,0
"1-iodopropane"
0,169.992
V
0,101
V
0,1.504
V
0,1.743
V
0,2.57
V
0,0.0064
V
0,0.0112
V
0,170
V
0,74
V
0,3.35
V
0,61.57
V
0,63.28
V
0,28.90
V
0,1.57
V
0,1.53
V
0,292
V
0,2.17
V
0,1.86
V
0,28.92
V
0,4.41
V
0,4.50
V
0,4.75
V
0,136
V
0,6.0
V
0,111
V
0,12.46
V
0,-828.6
V
0,-7.84
V
0,0.4691
V
0,-10.4281
V
0,1.541
V
0,-0.388
V
0,-0.419
V
0,-0.007
V
0,-0.554
V
0,-0.543
V
0,-0.586
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.188
V
0,-0.250
V
0,-0.746
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-0.232
V
0,-0.435
V
0,-0.509
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.557
V
0,-0.540
V
0,-0.593
V
0,1.197
V
0,1.198
V
0,-0.718
V
0,-0.304
V
0,-0.150
V
0,-0.880
V
0,-0.667
V
0,-0.930
V
0,-0.792
V
0,-0.663
V
0,-0.447
V
0,0.136
V
0,0.595
V
0,-0.271
V
0,-0.200
V
0,-0.402
V
0,-0.647
V
0,-0.980
V
0,-0.736
V
0,-0.381
V
0,-0.392
V
0,-0.913
V
0,-0.262
V
0,-0.184
V
0,1.588
V
0,-0.469
V
0,1.588
V
0,2.073
V
0,0.977
V
0,0.004
V
0,0.046
V
0,0.898
V
0,0.522
V
0,1.795
V
0,1.043
V
0,1.419
V
0,1.837
V
0,0.422
V
0,0.275
V
0,-0.311
V
0,0.039
V
0,0.459
V
0,0.067
V
0,0.919
V
0,0.493
V
0,0.626
V
0,0.815
V
0,0.217
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,29
V
1,0
"1-iodobutane"
0,184.019
V
0,130
V
0,1.498
V
0,1.617
V
0,3.06
V
0,0.0017
V
0,0.0032
V
0,184
V
0,86
V
0,5.39
V
0,110.16
V
0,113.36
V
0,35.17
V
0,1.72
V
0,1.67
V
0,424
V
0,2.56
V
0,2.01
V
0,33.52
V
0,5.42
V
0,5.75
V
0,5.30
V
0,259
V
0,7.5
V
0,129
V
0,14.79
V
0,-984.4
V
0,-14.69
V
0,0.4652
V
0,-10.4282
V
0,1.555
V
0,-0.015
V
0,-0.036
V
0,0.341
V
0,-0.101
V
0,-0.209
V
0,-0.421
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.245
V
0,-0.262
V
0,-0.746
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-0.340
V
0,-0.396
V
0,-0.509
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.540
V
0,-0.521
V
0,-0.574
V
0,1.197
V
0,-0.281
V
0,1.249
V
0,-0.024
V
0,0.117
V
0,-0.551
V
0,-0.346
V
0,-0.849
V
0,-0.792
V
0,-0.663
V
0,-0.447
V
0,0.021
V
0,0.438
V
0,-0.437
V
0,-0.347
V
0,-0.146
V
0,-0.259
V
0,-0.980
V
0,-0.736
V
0,-0.381
V
0,-0.392
V
0,-0.567
V
0,-0.262
V
0,0.186
V
0,2.210
V
0,-0.465
V
0,2.210
V
0,2.073
V
0,0.977
V
0,0.006
V
0,0.046
V
0,0.898
V
0,0.521
V
0,1.754
V
0,1.042
V
0,1.398
V
0,1.838
V
0,0.422
V
0,0.275
V
0,-0.311
V
0,0.039
V
0,0.458
V
0,0.067
V
0,0.916
V
0,0.491
V
0,0.625
V
0,0.815
V
0,0.217
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,30
V
1,0
"1-iodopentane"
0,198.046
V
0,155
V
0,1.495
V
0,1.517
V
0,3.56
V
0,4.58E-04 
V
0,9.19E-04 
V
0,198
V
0,99
V
0,5.98
V
0,182.39
V
0,185.63
V
0,51.91
V
0,1.70
V
0,1.67
V
0,618
V
0,2.96
V
0,2.16
V
0,38.12
V
0,6.43
V
0,7.00
V
0,5.73
V
0,436
V
0,9.0
V
0,145
V
0,17.10
V
0,-1140.2
V
0,-21.54
V
0,0.4647
V
0,-10.4280
V
0,1.575
V
0,0.360
V
0,0.334
V
0,0.715
V
0,0.273
V
0,0.146
V
0,-0.260
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.256
V
0,-0.270
V
0,-0.746
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-0.380
V
0,-0.365
V
0,-0.509
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.533
V
0,-0.585
V
0,-0.570
V
0,-0.676
V
0,0.630
V
0,0.129
V
0,0.260
V
0,0.357
V
0,-0.239
V
0,-0.069
V
0,-0.869
V
0,-0.792
V
0,-0.663
V
0,-0.447
V
0,0.091
V
0,0.575
V
0,-0.435
V
0,-0.305
V
0,0.362
V
0,0.243
V
0,-0.980
V
0,-0.736
V
0,-0.381
V
0,-0.392
V
0,-0.258
V
0,-0.262
V
0,0.557
V
0,2.844
V
0,-0.465
V
0,2.844
V
0,2.073
V
0,0.977
V
0,0.008
V
0,0.047
V
0,0.897
V
0,0.522
V
0,1.718
V
0,1.043
V
0,1.380
V
0,1.837
V
0,0.422
V
0,0.275
V
0,-0.311
V
0,0.039
V
0,0.458
V
0,0.067
V
0,0.915
V
0,0.491
V
0,0.626
V
0,0.815
V
0,0.217
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,31
V
1,0
"1-iodohexane"
0,212.073
V
0,179
V
0,1.492
V
0,1.437
V
0,4.05
V
0,1.24E-04 
V
0,2.65E-04 
V
0,212
V
0,112
V
0,7.93
V
0,274.29
V
0,278.92
V
0,60.79
V
0,1.76
V
0,1.73
V
0,773
V
0,3.36
V
0,2.32
V
0,42.72
V
0,7.43
V
0,8.25
V
0,6.08
V
0,676
V
0,10.5
V
0,168
V
0,19.44
V
0,-1296.1
V
0,-28.38
V
0,0.4609
V
0,-10.4274
V
0,1.583
V
0,0.734
V
0,0.663
V
0,1.242
V
0,0.480
V
0,0.533
V
0,-0.098
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.293
V
0,-0.283
V
0,-0.746
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-0.318
V
0,-0.328
V
0,-0.509
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.531
V
0,-0.512
V
0,-0.561
V
0,1.197
V
0,1.198
V
0,-0.718
V
0,0.543
V
0,0.611
V
0,0.019
V
0,0.208
V
0,-0.849
V
0,-0.759
V
0,-0.663
V
0,-0.447
V
0,0.025
V
0,0.535
V
0,-0.388
V
0,-0.255
V
0,0.907
V
0,0.016
V
0,-0.980
V
0,-0.736
V
0,-0.381
V
0,-0.392
V
0,0.051
V
0,-0.262
V
0,0.928
V
0,3.489
V
0,-0.463
V
0,3.489
V
0,2.068
V
0,0.977
V
0,0.005
V
0,0.047
V
0,0.897
V
0,0.521
V
0,1.676
V
0,1.042
V
0,1.359
V
0,1.838
V
0,0.422
V
0,0.275
V
0,-0.311
V
0,0.039
V
0,0.458
V
0,0.066
V
0,0.915
V
0,0.491
V
0,0.626
V
0,0.815
V
0,0.217
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,32
V
1,0
"1-iodoheptane"
0,226.100
V
0,204
V
0,1.490
V
0,1.379
V
0,4.54
V
0,3.34E-05 
V
0,7.61E-05 
V
0,226
V
0,125
V
0,8.51
V
0,394.43
V
0,399.10
V
0,80.78
V
0,1.74
V
0,1.72
V
0,1015
V
0,3.75
V
0,2.46
V
0,47.32
V
0,8.44
V
0,9.50
V
0,6.37
V
0,988
V
0,12.0
V
0,179
V
0,21.77
V
0,-1451.9
V
0,-35.23
V
0,0.4630
V
0,-10.4284
V
0,1.591
V
0,1.105
V
0,1.063
V
0,1.306
V
0,0.976
V
0,0.919
V
0,0.052
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.286
V
0,-0.262
V
0,-0.746
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-0.353
V
0,-0.321
V
0,-0.509
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.531
V
0,-0.578
V
0,-0.593
V
0,0.591
V
0,0.592
V
0,1.540
V
0,0.859
V
0,0.878
V
0,0.313
V
0,0.462
V
0,-0.828
V
0,-0.759
V
0,-0.663
V
0,-0.447
V
0,0.147
V
0,0.702
V
0,-0.268
V
0,-0.026
V
0,1.545
V
0,0.111
V
0,-0.980
V
0,-0.736
V
0,-0.381
V
0,-0.392
V
0,0.389
V
0,-0.262
V
0,1.298
V
0,4.136
V
0,-0.463
V
0,4.136
V
0,2.069
V
0,0.977
V
0,0.006
V
0,0.046
V
0,0.898
V
0,0.521
V
0,1.633
V
0,1.042
V
0,1.337
V
0,1.838
V
0,0.423
V
0,0.275
V
0,-0.310
V
0,0.039
V
0,0.458
V
0,0.064
V
0,0.915
V
0,0.490
V
0,0.626
V
0,0.815
V
0,0.217
