1 files changed, 54 insertions, 0 deletions
diff --git a/test/data/input_53.tsv b/test/data/input_53.tsv
new file mode 100644
index 0000000..c46fdd4
--- /dev/null
+++ b/test/data/input_53.tsv
@@ -0,0 +1,54 @@
+Id	Smiles
+123-30-8	Oc1ccc(N)cc1
+68391-25-3	OC(COc1ccccc1)CNc2ccc(cc2)Cc3ccc(N)cc3
+62-53-3	Nc1ccccc1
+123-98-8	O=C(CCCCCCCC(=O)Cl)Cl
+106-51-4	O=C1C=CC(=O)C=C1
+7144-65-2	O(c1ccccc1c2ccccc2)CC3OC3
+3130-19-6	O=C(OCC1CCC2OC2(C1))CCCCC(=O)OCC3CCC4OC4(C3)
+140-95-4	O=C(NCO)NCO
+2778-42-9	O=C=NC(c1cccc(c1)C(N=C=O)(C)C)(C)C
+593-60-2	C=CBr
+75-25-2	C(Br)(Br)Br
+1852-16-0	O=C(C=C)NCOCCCC
+107-58-4	O=C(C=C)NC(C)(C)C
+592-35-8	O=C(OCCCC)N
+2426-08-6	O(CCCC)CC1OC1
+79-07-2	O=C(N)CCl
+110-75-8	O(C=C)CCCl
+67-66-3	C(Cl)(Cl)Cl
+26172-55-4	O=C1C=C(Cl)SN1C
+598-09-4	O1CC1(C)CCl
+2556-36-7	O=C=NC1CCC(N=C=O)CC1
+3271-22-5	n1c(nc(nc1OC)c2ccc3ccc4cccc5ccc2c3c45)OC
+2680-03-7	O=C(C=C)N(C)C
+13036-41-4	O=C(C=C)NCOCC
+556-52-5	OCC1OC1
+2530-83-8	O(CCC[Si](OC)(OC)OC)CC1OC1
+106-90-1	O=C(OCC1OC1)C=C
+26761-45-5	O=C(OCC1OC1)C(C)(C)CCCCCC
+122-60-1	O(c1ccccc1)CC2OC2
+2210-79-9	O(c1ccccc1C)CC2OC2
+2461-15-6	O(CC1OC1)CC(CC)CCCC
+75-02-5	FC=C
+98-01-1	O=Cc1occc1
+111-30-8	O=CCCCC=O
+107-22-2	O=CC=O
+78-84-2	O=CC(C)C
+11087-88-0	O=C(OCCCCCC(C)C)CCCCCCCC1OC1(CCCCCCCC)
+3644-11-9	O=C(C=C)NCOC
+1187-59-3	O=C(C=C)NC
+54208-63-8	O(c1ccccc1Cc3ccccc3(OCC2OC2))CC4OC4
+110-26-9	O=C(C=C)NCNC(=O)C=C
+1208-52-2	Nc1ccc(cc1)Cc2ccccc2(N)
+71033-08-4	O(c1ccc(cc1)C(c3ccc(OCC(OCC2OC2)COCCCC)cc3)(C)C)CC(OCC4OC4)COCCCC
+5165-97-9	O=C(C=C)NC(C)(C)CS(=O)(=O)O
+34813-62-2	O=C=NCCCC(C)CN=C=O
+16669-59-3	O=C(C=C)NCOCC(C)C
+80-48-8	O=S(=O)(OC)c1ccc(cc1)C
+2386-87-0	O=C(OCC1CCC2OC2(C1))C3CCC4OC4(C3)
+104-49-4	O=C=Nc1ccc(N=C=O)cc1
+103-71-9	O=C=Nc1ccccc1
+111-19-3	O=C(CCCCCCCCC(=O)Cl)Cl
+7320-37-8	O1CC1CCCCCCCCCCCCCC
+2451-62-9	O=C1N(C(=O)N(C(=O)N1CC2OC2)CC3OC3)CC4OC4