0 B4R0.2 CCCNC HY-W250110E [0,0,0,0,0,0|2,0,0]=2 1 B4R0.2 CCCNC HY-W250110I [0,0,0,0,0,0|2,0,0]=2 2 B3R0.1 NCCS HY-77591R [1,0,0,0,0,0|2,0,0]=3 3 B3R0.1 N[13CH2][13CH2]O HY-W035903S [1,0,0,0,0,0|2,0,0]=3 4 B3R0.1 OCCO HY-Y0873 [1,0,0,0,0,0|2,0,0]=3 5 B3R0.1 OCCO HY-Y0873A3 [1,0,0,0,0,0|2,0,0]=3 6 B3R0.1 [13CH](=O)[13CH2]O HY-W779008 [1,0,0,0,0,0|2,0,1]=4 7 B5R0.1 C\C=C\C(C)=O HY-34748 [0,1,0,0,0,0|1,0,2]=4 8 B5R0.2 C=CCCCO HY-W010639 [0,1,0,0,0,0|1,0,2]=4 9 B5R0.3 CCC(O)CC HY-W087988 [0,1,0,0,0,0|1,0,0]=2 10 B5R0.3 CC[C@H](C)CO HY-W093104 [0,1,0,0,0,0|2,0,0]=3 11 B5R0.3 CC[PH](=O)CC HY-W094280 [0,1,0,0,0,0|1,0,0]=2 12 B5R0.3 OCC(Cl)CO HY-W585827 [0,1,0,0,0,0|3,0,0]=4 13 B5R0.3 OCC(O)CS HY-W010572 [0,1,0,0,0,0|3,0,0]=4 14 B5R0.3 OC[13CH](O)CO HY-B1659S2 [0,1,0,0,0,0|3,0,0]=4 15 B5R0.3 O[13CH2]C(O)[13CH2]O HY-B1659S4 [0,1,0,0,0,0|3,0,0]=4 16 B5R0.3 O[13CH2][13CH](O)[13CH2]O HY-B1659S5 [0,1,0,0,0,0|3,0,0]=4 17 B5R1.1 C1CSCN1 HY-I0144 [0,0,0,1,0,0|1,0,0]=2 18 B5R1.2 C[C@H]1CCN1 HY-35279 [0,0,0,1,0,0|1,0,0]=2 19 B2R0.1 [*]S[44*] HY-P991183 [2,0,0,0,0,0|2,0,0]=4 20 B2R0.1 [2H]OC HY-W025916 [2,0,0,0,0,0|1,1,0]=4 21 B2R0.1 [3H]CC HY-P99179 [2,0,0,0,0,0|1,0,0]=3 22 B4R0.1 CC(=O)CN HY-W004850 [1,1,0,0,0,0|1,0,1]=4 23 B4R0.1 CCB(O)O HY-W000933 [1,1,0,0,0,0|2,0,0]=4 24 B4R0.1 CSC(=N)N HY-79457 [1,1,0,0,0,0|1,0,1]=4 25 B4R0.1 C[C@H](N)CO HY-Y0837 [1,1,0,0,0,0|1,0,0]=3 26 B4R0.1 C[C@H](O)CO HY-79334 [1,1,0,0,0,0|1,0,0]=3 27 B4R0.1 [13CH3][13CH2][13C](=O)O HY-B1773AS3 [1,1,0,0,0,0|1,0,1]=4 28 B6R0.2 CC(C)NC(C)C HY-B2210 [0,2,0,0,0,0|1,0,0]=3 29 B6R0.3 CC(C)[C@@H](N)CO HY-30167 [0,2,0,0,0,0|2,0,0]=4 30 B6R0.3 CCC(=O)C(C)=O HY-W012998R [0,2,0,0,0,0|1,0,1]=4 31 B6R0.6 C#CCOCCBr HY-W190805 [0,2,0,0,0,0|0,1,1]=4 32 B6R0.6 C#CCOCCI HY-W251756 [0,2,0,0,0,0|0,1,1]=4 33 B6R0.6 NCCOCCS HY-140651 [0,2,0,0,0,0|0,1,0]=3 34 B6R0.6 NCCOCCS HY-168937D [0,2,0,0,0,0|0,1,0]=3 35 B6R0.6 OCCOCCO HY-B1952R [0,2,0,0,0,0|0,1,0]=3 36 B6R1.2 [C@H]1(F)CCNC1 HY-W004695 [0,1,0,1,0,0|1,0,0]=3 37 B6R1.6 OC[C@H]1CCN1 HY-W061628 [0,1,0,1,0,0|1,0,0]=3