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,33
V
1,0
"1-fluoropentane"
0,90.140
V
0,63
V
0,1.360
V
0,0.789
V
0,2.74
V
0,0.0041
V
0,0.0076
V
0,90
V
0,80
V
0,5.35
V
0,73.94
V
0,76.54
V
0,21.17
V
0,1.53
V
0,1.48
V
0,201
V
0,1.94
V
0,1.04
V
0,25.04
V
0,4.87
V
0,7.00
V
0,5.73
V
0,436
V
0,16.0
V
0,133
V
0,11.61
V
0,-1278.2
V
0,-86.94
V
0,3.3929
V
0,-11.3516
V
0,1.769
V
0,-0.243
V
0,-0.178
V
0,-0.489
V
0,0.074
V
0,-0.666
V
0,-0.331
V
0,0.080
V
0,-0.289
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,0.656
V
0,1.635
V
0,1.791
V
0,1.959
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-0.843
V
0,-0.274
V
0,0.025
V
0,-0.303
V
0,-0.472
V
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V
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V
0,2.792
V
0,-3.391
V
0,2.792
V
0,1.383
V
0,0.976
V
0,0.002
V
0,-0.178
V
0,0.047
V
0,0.051
V
0,0.219
V
0,0.051
V
0,0.135
V
0,0.901
V
0,0.126
V
0,0.172
V
0,0.009
V
0,0.049
V
0,0.235
V
0,0.176
V
0,0.371
V
0,0.273
V
0,0.497
V
0,0.639
V
0,0.191
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,34
V
1,0
"1-fluorohexane"
0,104.167
V
0,93
V
0,1.376
V
0,0.800
V
0,3.23
V
0,0.0011
V
0,0.0022
V
0,104
V
0,93
V
0,6.53
V
0,116.13
V
0,119.36
V
0,26.64
V
0,1.50
V
0,1.46
V
0,244
V
0,2.34
V
0,1.35
V
0,29.64
V
0,5.87
V
0,8.25
V
0,6.08
V
0,676
V
0,17.5
V
0,148
V
0,13.93
V
0,-1434.1
V
0,-93.77
V
0,3.3626
V
0,-11.3055
V
0,1.778
V
0,0.105
V
0,0.178
V
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V
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V
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V
0,0.423
V
0,1.310
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V
0,1.833
V
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V
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V
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V
0,0.637
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0,0.620
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V
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V
0,3.443
V
0,-3.361
V
0,3.443
V
0,1.382
V
0,0.976
V
0,0.003
V
0,-0.178
V
0,0.007
V
0,0.047
V
0,0.169
V
0,0.046
V
0,0.108
V
0,0.901
V
0,0.126
V
0,0.172
V
0,0.009
V
0,0.009
V
0,0.211
V
0,0.137
V
0,0.332
V
0,0.234
V
0,0.497
V
0,0.639
V
0,0.191
V
1,0
""
1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,35
V
1,0
"1-fluorononane"
0,146.248
V
0,168
V
0,1.403
V
0,0.816
V
0,4.70
V
0,2.18E-05 
V
0,5.20E-05 
V
0,146
V
0,132
V
0,9.59
V
0,331.97
V
0,336.61
V
0,52.03
V
0,1.50
V
0,1.48
V
0,485
V
0,3.53
V
0,2.24
V
0,43.45
V
0,8.87
V
0,12.00
V
0,6.82
V
0,1864
V
0,22.0
V
0,202
V
0,20.93
V
0,-1901.6
V
0,-114.32
V
0,3.3175
V
0,-11.1758
V
0,1.796
V
0,1.211
V
0,1.396
V
0,0.268
V
0,1.957
V
0,0.808
V
0,0.285
V
0,0.083
V
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0,0.141
V
0,0.729
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0,1.633
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0,1.746
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0,1.768
V
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V
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V
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V
0,1.006
V
0,5.362
V
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V
0,5.362
V
0,1.382
V
0,0.976
V
0,0.002
V
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V
0,0.000
V
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V
0,0.091
V
0,0.037
V
0,0.064
V
0,0.900
V
0,0.126
V
0,0.172
V
0,0.009
V
0,0.000
V
0,0.168
V
0,0.075
V
0,0.260
V
0,0.167
V
0,0.497
V
0,0.639
V
0,0.191
V
1,0
""
1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,36
V
1,0
"1,1-dichloromethane"
0,84.933
V
0,40
V
0,1.424
V
0,1.325
V
0,1.34
V
0,0.1720
V
0,0.1754
V
0,85
V
0,53
V
0,2.54
V
0,25.10
V
0,27.08
V
0,17.03
V
0,1.73
V
0,1.60
V
0,197
V
0,1.15
V
0,0.35
V
0,16.44
V
0,3.08
V
0,2.00
V
0,3.02
V
0,16
V
0,4.1
V
0,81
V
0,4.08
V
0,-903.6
V
0,-25.85
V
0,0.5945
V
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V
0,1.503
V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
0,0.125
V
0,-0.594
V
0,0.125
V
0,1.741
V
0,0.986
V
0,0.000
V
0,-0.077
V
0,0.354
V
0,0.252
V
0,0.773
V
0,0.492
V
0,0.632
V
0,1.139
V
0,0.320
V
0,0.214
V
0,-0.103
V
0,0.114
V
0,0.473
V
0,0.183
V
0,0.976
V
0,0.580
V
0,0.460
V
0,1.040
V
0,0.221
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
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1,0
""
1,0
""
1,0
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1,0
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1,0
""
1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,37
V
1,0
"1,2-dichloroethane"
0,98.960
V
0,83
V
0,1.444
V
0,1.256
V
0,1.83
V
0,0.0465
V
0,0.0505
V
0,99
V
0,67
V
0,2.90
V
0,55.17
V
0,56.83
V
0,29.91
V
0,1.57
V
0,1.53
V
0,301
V
0,1.59
V
0,0.13
V
0,20.66
V
0,4.10
V
0,3.25
V
0,4.02
V
0,58
V
0,5.6
V
0,99
V
0,6.37
V
0,-1059.5
V
0,-33.80
V
0,0.6814
V
0,-11.4196
V
0,0.010
V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
0,0.040
V
0,2.313
V
0,1.393
V
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V
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V
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V
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V
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V
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V
0,3.681
V
0,-0.684
V
0,3.681
V
0,1.755
V
0,0.971
V
0,0.006
V
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V
0,0.299
V
0,0.244
V
0,0.714
V
0,0.482
V
0,0.598
V
0,1.183
V
0,0.288
V
0,0.216
V
0,-0.130
V
0,0.081
V
0,0.256
V
0,0.144
V
0,0.516
V
0,0.330
V
0,0.506
V
0,0.833
V
0,0.210
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
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1,0
""
1,0
""
1,0
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1,0
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1,0
""
1,0
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1,0
