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inchikey_skeleton
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FHCSBLWRGCOVPT
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FIHJKUPKCHIPAT
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FINHMKGKINIASC
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FNHKPVJBJVTLMP
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FPOHNWQLNRZRFC
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GHASVSINZRGABV
1.766987
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GKHIVNAUVKXIIY
0.319069
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GKTWGGQPFAXNFI
2.25355
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0.01419
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GPXBXXGIAQBQNI
1.986442
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3.302252
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1.19936
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2.525185
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1.096918
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1.869634
HYWYRSMBCFDLJT
0.303042
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0.335249
0.391107
0.695131
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IECPWNUMDGFDKC
2.486736
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-0.936939
-1.346659
0.047917
0.598458
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0.794729
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1.573942
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0.424762
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1.384697
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1.212211
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IMBXEJJVJRTNOW
0.057844
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0.06823
0.177127
0.878226
1.46138
0.196694
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0.13858
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0.249202
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IPWKIXLWTCNBKN
0.287893
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0.038048
0.765796
0.488731
-0.18318
0.090246
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0.403774
0.212284
0.43025
0.149582
0.06986
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0.660099
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0.1358
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0.258095
0.197796
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0.292454
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0.012195
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0.637703
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0.323182
0.3567
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0.019089
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0.174271
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0.133391
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0.284714
0.180254
0.020695
0.281671
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0.294217
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0.019112
0.416072
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0.242418
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0.276945
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0.053042
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0.129655
0.134451
0.053692
IVTVGDXNLFLDRM
2.620964
-1.13435
-0.346152
-1.037038
-0.344652
0.272224
0.561237
-0.629793
-0.13433
0.599897
0.190274
-0.05214
-0.685996
-1.785632
-0.564393
0.308956
-3.170807
2.482728
0.16159
0.593757
-0.463299
-0.102867
0.299688
-1.349958
0.270615
0.641661
-1.250318
0.317934
-0.095754
-0.017865
0.05323
0.043544
-0.401922
0.12545
0.137076
0.697578
1.069354
0.035031
2.209626
0.437228
0.480759
-0.758366
-0.027282
0.235673
1.743595
-0.414317
-0.031396
-0.112933
0.401437
0.937936
0.156054
0.452662
-0.645581
-0.695804
-1.170453
-0.752358
0.284708
0.521524
-0.519305
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1.092546
0.154156
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0.156723
0.619592
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0.071752
0.252151
0.582498
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0.167506
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0.924935
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1.102973
-0.23655
1.19464
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1.115669
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0.225148
0.373545
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0.35989
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0.957833
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0.118692
0.75632
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0.303581
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0.931305
0.562805
JDUBGYFRJFOXQC
0.73534
-1.333236
-0.655511
-1.131953
0.475914
0.629476
-0.04123
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-0.051904
0.296672
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0.801074
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0.543053
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0.203457
1.046483
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0.819768
-1.315462
0.592053
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0.299063
0.250266
-0.154584
0.733815
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0.198849
0.111027
0.453945
0.262368
0.621931
0.310886
0.124608
-0.178597
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0.229397
0.015633
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0.262999
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0.030798
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0.026067
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0.185147
0.111266
0.335981
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0.508704
0.329667
1.143428
0.845658
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0.338468
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1.088603
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0.231944
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0.824343
0.095049
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0.46897
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0.443044
0.306992
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0.363968
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0.012697
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0.110343
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0.447226
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0.017865
0.74314
JGCMEBMXRHSZKX
0.284971
-1.134255
-0.732574
-0.752189
-0.064055
0.600967
0.126451
-0.119037
0.259276
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0.043553
0.490363
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0.284615
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0.695141
0.247244
-0.072945
0.365154
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0.534078
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0.115614
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0.236394
0.070481
0.31511
-0.169173
0.299213
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0.258407
0.167394
0.582518
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0.450594
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0.26405
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0.24311
0.563361
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0.145356
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0.329951
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0.068865
0.066556
0.304311
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0.122368
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0.247475
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0.40517
0.211535
0.412463
0.40813
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0.478718
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0.13706
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0.540546
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0.204271
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0.113845
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0.028615
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0.341155
0.224448
0.094722
0.75192
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0.167573
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0.050786
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0.191259
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0.289283
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0.050718
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0.330483
0.191529
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0.569398
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0.089875
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0.11235
0.105663
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0.144428
0.038371
0.230033
0.147468
0.135104
-0.023165
-0.206823
0.051087
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