diff --git "a/synthetic_data/formula_combinations_220-230.csv" "b/synthetic_data/formula_combinations_220-230.csv"
new file mode 100644--- /dev/null
+++ "b/synthetic_data/formula_combinations_220-230.csv"
@@ -0,0 +1,12754 @@
+Formula,Mass_Daltons
+C8H3O5N3,220.0000
+CH11O2S3N5,220.0003
+CH3O3SN9,220.0007
+C2H9O8SN2,220.0007
+C10H5O6,220.0014
+C3H13O3S3N2,220.0016
+C3H5O4SN6,220.0021
+C11H9OS2,220.0023
+C11HO2N4,220.0027
+C5H7O5SN3,220.0034
+C13H3O3N,220.0041
+C6H3OSN7,220.0048
+C7H9O6S,220.0048
+C8H13OS3,220.0056
+CH7O10N3,220.0059
+C8H5O2SN4,220.0061
+C2H11O5S2N3,220.0068
+C2H3O6N7,220.0073
+C3H9O11,220.0073
+C10H7O3SN,220.0074
+C3H7OS2N7,220.0081
+C4H13O6S2,220.0081
+C4H5O7N4,220.0086
+C5H17OS4,220.0090
+C5H9O2S2N4,220.0095
+C5HO3N8,220.0099
+C6H7O8N,220.0099
+C7H11O3S2N,220.0108
+C7H3O4N5,220.0113
+CH17O6S3,220.0115
+CH9O7SN4,220.0120
+C2H21OS5,220.0124
+C9H5O5N2,220.0126
+C2H13O2S3N4,220.0128
+C2H5O3SN8,220.0133
+C3H11O8SN,220.0133
+C10HON6,220.0140
+C4H15O3S3N,220.0142
+C4H7O4SN5,220.0146
+C12H3O2N3,220.0153
+C6H9O5SN2,220.0160
+C14H5O3,220.0166
+C7H5OSN6,220.0173
+CH19O3S4N,220.0176
+CH11O4S2N5,220.0180
+CH3O5N9,220.0185
+C2H9O10N2,220.0185
+C9H7O2SN3,220.0187
+C3H13O5S2N2,220.0194
+C3H5O6N6,220.0198
+C11H9O3S,220.0200
+C4H9OS2N6,220.0207
+C4HO2N10,220.0212
+C5H7O7N3,220.0212
+C6H11O2S2N3,220.0220
+C6H3O3N7,220.0225
+C7H9O8,220.0225
+C8H13O3S2,220.0234
+C8H5O4N4,220.0239
+CH13OS3N6,220.0241
+CH5O2SN10,220.0245
+C2H11O7SN3,220.0245
+C10H7O5N,220.0252
+C3H15O2S3N3,220.0254
+C3H7O3SN7,220.0259
+C4H13O8S,220.0259
+C11H3ON5,220.0265
+C5H17O3S3,220.0268
+C5H9O4SN4,220.0272
+C13H5O2N2,220.0279
+C7H11O5SN,220.0286
+CH17O8S2,220.0293
+CH9O9N4,220.0297
+C8H7OSN5,220.0299
+C2H21O3S4,220.0301
+C2H13O4S2N4,220.0306
+C2H5O5N8,220.0311
+C3H11O10N,220.0311
+C10H9O2SN2,220.0312
+C4H15O5S2N,220.0319
+C3HON12,220.0324
+C4H7O6N5,220.0324
+C5H11OS2N5,220.0333
+C5H3O2N9,220.0337
+C6H9O7N2,220.0338
+C7H13O2S2N2,220.0346
+C7H5O3N6,220.0351
+CH19O5S3N,220.0353
+CH11O6SN5,220.0358
+C9H7O4N3,220.0364
+C2H15OS3N5,220.0366
+C2H7O2SN9,220.0371
+C3H13O7SN2,220.0371
+C11H9O5,220.0378
+C4H17O2S3N2,220.0380
+C4H9O3SN6,220.0385
+C12H5ON4,220.0391
+C6H11O4SN3,220.0398
+C14H7O2N,220.0405
+C8H13O5S,220.0411
+CH21O2S4N2,220.0414
+CH13O3S2N6,220.0418
+CH5O4N10,220.0423
+C2H11O9N3,220.0423
+C9H9OSN4,220.0425
+C3H15O4S2N3,220.0432
+C3H7O5N7,220.0436
+C4H13O10,220.0436
+C11H11O2SN,220.0438
+C5H17O5S2,220.0445
+C4H3ON11,220.0450
+C5H9O6N4,220.0450
+C6H13OS2N4,220.0459
+C6H5O2N8,220.0463
+C7H11O7N,220.0463
+CH17O10S,220.0470
+C8H15O2S2N,220.0472
+C8H7O3N5,220.0477
+C2H21O5S3,220.0479
+CH7OSN11,220.0484
+C2H13O6SN4,220.0484
+C10H9O4N2,220.0490
+C3H17OS3N4,220.0492
+C3H9O2SN8,220.0497
+C4H15O7SN,220.0497
+C5H19O2S3N,220.0506
+C5H11O3SN5,220.0510
+C13H7ON3,220.0517
+C7H13O4SN2,220.0524
+C15H9O2,220.0530
+CH19O7S2N,220.0531
+CH11O8N5,220.0535
+C2H23O2S4N,220.0539
+C2H15O3S2N5,220.0544
+C2H7O4N9,220.0549
+C3H13O9N2,220.0549
+C10H11OSN3,220.0551
+C4H17O4S2N2,220.0557
+C4H9O5N6,220.0562
+C12H13O2S,220.0564
+C5H5ON10,220.0576
+C6H11O6N3,220.0576
+C7H15OS2N3,220.0584
+C7H7O2N7,220.0589
+C8H13O7,220.0589
+CH21O4S3N2,220.0591
+CH13O5SN6,220.0596
+C9H17O2S2,220.0598
+C9H9O3N4,220.0602
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+C11H11O4N,220.0616
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+C5H17O7S,220.0623
+C6H21O2S3,220.0631
+C6H13O3SN4,220.0636
+C14H9ON2,220.0643
+CH17O12,220.0648