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1,0
""
1,0
""
1,0
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1,0
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1,0
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1,0
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1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,38
V
1,0
"1,3-dichloropropane"
0,112.986
V
0,121
V
0,1.448
V
0,1.190
V
0,2.32
V
0,0.0126
V
0,0.0145
V
0,113
V
0,79
V
0,5.12
V
0,93.78
V
0,97.23
V
0,30.18
V
0,1.65
V
0,1.59
V
0,330
V
0,1.64
V
0,0.78
V
0,25.52
V
0,5.11
V
0,4.50
V
0,4.75
V
0,136
V
0,7.1
V
0,121
V
0,8.46
V
0,-1215.3
V
0,-40.74
V
0,1.0199
V
0,-11.3717
V
0,1.505
V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
0,1.220
V
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V
0,0.218
V
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V
0,0.065
V
0,0.259
V
0,0.109
V
0,0.531
V
0,0.320
V
0,0.513
V
0,0.807
V
0,0.208
V
1,0
""
1,0
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1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,39
V
1,0
"1,4-dichlorobutane"
0,127.013
V
0,162
V
0,1.453
V
0,1.160
V
0,2.81
V
0,0.0034
V
0,0.0042
V
0,127
V
0,92
V
0,5.34
V
0,151.37
V
0,154.50
V
0,45.43
V
0,1.60
V
0,1.57
V
0,479
V
0,2.09
V
0,0.00
V
0,30.16
V
0,6.12
V
0,5.75
V
0,5.30
V
0,259
V
0,8.6
V
0,134
V
0,10.80
V
0,-1371.1
V
0,-48.09
V
0,1.1802
V
0,-11.2998
V
0,0.003
V
0,0.027
V
0,0.042
V
0,0.153
V
0,0.109
V
0,-0.188
V
0,-0.579
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.635
V
0,-0.675
V
0,-0.746
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-0.432
V
0,-0.551
V
0,-0.509
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.607
V
0,-0.592
V
0,-0.571
V
0,1.210
V
0,1.301
V
0,-1.195
V
0,0.533
V
0,0.062
V
0,0.624
V
0,-0.257
V
0,-0.788
V
0,-0.857
V
0,-0.663
V
0,-0.447
V
0,-0.931
V
0,-1.059
V
0,-0.935
V
0,-0.988
V
0,-0.152
V
0,-1.211
V
0,-0.980
V
0,-0.736
V
0,-0.381
V
0,-0.392
V
0,0.125
V
0,-0.262
V
0,-0.050
V
0,2.733
V
0,-1.184
V
0,2.733
V
0,1.757
V
0,0.971
V
0,0.003
V
0,-0.119
V
0,0.381
V
0,0.208
V
0,0.660
V
0,0.416
V
0,0.538
V
0,1.242
V
0,0.258
V
0,0.219
V
0,-0.116
V
0,0.072
V
0,0.248
V
0,0.108
V
0,0.516
V
0,0.312
V
0,0.520
V
0,0.788
V
0,0.208
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,40
V
1,0
"1,5-dichloropentane"
0,141.040
V
0,181
V
0,1.455
V
0,1.106
V
0,3.30
V
0,0.0009
V
0,0.0012
V
0,141
V
0,105
V
0,7.61
V
0,220.44
V
0,225.28
V
0,46.87
V
0,1.62
V
0,1.58
V
0,503
V
0,2.48
V
0,0.86
V
0,34.77
V
0,7.13
V
0,7.00
V
0,5.73
V
0,436
V
0,10.1
V
0,159
V
0,13.03
V
0,-1527.0
V
0,-54.99
V
0,1.2913
V
0,-11.2497
V
0,1.560
V
0,0.397
V
0,0.371
V
0,0.743
V
0,0.313
V
0,0.183
V
0,-0.397
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.638
V
0,-0.677
V
0,-0.746
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-0.382
V
0,-0.480
V
0,-0.509
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.606
V
0,-0.592
V
0,-0.572
V
0,-0.781
V
0,1.301
V
0,1.456
V
0,0.808
V
0,0.270
V
0,0.818
V
0,-0.003
V
0,-0.849
V
0,-0.857
V
0,-0.663
V
0,-0.447
V
0,-0.849
V
0,-1.095
V
0,-1.065
V
0,-0.284
V
0,-0.827
V
0,-1.211
V
0,-0.980
V
0,-0.736
V
0,-0.381
V
0,-0.392
V
0,0.407
V
0,-0.262
V
0,0.320
V
0,3.344
V
0,-1.294
V
0,3.344
V
0,1.756
V
0,0.971
V
0,0.002
V
0,-0.121
V
0,0.307
V
0,0.206
V
0,0.618
V
0,0.414
V
0,0.516
V
0,1.257
V
0,0.253
V
0,0.219
V
0,-0.115
V
0,0.060
V
0,0.251
V
0,0.102
V
0,0.520
V
0,0.311
V
0,0.526
V
0,0.778
V
0,0.207
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,41
V
1,0
"1,6-dichlorohexane"
0,155.067
V
0,205
V
0,1.457
V
0,1.068
V
0,3.80
V
0,0.0002
V
0,0.0003
V
0,155
V
0,118
V
0,7.78
V
0,312.87
V
0,317.33
V
0,65.64
V
0,1.63
V
0,1.61
V
0,723
V
0,2.88
V
0,0.04
V
0,39.37
V
0,8.13
V
0,8.25
V
0,6.08
V
0,676
V
0,11.6
V
0,173
V
0,15.40
V
0,-1682.8
V
0,-61.92
V
0,1.3564
V
0,-11.2221
V
0,0.047
V
0,0.813
V
0,0.844
V
0,0.735
V
0,0.976
V
0,0.545
V
0,-0.206
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.657
V
0,-0.688
V
0,-0.746
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-0.535
V
0,-0.445
V
0,-0.509
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.566
V
0,-0.567
V
0,-0.545
V
0,1.287
V
0,1.191
V
0,-0.546
V
0,1.061
V
0,0.540
V
0,1.118
V
0,0.197
V
0,0.044
V
0,-0.207
V
0,-0.563
V
0,-0.447
V
0,-0.942
V
0,-1.108
V
0,-1.048
V
0,-1.092
V
0,-1.169
V
0,-0.934
V
0,0.693
V
0,-0.736
V
0,-0.381
V
0,-0.392
V
0,0.825
V
0,-0.262
V
0,0.691
V
0,3.835
V
0,-1.364
V
0,3.835
V
0,1.756
V
0,0.970
V
0,0.004
V
0,-0.124
V
0,0.293
V
0,0.203
V
0,0.582
V
0,0.412
V
0,0.497
V
0,1.266
V
0,0.250
V
0,0.220
V
0,-0.115
V
0,0.058
V
0,0.251
V
0,0.097
V
0,0.521
V
0,0.309
V
0,0.530
V
0,0.772
V
0,0.207
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,42
V
1,0
"1,7-dichloroheptane"
0,169.094
V
0,227
V
0,1.457
V
0,1.041
V
0,4.29
V
0,6.51E-05 
V
0,9.88E-05 
V
0,169
V
0,131
V
0,10.99
V
0,429.64
V
0,436.95
V
0,63.48
V
0,1.62
V
0,1.60
V
0,690
V
0,3.28
V
0,1.02
V
0,43.97
V
0,9.13
V
0,9.50
V
0,6.37
V
0,988
V
0,13.1
V
0,202
V
0,17.62
V
0,-1838.5
V
0,-64.77
V
0,1.3777
V
0,-11.2150
V
0,1.704
V
0,1.173
V
0,1.228
V
0,0.860
V
0,1.417
V
0,0.937
V
0,-0.095
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.622
V
0,-0.657
V
0,-0.746
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-0.525
V
0,-0.450
V
0,-0.509
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.607
V
0,-0.594
V
0,-0.587
V
0,-1.100
V
0,1.736
V
0,1.974
V
0,1.404
V
0,0.832
V
0,1.593
V
0,0.562
V
0,-0.768
V
0,-0.759
V
0,-0.663
V
0,-0.447
V
0,-0.729
V
0,-0.963
V
0,-1.108
V
0,-0.579
V
0,-0.286
V
0,1.776
V
0,-0.980
V
0,-0.736
V
0,-0.381
V
0,-0.392
V
0,1.140
V
0,-0.262
V
0,1.062
V
0,4.487
V
0,-1.406
V
0,4.487
V
0,1.756
V
0,0.970
V
0,0.003
V
0,-0.124
V
0,0.236
V
0,0.194
V
0,0.543
V
0,0.411
V
0,0.477
V
0,1.274
V
0,0.248
V
0,0.220
V
0,-0.114
V
0,0.047
V
0,0.242
V
0,0.092
V
0,0.521
V
0,0.306
V
0,0.532
V
0,0.768
V
0,0.207
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,43
V
1,0
"1,8-dichlorooctane"
0,183.120
V
0,250
