diff --git "a/data/sepidermidis_test.json" "b/data/sepidermidis_test.json"
new file mode 100644--- /dev/null
+++ "b/data/sepidermidis_test.json"
@@ -0,0 +1 @@
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{"compound_id": "LB-6BF41D755FF1", "smiles": "O=C(O)c1ccc(-n2cc(CNc3ccc(Br)c(C(F)(F)F)c3)c(-c3ccc(F)c(F)c3)n2)cc1"}, {"compound_id": "LB-23D9E205AF8B", "smiles": "O=C(O)c1ccc(-n2cc(CNc3cc(F)cc(C(F)(F)F)c3)c(-c3ccc(F)c(F)c3)n2)cc1"}, {"compound_id": "LB-5AC6EEADE60A", "smiles": "O=C(O)c1ccc(-n2cc(CNc3cc(Cl)cc(C(F)(F)F)c3)c(-c3ccc(F)c(F)c3)n2)cc1"}, {"compound_id": "LB-CB5019055ECE", "smiles": "O=C(O)c1ccc(-n2cc(CNc3cc(Br)cc(C(F)(F)F)c3)c(-c3ccc(F)c(F)c3)n2)cc1"}, {"compound_id": "LB-63797591E357", "smiles": "O=C(O)c1ccc(-n2cc(CNc3cc(C(F)(F)F)cc(C(F)(F)F)c3)c(-c3ccc(F)c(F)c3)n2)cc1"}, {"compound_id": "LB-79E4AB1D90EB", "smiles": "O=C(O)c1ccc(-n2cc(CNc3cc(F)c(F)c(F)c3)c(-c3ccc(F)c(F)c3)n2)cc1"}, {"compound_id": "LB-C1D4BC737375", "smiles": "O=C(O)c1ccc(-n2cc(CNc3ccc(F)c(Cl)c3F)c(-c3ccc(F)c(F)c3)n2)cc1"}, {"compound_id": "LB-945F5FC405EA", "smiles": "O=C(O)c1ccc(-n2cc(CNc3cc(Cl)c(F)c(Cl)c3)c(-c3ccc(F)c(F)c3)n2)cc1"}, {"compound_id": "LB-63D79661DEEF", "smiles": "Nc1nc(N)c2c(ccc3c2ccn3Cc2cccc3ccccc23)n1"}, {"compound_id": "LB-DDAC45A12AEF", "smiles": "Nc1nc(N)c2c(ccc3c2ccn3Cc2cccc3cccnc23)n1"}, {"compound_id": "LB-770ED421B17E", "smiles": "Nc1nc(N)c2c(ccc3c2ccn3Cc2ccc3ccccc3c2)n1"}, {"compound_id": "LB-EBE111ECDA6F", "smiles": "Nc1nc(N)c2c(ccc3c2ccn3Cc2ccc3ccccc3n2)n1"}, {"compound_id": "LB-4662DEC720EE", "smiles": "COC(=O)c1ccc2nc(Cn3ccc4c5c(N)nc(N)nc5ccc43)ccc2c1"}, {"compound_id": "LB-750FF3C0C029", "smiles": "Nc1nc(N)c2c(ccc3c2ccn3Cc2nc3ccccc3o2)n1"}, {"compound_id": "LB-5D38110B6DFE", "smiles": "COC(=O)c1ccc2nc(Cn3ccc4c5c(N)nc(N)nc5ccc43)sc2c1"}, {"compound_id": "LB-6BD2224B3F09", "smiles": "Nc1nc(N)c2c(ccc3c2ccn3Cc2ccc(C(=O)O)c3ccccc23)n1"}, {"compound_id": "LB-8421CD00461D", "smiles": "Nc1nc(N)c2c(ccc3c2ccn3Cc2ccc3cc(C(=O)O)ccc3n2)n1"}, {"compound_id": "LB-5FB75B2CEB5E", "smiles": "Nc1nc(N)c2c(ccc3c2ccn3Cc2nc3ccc(C(=O)O)cc3s2)n1"}, {"compound_id": "LB-219FC06DC636", "smiles": "Nc1nc(N)c2c(ccc3c2ccn3Cc2ccc3sc(N)nc3c2)n1"}, {"compound_id": "LB-0B0FAEF17E31", "smiles": "Nc1nc(N)c2c(ccc3c2cc(-c2ccccc2)n3Cc2nc3ccccc3s2)n1"}, {"compound_id": "LB-ABE0130DF2F6", "smiles": "CCc1c(Cl)c(O)c(Cl)c(O)c1C(=O)O[C@H]1[C@H](O)[C@H](OC)[C@H](OC/C2=C\\C=C\\C[C@H](O)/C(C)=C/[C@H](CC)[C@@H](O[C@@H]3OC(C)(C)[C@@H](OC(=O)C(C)C)[C@H](O)[C@@H]3O)/C(C)=C/C(C)=C/C[C@@H]([C@@H](C)O)OC2=O)O[C@@H]1C"}, {"compound_id": "LB-08A1AA98FEFB", "smiles": "Oc1ccc(-c2nc(-c3ccc(OC4CCCC4)cc3)no2)cc1"}, {"compound_id": "LB-8711F1733041", "smiles": "O=[N+]([O-])c1c[nH]c(-c2nc(-c3ccc(OC4CCCC4)cc3)no2)n1"}, {"compound_id": "LB-E952E5144913", "smiles": "CC1=CC(O)=C2C(=O)c3c(O)ccc(-c4ccc5c(c4O)C(=O)C4=C(O)C=C(C)[C@H](O)[C@]4(C)O5)c3O[C@]2(C)C1=O"}, {"compound_id": "LB-ECC78E8A3DC7", "smiles": "CC1=CC(O)=C2C(=O)c3c(ccc(-c4ccc5c(c4O)C(=O)C4=C(O)C=C(C)[C@H](O)[C@]4(C)O5)c3O)O[C@@]2(C)[C@H]1O"}, {"compound_id": "LB-EDEFA25CBCD4", "smiles": "CC1=CC(O)=C2C(=O)c3c(ccc(-c4ccc5c(c4O)C(=O)C4=C(O)C=C(C)C(=O)[C@]4(C)O5)c3O)O[C@@]2(C)C1=O"}, {"compound_id": 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\ No newline at end of file