+C8H15O4SN,220.0650
+CH23OS4N3,220.0652
+CH15O2S2N7,220.0656
+C2H21O7S2,220.0656
+CH7O3N11,220.0661
+C2H13O8N4,220.0661
+C3H25O2S4,220.0665
+C3H17O3S2N4,220.0670
+C3H9O4N8,220.0675
+C4H15O9N,220.0675
+C11H13OSN2,220.0676
+C5H19O4S2N,220.0683
+C5H11O5N5,220.0688
+C6H7ON9,220.0701
+C7H13O6N2,220.0701
+CH19O9SN,220.0708
+C8H17OS2N2,220.0710
+C8H9O2N6,220.0715
+C2H23O4S3N,220.0717
+C2H15O5SN5,220.0722
+C10H11O3N3,220.0728
+C3H11OSN9,220.0735
+C4H17O6SN2,220.0735
+C12H13O4,220.0742
+C5H21OS3N2,220.0744
+C5H13O2SN6,220.0748
+C7H15O3SN3,220.0762
+C15H11ON,220.0768
+CH21O6S2N2,220.0769
+CH13O7N6,220.0773
+C9H17O4S,220.0775
+C2H25OS4N2,220.0777
+C2H17O2S2N6,220.0782
+C2H9O3N10,220.0787
+C3H15O8N3,220.0787
+C4H19O3S2N3,220.0796
+C4H11O4N7,220.0800
+C5H17O9,220.0800
+C12H15OSN,220.0802
+C6H21O4S2,220.0809
+C6H13O5N4,220.0814
+C7H9ON8,220.0827
+C8H15O6N,220.0827
+CH23O3S3N3,220.0829
+CH15O4SN7,220.0834
+C2H21O9S,220.0834
+C9H19OS2N,220.0836
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+C3H25O4S3,220.0843
+C3H17O5SN4,220.0847
+C11H13O3N2,220.0854
+C4H13OSN8,220.0861
+C5H19O6SN,220.0861
+C6H23OS3N,220.0870
+C6H15O2SN5,220.0874
+CH19O11N,220.0886
+C8H17O3SN2,220.0888
+CH17OS2N8,220.0894
+C16H13O,220.0894
+C2H23O6S2N,220.0895
+CH9O2N12,220.0899
+C2H15O7N5,220.0899
+C3H27OS4N,220.0903
+C3H19O2S2N5,220.0908
+C3H11O3N9,220.0913
+C4H17O8N2,220.0913
+C5H21O3S2N2,220.0921
+C5H13O4N6,220.0926
+C13H17OS,220.0928
+C7H15O5N3,220.0939
+CH21O8SN2,220.0946
+C8H11ON7,220.0953
+C9H17O6,220.0953
+C2H25O3S3N2,220.0955
+C2H17O4SN6,220.0960
+C10H21OS2,220.0962
+C10H13O2N4,220.0966
+C4H19O5SN3,220.0973
+C12H15O3N,220.0980
+C5H15OSN7,220.0987
+C6H21O6S,220.0987
+C7H25OS3,220.0995
+C7H17O2SN4,220.1000
+CH23O5S2N3,220.1007
+CH15O6N7,220.1012
+C2H21O11,220.1012
+C9H19O3SN,220.1013
+C2H19OS2N7,220.1020
+C3H25O6S2,220.1020
+C2H11O2N11,220.1025
+C3H17O7N4,220.1025
+C4H29OS4,220.1029
+C4H21O2S2N4,220.1034
+C4H13O3N8,220.1038
+C5H19O8N,220.1038
+C6H23O3S2N,220.1047
+C6H15O4N5,220.1052
+CH33OS5,220.1063
+C8H17O5N2,220.1065
+CH25O2S3N4,220.1067
+CH17O3SN8,220.1072
+C2H23O8SN,220.1072
+C9H13ON6,220.1079
+C3H27O3S3N,220.1081
+C3H19O4SN5,220.1086
+C11H15O2N3,220.1092
+C5H21O5SN2,220.1099
+C13H17O3,220.1105
+C6H17OSN6,220.1112
+CH21O10N2,220.1124
+C8H19O2SN3,220.1126
+C2H25O5S2N2,220.1133
+CH11ON13,220.1137
+C2H17O6N6,220.1137
+C10H21O3S,220.1139
+C3H21OS2N6,220.1146
+C3H13O2N10,220.1151
+C4H19O7N3,220.1151
+C5H23O2S2N3,220.1159
+C5H15O3N7,220.1164
+C6H21O8,220.1164
+C7H25O3S2,220.1173
+C7H17O4N4,220.1178
+CH23O7SN3,220.1184
+C9H19O5N,220.1191
+C2H27O2S3N3,220.1193
+C2H19O3SN7,220.1198
+C3H25O8S,220.1198
+C10H15ON5,220.1204
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+C4H21O4SN4,220.1211
+C12H17O2N2,220.1218
+C6H23O5SN,220.1225
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+CH33O3S4,220.1240
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+CH17O5N8,220.1250
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+C3H27O5S2N,220.1258
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+CH27OS3N5,220.1305
+CH19O2SN9,220.1310
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+C11H17ON4,220.1330
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+C13H19O2N,220.1344
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+CH33O5S3,220.1418
+CH25O6SN4,220.1423
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+CH19O4N9,220.1488
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