V
0,1.459
V
0,1.025
V
0,4.78
V
0,1.76E-05 
V
0,2.84E-05 
V
0,183
V
0,144
V
0,9.98
V
0,556.03
V
0,561.61
V
0,90.04
V
0,1.62
V
0,1.60
V
0,975
V
0,3.67
V
0,0.02
V
0,48.57
V
0,10.14
V
0,10.75
V
0,6.61
V
0,1381
V
0,14.6
V
0,209
V
0,20.03
V
0,-1994.5
V
0,-75.76
V
0,1.4252
V
0,-11.1929
V
0,0.014
V
0,1.509
V
0,1.640
V
0,0.711
V
0,2.020
V
0,1.282
V
0,0.069
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.653
V
0,-0.681
V
0,-0.746
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-0.594
V
0,-0.429
V
0,-0.509
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.591
V
0,-0.595
V
0,-0.573
V
0,0.616
V
0,1.221
V
0,2.477
V
0,1.662
V
0,1.086
V
0,1.811
V
0,0.949
V
0,-0.403
V
0,-0.662
V
0,-0.613
V
0,-0.447
V
0,-0.929
V
0,-1.087
V
0,-1.003
V
0,-0.962
V
0,-0.533
V
0,0.780
V
0,1.248
V
0,-0.736
V
0,-0.381
V
0,-0.392
V
0,1.553
V
0,-0.262
V
0,1.432
V
0,5.068
V
0,-1.432
V
0,5.068
V
0,1.757
V
0,0.969
V
0,0.002
V
0,-0.126
V
0,0.003
V
0,0.218
V
0,0.503
V
0,0.413
V
0,0.458
V
0,1.278
V
0,0.247
V
0,0.221
V
0,-0.114
V
0,0.119
V
0,0.247
V
0,0.086
V
0,0.522
V
0,0.304
V
0,0.534
V
0,0.765
V
0,0.207
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,44
V
1,0
"1,9-dichlorononane"
0,197.147
V
0,260
V
0,1.460
V
0,1.091
V
0,5.27
V
0,4.75E-06 
V
0,8.17E-06 
V
0,197
V
0,157
V
0,12.28
V
0,708.27
V
0,715.57
V
0,92.06
V
0,1.60
V
0,1.58
V
0,972
V
0,4.07
V
0,0.88
V
0,53.17
V
0,11.14
V
0,12.00
V
0,6.82
V
0,1864
V
0,16.1
V
0,236
V
0,22.32
V
0,-2150.3
V
0,-82.54
V
0,1.4484
V
0,-11.1784
V
0,1.595
V
0,1.910
V
0,1.968
V
0,1.249
V
0,2.119
V
0,1.660
V
0,0.273
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.590
V
0,-0.629
V
0,-0.746
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-0.542
V
0,-0.374
V
0,-0.509
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.571
V
0,-0.566
V
0,-0.558
V
0,-0.842
V
0,1.198
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BOT
0,45
V
1,0
"1,10-dichlorodecane"
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0,284
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0,1.461
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0,5.76
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0,2.34E-06 
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0,211
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0,170
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0,893.16
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0,117.37
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0,1257
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BOT
0,46
V
1,0
"1,1-dibromomethane"
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0,97
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0,1.52
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0,174
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0,543
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0,16
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BOT
0,47
V
1,0
"1,2-dibromoethane"
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0,131
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0,1.539
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0,2.01
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0,188
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0,75
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0,143.69
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0,145.39
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0,77.27
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0,1.55
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0,789
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0,26.62
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0,4.91
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0,3.25
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0,4.02
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0,58
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0,113
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0,0.216
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BOT
0,48
V
1,0
"1,3-dibromopropane"
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0,167
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0,1.523
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0,2.50
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0,202
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0,88
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0,6.14
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0,226.26
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0,230.75
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0,844
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0,31.49
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0,126
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BOT
0,49
V
1,0
"1,10-dibromodecane"
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0,114
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0,5.94
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0,7.94E-07 
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0,9.06E-07 
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1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,50
V
1,0
"1,12-dibromododecane"
0,328.130
V
0,350
V
1,0
""
1,0
""
0,6.92
V
0,5.79E-08 
V
0,7.47E-08 
V
0,328
V
0,205
V
0,15.37
V
0,2442.59
V
0,2451.36
V
0,269.41
V
0,1.69
V
0,1.69
V
0,3230
V
0,5.39
V
0,0.01
V
0,72.94
V
0,14.92
V
0,15.75
V
0,7.29
V
0,3943
V
0,20.1
V
0,300
V
0,30.10
V
0,-2576.7
V
0,-77.14
V
0,0.7962
V
0,-10.7158
V
0,0.008
V
0,3.320
V
0,3.294
V
0,2.070
V
0,3.108
V
0,3.429
V
0,1.207
V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
0,1.015
V
0,1.115
V
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V
0,3.001
V
0,3.460
V
0,2.898
V
0,2.333
V
0,1.139
V
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V
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V
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V
0,-0.816
V
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V
0,-0.773
V
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V
0,0.096
V
0,1.122
V
0,0.938
V
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V
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V
0,-0.392
V
0,3.064
V
0,-0.262
V
0,3.197
V
0,7.799
V
0,-0.796
V
0,7.799
V
0,1.923
V
0,0.979
V
0,0.007
V
0,-0.051
V
0,0.821
V
0,0.433
V
0,0.703
V
0,0.467
V
0,0.585
V
0,1.609
V
0,0.335
V
0,0.254
V
0,-0.215
V
0,0.066
V
0,0.464
V
0,0.049
V
0,0.501
V
0,0.275
V
0,0.576
V
0,0.808
V
0,0.213
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
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1,0
""
1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,51
V
1,0
"bromochloromethane"
0,129.384
V
0,68
V
0,1.483
V
0,1.951
V
0,1.43
V
0,0.1353
V
0,0.1090
V
0,129
V
0,58
V
0,2.93
V
0,38.33
V
0,40.70
V
0,23.43
V
0,1.79
V
0,1.68
V
0,296
V
0,1.03
V
0,0.35
V
0,19.25
V
0,3.48
V
0,2.00
V
0,3.02
V
0,16
V
0,3.9
V
0,85
V
0,4.33
V
0,-883.0
V
0,-11.35
V
0,0.1671
V
0,-11.1440
V
0,1.486
V
0,-0.947
V
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V
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V
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V
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V
0,-0.814
V
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V
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V
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V
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V
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V
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V
0,-0.492
V
0,-0.605
V
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V
0,-0.533
V
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V
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V
0,-0.467
V
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V
0,0.130
V
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V
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V
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V
0,-0.472
V
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V
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V
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V
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V
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V
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V
0,1.097
V
0,1.228
V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
0,-0.806
V
0,0.752
V
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V
0,-0.328
V
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V
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V
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V
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V
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V
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V
0,-1.021
V
0,0.173
V
0,-0.100
V
0,0.173
V
0,1.915
V
0,0.986
V
0,0.001
V
0,-0.001
V
0,0.699
V
0,0.451
V
0,1.401
V
0,0.854
V
0,1.127
V
0,1.408
V
0,0.461
V
0,0.247
V
0,-0.209
V
0,0.076
V
0,0.457
V
0,0.109
V
0,0.927
V
0,0.518
V
0,0.496
V
0,1.113
V
0,0.227
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
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1,0
""
1,0
""
1,0
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1,0
""
1,0
""
1,0
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1,0
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1,0
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1,0
""
1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
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1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,52
V
1,0
"1-bromo-3-chloropropane"
0,157.437
V
0,144
V
0,1.485
V
0,1.592
V
0,2.41
V
0,0.0099
V
0,0.0090
V
0,157
V
0,84
V
0,5.53
V
0,141.51
V
0,145.38
V
0,44.46
V
0,1.74
V
0,1.69
V
0,547
V
0,1.70
V
0,0.88
V
0,28.50
V
0,5.50
V
0,4.50
V
0,4.75
V
0,136
V
0,6.9
V
0,123
V
0,8.81
V
0,-1194.7
V
0,-27.73
V
0,0.5061
V
0,-10.9189
V
0,1.463
V
0,-0.169
V
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V
0,0.058
V
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V
0,-0.217
V
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V
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V
0,-0.493
V
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V
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V
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V
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V
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V
0,-0.613
V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
0,0.676
V
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V
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V
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V
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V
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V
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V
0,-0.280
V
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V
0,-0.509
V
0,-0.898
V
0,1.925
V
0,0.981
V
0,0.005
V
0,-0.035
V
0,0.832
V
0,0.442
V
0,1.371
V
0,0.819
V
0,1.095
V
0,1.509
V
0,0.374
V
0,0.250
V
0,-0.222
V
0,0.063
V
0,0.447
V
0,0.088
V
0,0.834
V
0,0.461
V
0,0.549
V
0,0.863
V
0,0.215
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
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1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,53
V
1,0
"1,1-diidomethane"
0,267.835
V
0,181
V
1,0
""
0,3.325
V
0,2.35
V
0,0.0116
V
0,0.0065
V
0,268
V
0,74
V
0,3.73
V
0,121.51
V
0,124.69
V
0,63.49
V
0,1.95
V
0,1.90
V
0,985
V
0,1.23
V
0,0.47
V
0,32.39
V
0,5.14
V
0,2.00
V
0,3.02
V
0,16
V
0,3.5
V
0,102
V
0,12.64
V
0,-850.5
V
0,21.50
V
0,-0.2688
V
0,-10.5533
V
0,1.128
V
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V
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V
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V
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V
0,0.212
V
0,0.117
V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
0,1.252
V
0,0.284
V
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V
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V
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V
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V
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V
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V
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V
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V
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V
0,1.131
V
0,1.250
V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
0,0.090
V
0,0.246
V
0,0.270
V
0,0.246
V
0,2.042
V
0,0.979
V
0,0.001
V
0,0.121
V
0,0.487
V
0,0.315
V
0,0.938
V
0,0.598
V
0,0.768
V
0,1.573
V
0,0.598
V
0,0.266
V
0,-0.527
V
0,0.027
V
0,0.373
V
0,0.073
V
0,0.808
V
0,0.440
V
0,0.621
V
0,1.193
V
0,0.239
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,54
V
1,0
"1,3-diidopropane"
0,295.888
V
0,211
V
0,1.642
V
0,2.576
V
0,3.33
V
0,0.0008
V
0,0.0005
V
0,296
V
0,100
V
0,7.23
V
0,383.97
V
0,389.55
V
0,99.70
V
0,1.88
V
0,1.85
V
0,1451
V
0,2.59
V
0,1.38
V
0,42.18
V
0,7.05
V
0,4.50
V
0,4.75
V
0,136
V
0,6.5
V
0,140
V
0,17.31
V
0,-1162.2
V
0,9.21
V
0,0.0628
V
0,-10.5939
V
0,1.305
V
0,0.305
V
0,0.255
V
0,0.819
V
0,0.109
V
0,0.937
V
0,0.313
V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
0,0.503
V
0,0.585
V
0,0.699
V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
0,0.831
V
0,0.606
V
0,-0.068
V
0,0.606
V
0,2.066
V
0,0.976
V
0,0.005
V
0,0.062
V
0,0.454
V
0,0.279
V
0,0.909
V
0,0.543
V
0,0.726
V
0,1.710
V
0,0.476
V
0,0.270
V
0,-0.319
V
0,0.021
V
0,0.216
V
0,0.037
V
0,0.449
V
0,0.243
V
0,0.601
V
0,0.874
V
0,0.219
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,55
V
1,0
"2-chloropropane"
0,78.541
V
0,35
V
0,1.378
V
0,0.859
V
0,2.00
V
0,0.0295
V
0,0.0639
V
0,79
V
0,62
V
0,10.18
V
0,18.35
V
0,25.86
V
0,4.07
V
0,2.26
V
0,1.60
V
0,62
V
0,1.64
V
0,1.03
V
0,20.48
V
0,1.71
V
0,4.50
V
0,4.75
V
0,136
V
0,6.6
V
0,101
V
0,8.11
V
0,-855.1
V
0,-31.31
V
0,1.4173
V
0,-11.1553
V
0,1.806
V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
0,-0.746
V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
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V
0,-0.607
V
0,-0.638
V
0,-0.622
V
0,1.077
V
0,1.099
V
0,-1.026
V
0,-0.649
V
0,-1.181
V
0,-0.792
V
0,-0.999
V
0,-0.849
V
0,-0.727
V
0,-0.563
V
0,-0.447
V
0,-0.313
V
0,-0.056
V
0,-0.087
V
0,0.035
V
0,0.081
V
0,2.374
V
0,1.261
V
0,-0.736
V
0,-0.381
V
0,-0.392
V
0,-0.323
V
0,-0.262
V
0,-0.810
V
0,1.825
V
0,-1.407
V
0,1.825
V
0,1.775
V
0,0.949
V
0,0.019
V
0,-0.138
V
0,0.653
V
0,0.410
V
0,1.366
V
0,0.816
V
0,1.091
V
0,1.332
V
0,0.246
V
0,0.225
V
0,-0.052
V
0,0.112
V
0,0.518
V
0,0.186
V
0,1.034
V
0,0.610
V
0,0.523
V
0,0.775
V
0,0.207
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,56
V
1,0
"2-chlorobutane"
0,92.568
V
0,69
V
0,1.396
V
0,0.873
V
0,2.49
V
0,0.0080
V
0,0.0184
V
0,93
V
0,76
V
0,17.94
V
0,26.65
V
0,40.96
V
0,4.04
V
0,2.72
V
0,1.77
V
0,81
V
0,2.11
V
0,1.05
V
0,25.00
V
0,2.67
V
0,5.75
V
0,5.30
V
0,259
V
0,8.1
V
0,121
V
0,10.44
V
0,-1010.9
V
0,-37.58
V
0,1.4430
V
0,-11.1125
V
0,1.759
V
0,-0.373
V
0,-0.407
V
0,0.028
V
0,-0.550
V
0,-1.070
V
0,-1.012
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.540
V
0,-0.483
V
0,-0.746
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-1.171
V
0,-0.851
V
0,-0.509
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.578
V
0,-0.564
V
0,-0.584
V
0,-0.376
V
0,-0.172
V
0,-1.195
V
0,-0.444
V
0,-0.917
V
0,-0.721
V
0,-0.766
V
0,-0.545
V
0,-0.402
V
0,-0.513
V
0,-0.447
V
0,-0.600
V
0,-0.915
V
0,-0.125
V
0,-0.291
V
0,-0.583
V
0,-0.698
V
0,-0.030
V
0,-0.736
V
0,-0.381
V
0,-0.392
V
0,-1.068
V
0,-0.262
V
0,-0.440
V
0,2.857
V
0,-1.435
V
0,2.857
V
0,1.776
V
0,0.950
V
0,0.025
V
0,-0.137
V
0,0.621
V
0,0.409
V
0,1.202
V
0,0.813
V
0,1.007
V
0,1.341
V
0,0.243
V
0,0.226
V
0,-0.052
V
0,0.117
V
0,0.518
V
0,0.189
V
0,1.033
V
0,0.611
V
0,0.535
V
0,0.774
V
0,0.208
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,57
V
1,0
"2-chloropentane"
0,106.595
V
0,97
V
1,0
""
0,0.873
V
0,2.98
V
0,0.0022
V
0,0.0053
V
0,107
V
0,89
V
0,18.99
V
0,54.08
V
0,68.18
V
0,7.61
V
0,2.67
V
0,2.12
V
0,181
V
0,2.50
V
0,1.04
V
0,29.60
V
0,3.65
V
0,7.00
V
0,5.73
V
0,436
V
0,9.6
V
0,137
V
0,12.77
V
0,-1166.7
V
0,-44.42
V
0,1.4199
V
0,-11.1205
V
0,1.770
V
0,-0.008
V
0,0.037
V
0,-0.076
V
0,0.213
V
0,-0.726
V
0,-0.821
V
0,-0.522
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.462
V
0,-0.495
V
0,0.236
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-1.241
V
0,-0.753
V
0,-0.508
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.502
V
0,-0.540
V
0,-0.532
V
0,-0.376
V
0,-1.177
V
0,-0.523
V
0,-0.155
V
0,-0.628
V
0,-0.457
V
0,-0.567
V
0,-0.443
V
0,-0.109
V
0,-0.163
V
0,-0.300
V
0,-0.375
V
0,-0.356
V
0,0.118
V
0,0.071
V
0,0.136
V
0,0.177
V
0,1.142
V
0,1.750
V
0,-0.381
V
0,-0.392
V
0,-0.849
V
0,-0.262
V
0,-0.069
V
0,3.489
V
0,-1.430
V
0,3.489
V
0,1.776
V
0,0.950
V
0,0.026
V
0,-0.138
V
0,0.642
V
0,0.409
V
0,1.012
V
0,0.812
V
0,0.912
V
0,1.340
V
0,0.244
V
0,0.226
V
0,-0.051
V
0,0.112
V
0,0.518
V
0,0.156
V
0,1.032
V
0,0.594
V
0,0.534
V
0,0.774
V
0,0.208
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,58
V
1,0
"3-chlorohexane"
0,120.622
V
0,123
V
0,1.416
V
0,0.876
V
0,3.47
V
0,5.82E-04 
V
0,1.52E-03 
V
0,121
V
0,101
V
0,23.71
V
0,76.10
V
0,93.51
V
0,7.31
V
0,2.28
V
0,1.85
V
0,129
V
0,2.97
V
0,1.05
V
0,34.13
V
0,4.63
V
0,8.25
V
0,6.08
V
0,676
V
0,11.1
V
0,154
V
0,15.12
V
0,-1322.5
V
0,-50.57
V
0,1.4415
V
0,-11.0667
V
0,1.718
V
0,0.341
V
0,0.300
V
0,0.788
V
0,0.189
V
0,-0.441
V
0,-0.669
V
0,-0.521
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.557
V
0,-0.565
V
0,0.225
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-1.159
V
0,-0.676
V
0,-0.507
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.504
V
0,-0.520
V
0,-0.502
V
0,0.755
V
0,0.620
V
0,-1.129
V
0,0.010
V
0,-0.443
V
0,-0.316
V
0,-0.335
V
0,-0.078
V
0,0.086
V
0,0.137
V
0,-0.226
V
0,-0.568
V
0,-0.777
V
0,-0.577
V
0,-0.481
V
0,-0.474
V
0,-0.777
V
0,0.250
V
0,0.366
V
0,-0.381
V
0,-0.392
V
0,0.769
V
0,-0.262
V
0,0.301
V
0,4.562
V
0,-1.464
V
0,4.562
V
0,1.778
V
0,0.950
V
0,0.030
V
0,-0.136
V
0,0.555
V
0,0.408
V
0,0.937
V
0,0.809
V
0,0.873
V
0,1.349
V
0,0.241
V
0,0.226
V
0,-0.051
V
0,0.098
V
0,0.517
V
0,0.164
V
0,1.029
V
0,0.596
V
0,0.546
V
0,0.773
V
0,0.209
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,59
V
1,0
"3-chloroheptane"
0,134.649
V
0,156
V
0,1.422
V
0,0.869
V
0,3.96
V
0,1.57E-04 
V
0,4.36E-04 
V
0,135
V
0,114
V
0,25.02
V
0,122.56
V
0,139.63
V
0,11.00
V
0,2.24
V
0,1.97
V
0,204
V
0,3.37
V
0,1.06
V
0,38.73
V
0,5.62
V
0,9.50
V
0,6.37
V
0,988
V
0,12.6
V
0,174
V
0,17.45
V
0,-1478.4
V
0,-57.38
V
0,1.4705
V
0,-11.0550
V
0,1.672
V
0,0.699
V
0,0.683
V
0,0.913
V
0,0.667
V
0,-0.095
V
0,-0.551
V
0,-0.514
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.544
V
0,-0.543
V
0,0.149
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-1.148
V
0,-0.655
V
0,-0.502
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.480
V
0,-0.461
V
0,-0.484
V
0,-1.100
V
0,0.837
V
0,0.732
V
0,0.312
V
0,-0.182
V
0,-0.116
V
0,0.042
V
0,0.003
V
0,0.021
V
0,0.087
V
0,-0.005
V
0,-0.565
V
0,-0.726
V
0,-0.356
V
0,-0.348
V
0,0.201
V
0,-0.684
V
0,-0.070
V
0,0.144
V
0,-0.381
V
0,-0.392
V
0,0.621
V
0,-0.262
V
0,0.672
V
0,5.179
V
0,-1.457
V
0,5.179
V
0,1.777
V
0,0.950
V
0,0.031
V
0,-0.136
V
0,0.503
V
0,0.408
V
0,0.820
V
0,0.809
V
0,0.814
V
0,1.349
V
0,0.242
V
0,0.226
V
0,-0.051
V
0,0.089
V
0,0.517
V
0,0.150
V
0,1.026
V
0,0.588
V
0,0.546
V
0,0.773
V
0,0.209
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,60
V
1,0
"2-chlorooctane"
0,148.675
V
0,174
V
0,1.427
V
0,0.866
V
0,4.45
V
0,4.25E-05 
V
0,1.25E-04 
V
0,149
V
0,126
V
0,23.65
V
0,218.05
V
0,234.00
V
0,22.74
V
0,2.47
V
0,2.30
V
0,540
V
0,3.69
V
0,1.06
V
0,43.41
V
0,6.62
V
0,10.75
V
0,6.61
V
0,1381
V
0,14.1
V
0,196
V
0,19.79
V
0,-1634.2
V
0,-64.95
V
0,1.4291
V
0,-11.1078
V
0,1.739
V
0,1.088
V
0,1.118
V
0,0.932
V
0,1.237
V
0,0.334
V
0,-0.369
V
0,-0.511
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.510
V
0,-0.501
V
0,-0.072
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-1.095
V
0,-0.604
V
0,-0.501
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.454
V
0,-0.538
V
0,-0.528
V
0,0.354
V
0,-0.233
V
0,1.210
V
0,0.656
V
0,0.026
V
0,0.489
V
0,0.307
V
0,-0.200
V
0,-0.044
V
0,-0.063
V
0,-0.152
V
0,-0.372
V
0,-0.537
V
0,-0.143
V
0,-0.193
V
0,1.012
V
0,0.513
V
0,0.921
V
0,0.676
V
0,-0.381
V
0,-0.392
V
0,0.774
V
0,-0.262
V
0,1.043
V
0,5.391
V
0,-1.429
V
0,5.391
V
0,1.776
V
0,0.950
V
0,0.028
V
0,-0.138
V
0,0.355
V
0,0.409
V
0,0.639
V
0,0.810
V
0,0.725
V
0,1.341
V
0,0.244
V
0,0.226
V
0,-0.051
V
0,0.042
V
0,0.518
V
0,0.106
V
0,1.030
V
0,0.568
V
0,0.534
V
0,0.775
V
0,0.208
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,61
V
1,0
"2-bromopropane"
0,122.992
V
0,59
V
0,1.425
V
0,1.310
V
0,2.08
V
0,0.0238
V
0,0.0398
V
0,123
V
0,68
V
0,10.16
V
0,29.34
V
0,36.83
V
0,6.45
V
0,2.23
V
0,1.78
V
0,108
V
0,1.70
V
0,1.23
V
0,23.46
V
0,1.98
V
0,4.50
V
0,4.75
V
0,136
V
0,6.4
V
0,106
V
0,8.52
V
0,-834.5
V
0,-17.91
V
0,0.7283
V
0,-10.6722
V
0,1.799
V
0,-0.611
V
0,-0.584
V
0,-0.762
V
0,-0.484
V
0,-1.072
V
0,-0.965
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.318
V
0,-0.279
V
0,-0.746
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-0.889
V
0,-0.771
V
0,-0.509
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.592
V
0,-0.588
V
0,-0.568
V
0,-0.950
V
0,1.052
V
0,1.279
V
0,-0.491
V
0,-0.569
V
0,-0.880
V
0,-0.711
V
0,-0.707
V
0,-0.727
V
0,-0.513
V
0,-0.447
V
0,-0.006
V
0,0.626
V
0,-0.025
V
0,0.055
V
0,0.070
V
0,2.396
V
0,1.338
V
0,-0.736
V
0,-0.381
V
0,-0.392
V
0,-0.263
V
0,-0.262
V
0,-0.669
V
0,2.057
V
0,-0.736
V
0,2.057
V
0,1.954
V
0,0.959
V
0,0.040
V
0,-0.066
V
0,0.847
V
0,0.458
V
0,1.712
V
0,0.915
V
0,1.314
V
0,1.680
V
0,0.337
V
0,0.260
V
0,-0.145
V
0,0.055
V
0,0.493
V
0,0.088
V
0,0.986
V
0,0.537
V
0,0.563
V
0,0.827
V
0,0.213
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,62
V
1,0
"2-bromobutane"
0,137.019
V
0,91
V
0,1.437
V
0,1.255
V
0,2.58
V
0,0.0063
V
0,0.0114
V
0,137
V
0,81
V
0,21.10
V
0,38.11
V
0,55.53
V
0,5.09
V
0,2.82
V
0,1.93
V
0,116
V
0,2.17
V
0,1.24
V
0,27.99
V
0,2.96
V
0,5.75
V
0,5.30
V
0,259
V
0,7.9
V
0,122
V
0,10.86
V
0,-990.3
V
0,-24.06
V
0,0.7562
V
0,-10.6423
V
0,1.766
V
0,-0.249
V
0,-0.390
V
0,0.959
V
0,-0.931
V
0,-0.751
V
0,-0.819
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.475
V
0,-0.425
V
0,-0.746
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-0.645
V
0,-0.668
V
0,-0.509
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.541
V
0,-0.541
V
0,-0.533
V
0,1.084
V
0,-0.202
V
0,0.722
V
0,-0.305
V
0,-0.384
V
0,-0.780
V
0,-0.600
V
0,-0.463
V
0,-0.304
V
0,-0.463
V
0,-0.447
V
0,-0.429
V
0,-0.154
V
0,-0.402
V
0,-0.203
V
0,-0.601
V
0,-0.730
V
0,0.241
V
0,-0.736
V
0,-0.381
V
0,-0.392
V
0,-0.700
V
0,-0.262
V
0,-0.299
V
0,3.110
V
0,-0.765
V
0,3.110
V
0,1.955
V
0,0.959
V
0,0.052
V
0,-0.065
V
0,0.844
V
0,0.457
V
0,1.654
V
0,0.913
V
0,1.284
V
0,1.695
V
0,0.333
V
0,0.260
V
0,-0.145
V
0,0.053
V
0,0.492
V
0,0.092
V
0,0.984
V
0,0.538
V
0,0.575
V
0,0.824
V
0,0.214
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,63
V
1,0
"2-bromopentane"
0,151.046
V
0,117
V
0,1.440
V
0,1.223
V
0,3.07
V
0,0.0017
V
0,0.0033
V
0,151
V
0,93
V
0,25.36
V
0,68.86
V
0,89.12
V
0,8.47
V
0,3.12
V
0,2.41
V
0,267
V
0,2.57
V
0,1.24
V
0,32.59
V
0,3.96
V
0,7.00
V
0,5.73
V
0,436
V
0,9.4
V
0,141
V
0,13.19
V
0,-1146.2
V
0,-30.87
V
0,0.7451
V
0,-10.6381
V
0,1.762
V
0,0.122
V
0,0.069
V
0,0.680
V
0,-0.100
V
0,-0.437
V
0,-0.620
V
0,-0.517
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.406
V
0,-0.429
V
0,-0.174
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-0.847
V
0,-0.591
V
0,-0.504
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.484
V
0,-0.505
V
0,-0.488
V
0,-0.950
V
0,-1.241
V
0,-0.746
V
0,-0.023
V
0,-0.121
V
0,-0.492
V
0,-0.434
V
0,-0.382
V
0,-0.012
V
0,-0.063
V
0,-0.079
V
0,-0.244
V
0,0.172
V
0,-0.202
V
0,0.267
V
0,-0.171
V
0,-0.283
V
0,0.826
V
0,1.587
V
0,-0.381
V
0,-0.392
V
0,-0.465
V
0,-0.262
V
0,0.072
V
0,3.781
V
0,-0.754
V
0,3.781
V
0,1.954
V
0,0.959
V
0,0.053
V
0,-0.065
V
0,0.840
V
0,0.457
V
0,1.573
V
0,0.913
V
0,1.243
V
0,1.694
V
0,0.334
V
0,0.260
V
0,-0.145
V
0,0.049
V
0,0.492
V
0,0.088
V
0,0.984
V
0,0.536
V
0,0.574
V
0,0.824
V
0,0.214
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,64
V
1,0
"2-iodobutane"
0,184.019
V
0,120
V
0,1.499
V
0,1.598
V
0,2.99
V
0,0.0021
V
0,0.0035
V
0,184
V
0,87
V
0,21.71
V
0,47.52
V
0,65.65
V
0,6.09
V
0,2.78
V
0,2.01
V
0,143
V
0,2.58
V
0,1.91
V
0,33.33
V
0,3.37
V
0,5.75
V
0,5.30
V
0,259
V
0,7.9
V
0,131
V
0,14.93
V
0,-984.3
V
0,-11.53
V
0,0.4227
V
0,-10.3693
V
0,1.595
V
0,-0.101
V
0,-0.168
V
0,0.567
V
0,-0.410
V
0,-0.331
V
0,-0.490
V
0,-0.522
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.412
V
0,-0.358
V
0,0.324
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-0.317
V
0,-0.420
V
0,-0.508
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.521
V
0,-0.511
V
0,-0.530
V
0,-0.294
V
0,-1.241
V
0,-0.036
V
0,-0.255
V
0,-0.280
V
0,-0.827
V
0,-0.633
V
0,-0.666
V
0,-0.434
V
0,-0.563
V
0,-0.373
V
0,-0.385
V
0,-0.078
V
0,-0.628
V
0,-0.430
V
0,-0.942
V
0,-0.807
V
0,-0.362
V
0,1.823
V
0,-0.381
V
0,-0.392
V
0,-0.664
V
0,-0.262
V
0,0.186
V
0,2.822
V
0,-0.425
V
0,2.822
V
0,2.091
V
0,0.962
V
0,0.056
V
0,0.035
V
0,0.916
V
0,0.514
V
0,1.780
V
0,1.027
V
0,1.403
V
0,1.924
V
0,0.423
V
0,0.280
V
0,-0.240
V
0,0.025
V
0,0.451
V
0,0.061
V
0,0.902
V
0,0.481
V
0,0.627
V
0,0.833
V
0,0.218
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,65
V
1,0
"1,1-dichloroethane"
0,98.960
V
0,57
V
0,1.417
V
0,1.177
V
0,1.76
V
0,0.0560
V
0,0.0556
V
0,99
V
0,65
V
0,12.96
V
0,26.01
V
0,36.70
V
0,5.05
V
0,2.52
V
0,1.78
V
0,95
V
0,1.16
V
0,0.99
V
0,21.28
V
0,2.13
V
0,3.25
V
0,4.02
V
0,58
V
0,6.0
V
0,102
V
0,6.36
V
0,-1059.3
V
0,-31.09
V
0,0.5766
V
0,-11.4323
V
0,1.864
V
0,-0.719
V
0,-0.654
V
0,-1.229
V
0,-0.384
V
0,-1.005
V
0,-0.887
V
0,-0.522
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.487
V
0,-0.437
V
0,0.512
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-0.638
V
0,-0.675
V
0,-0.507
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.522
V
0,-0.570
V
0,-0.569
V
0,0.907
V
0,0.914
V
0,-0.982
V
0,-0.237
V
0,-0.745
V
0,-0.410
V
0,-0.290
V
0,-0.240
V
0,-0.467
V
0,-0.313
V
0,-0.300
V
0,-0.370
V
0,-0.267
V
0,-0.169
V
0,0.395
V
0,0.361
V
0,1.569
V
0,1.381
V
0,1.834
V
0,-0.381
V
0,-0.392
V
0,-0.604
V
0,-0.262
V
0,-0.792
V
0,1.238
V
0,-0.582
V
0,1.238
V
0,1.758
V
0,0.969
V
0,0.003
V
0,-0.088
V
0,0.353
V
0,0.250
V
0,0.788
V
0,0.482
V
0,0.635
V
0,1.174
V
0,0.320
V
0,0.217
V
0,-0.031
V
0,0.110
V
0,0.462
V
0,0.153
V
0,0.958
V
0,0.556
V
0,0.453
V
0,1.059
V
0,0.222
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,66
V
1,0
"1,1-dichloropropane"
0,112.986
V
0,88
V
0,1.428
V
0,1.130
V
0,2.25
V
0,0.0151
V
0,0.0160
V
0,113
V
0,80
V
0,23.02
V
0,35.52
V
0,55.39
V
0,4.25
V
0,2.75
V
0,1.77
V
0,87
V
0,1.73
V
0,0.95
V
0,25.75
V
0,3.12
V
0,4.50
V
0,4.75
V
0,136
V
0,7.5
V
0,116
V
0,8.60
V
0,-1215.1
V
0,-37.41
V
0,0.6103
V
0,-11.3433
V
0,1.929
V
0,-0.384
V
0,-0.395
V
0,-0.156
V
0,-0.444
V
0,-0.690
V
0,-0.735
V
0,-0.522
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.447
V
0,-0.417
V
0,0.512
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-0.532
V
0,-0.586
V
0,-0.508
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.501
V
0,-0.537
V
0,-0.525
V
0,-1.100
V
0,1.287
V
0,1.369
V
0,0.000
V
0,-0.456
V
0,-0.263
V
0,-0.135
V
0,0.064
V
0,-0.174
V
0,-0.213
V
0,-0.226
V
0,-0.288
V
0,-0.384
V
0,0.120
V
0,0.673
V
0,-0.071
V
0,0.509
V
0,0.993
V
0,1.834
V
0,-0.381
V
0,-0.392
V
0,-1.055
V
0,-0.262
V
0,-0.421
V
0,2.258
V
0,-0.610
V
0,2.258
V
0,1.759
V
0,0.970
V
0,0.004
V
0,-0.087
V
0,0.326
V
0,0.242
V
0,0.716
V
0,0.472
V
0,0.594
V
0,1.183
V
0,0.315
V
0,0.218
V
0,-0.031
V
0,0.117
V
0,0.460
V
0,0.161
V
0,0.954
V
0,0.558
V
0,0.464
V
0,1.052
V
0,0.223
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,67
V
1,0
"1,2-dichloropropane"
0,112.986
V
0,96
V
0,1.439
V
0,1.156
V
0,2.25
V
0,0.0151
V
0,0.0160
V
0,113
V
0,79
V
0,12.22
V
0,57.08
V
0,66.12
V
0,11.03
V
0,2.36
V
0,2.04
V
0,223
V
0,2.00
V
0,0.38
V
0,25.07
V
0,3.12
V
0,4.50
V
0,4.75
V
0,136
V
0,7.5
V
0,117
V
0,8.66
V
0,-1215.2
V
0,-38.57
V
0,0.6767
V
0,-11.3814
V
0,0.504
V
0,-0.378
V
0,-0.400
V
0,-0.064
V
0,-0.495
V
0,-0.671
V
0,-0.730
V
0,-0.524
V
0,-0.493
V
0,-0.479
V
0,-0.457
V
0,-0.406
V
0,-0.311
V
0,-0.546
V
0,-0.496
V
0,-0.746
V
0,-0.533
V
0,-0.509
V
0,-0.507
V
0,-0.467
V
0,-0.324
V
0,-0.489
V
0,-0.580
V
0,-0.509
V
0,-0.484
V
0,-0.472
V
0,-0.451
V
0,-0.401
V
0,-0.312
V
0,-0.530
V
0,-0.519
V
0,-0.543
V
0,-0.950
V
0,1.213
V
0,1.332
V
0,0.039
V
0,-0.498
V
0,-0.081
V
0,-0.412
V
0,-0.281
V
0,-0.532
V
0,-0.363
V
0,-0.447
V
0,-0.607
V
0,-0.461
V
0,-0.415
V
0,-0.179
V
0,-0.988
V
0,-0.307
V
0,0.332
V
0,-0.736
V
0,-0.381
V
0,-0.392
V
0,-0.163
V
0,-0.262
V
0,-0.421
V
0,4.804
V
0,-0.682
V
0,4.804
V
0,1.775
V
0,0.952
V
0,0.037
V
0,-0.121
V
0,0.361
V
0,0.269
V
0,0.668
V
0,0.525
V
0,0.596
V
0,1.218
V
0,0.289
V
0,0.219
V
0,-0.063
V
0,0.096
V
0,0.283
V
0,0.139
V
0,0.564
V
0,0.351
V
0,0.500
V
0,0.853
V
0,0.211
V
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
1,0
""
-1,0
BOT
0,68
V
1,0
"1,1-dichlorobutane"
0,127.013
V
0,114
V
0,1.436
V
0,1.086
V
0,2.74
V
0,0.0041
V
0,0.0046
V
0,127
V
0,90
V
0,26.45
V
0,65.40
V
0,87.51
V
0,5.63
V
0,2.28
V
0,1.70
V
0,91
V
0,2.13
V
0,1.09
V
0,30.35
V
0,4.12
V
0,5.7