0 B4R0.1 C#CC(=O)O MC428031 [0,0,0,0,0,0|3,0,1]=4 1 B4R0.1 C=CC(N)=O MC41857 [0,0,0,0,0,0|3,0,0]=3 2 B4R0.1 CC(=O)CBr MC20986 [0,0,0,0,0,0|2,1,1]=4 3 B4R0.1 CC(=O)CN CS10921 [0,0,0,0,0,0|3,0,1]=4 4 B4R0.1 CC(=O)CO CS11467 [0,0,0,0,0,0|3,0,1]=4 5 B4R0.1 CC(=O)NN CS10881 [0,0,0,0,0,0|4,0,0]=4 6 B4R0.1 CC(=O)NO CS14961 [0,0,0,0,0,0|4,0,0]=4 7 B4R0.1 CC(C)=NO CS10884 [0,0,0,0,0,0|4,0,0]=4 8 B4R0.1 CC(Cl)CO CS20251 [0,0,0,0,0,0|2,0,2]=4 9 B4R0.1 CC(Cl)CO MC428270 [0,0,0,0,0,0|2,0,2]=4 10 B4R0.1 CC(O)CCl MC20696 [0,0,0,0,0,0|2,0,2]=4 11 B4R0.1 CC(O)CCl MC20697 [0,0,0,0,0,0|2,0,2]=4 12 B4R0.1 CCC(N)=O CS11886 [0,0,0,0,0,0|3,0,1]=4 13 B4R0.1 CNC(N)=O MC10792 [0,0,0,0,0,0|4,0,0]=4 14 B4R0.1 CNC(N)=S CS11797 [0,0,0,0,0,0|4,0,0]=4 15 B4R0.1 COC(N)=O CS11667 [0,0,0,0,0,0|4,0,0]=4 16 B4R0.1 COC(N)=[NH2+] CS11820 [0,0,0,0,0,0|4,0,0]=4 17 B4R0.1 CSC(=N)N MC41956 [0,0,0,0,0,0|4,0,0]=4 18 B4R0.1 C\C(N)=N\O CS10879 [0,0,0,0,0,0|4,0,0]=4 19 B4R0.1 C\C=C(/C)Br MC10255 [0,0,0,0,0,0|2,1,0]=3 20 B4R0.1 NC(=O)CBr CS21389 [0,0,0,0,0,0|2,1,1]=4 21 B4R0.1 NCC(=O)O CS19951 [0,0,0,0,0,0|3,0,1]=4 22 B4R0.1 NCC(=O)[O-] CS10910 [0,0,0,0,0,0|3,0,1]=4 23 B4R0.1 NCC(=O)[O-] MC20522 [0,0,0,0,0,0|3,0,1]=4 24 B4R0.1 NCC(N)=O CS13806 [0,0,0,0,0,0|3,0,1]=4 25 B4R0.1 NCC(N)=O MC437712 [0,0,0,0,0,0|3,0,1]=4 26 B4R0.1 NNC(N)=O CS11949 [0,0,0,0,0,0|4,0,0]=4 27 B4R0.1 O=C(Cl)CBr MC21000 [0,0,0,0,0,0|1,1,1]=3 28 B4R0.1 O=C(O)CCl MC41871 [0,0,0,0,0,0|2,0,1]=3 29 B4R0.1 O=C(O)CO CS19334 [0,0,0,0,0,0|3,0,1]=4 30 B4R0.1 O=C([O-])CCl MC41872 [0,0,0,0,0,0|2,0,1]=3 31 B4R0.1 ON=C(Br)Br CS18455 [0,0,0,0,0,0|2,2,0]=4 32 B3R0.1 C=CCBr MC41858 [1,0,0,0,0,0|1,1,1]=4 33 B3R0.1 C=C[Mg]Br MC10627 [1,0,0,0,0,0|2,1,0]=4 34 B3R0.1 COCCl MC41874 [1,0,0,0,0,0|2,0,1]=4 35 B3R0.1 C\C=C\C MC428373 [1,0,0,0,0,0|2,0,0]=3 36 B3R0.1 Cl\C=C\Cl MC41969 [1,0,0,0,0,0|0,0,0]=1 37 B3R0.1 N#CCCl MC41870 [1,0,0,0,0,0|1,0,2]=4 38 B3R0.1 NCCCl CS16188 [1,0,0,0,0,0|1,0,2]=4 39 B3R0.2 C=C(C)Br MC440274 [1,0,0,0,0,0|1,1,0]=3 40 B3R0.2 CC(=O)Cl MC40433 [1,0,0,0,0,0|1,0,1]=3 41 B3R0.2 CC(=O)O CS19761 [1,0,0,0,0,0|2,0,1]=4 42 B3R0.2 CC(=O)[O-] CS11168 [1,0,0,0,0,0|2,0,1]=4 43 B3R0.2 CC(=O)[O-] CS11832 [1,0,0,0,0,0|2,0,1]=4 44 B3R0.2 CC(=O)[O-] MC41921 [1,0,0,0,0,0|2,0,1]=4 45 B3R0.2 CC(N)=O MC40849 [1,0,0,0,0,0|2,0,1]=4 46 B3R0.2 CC(O)=S MC434055 [1,0,0,0,0,0|2,0,1]=4 47 B3R0.2 Cl[Ru](Cl)Cl CS11937 [1,0,0,0,0,0|1,0,0]=2 48 B3R0.2 Cl[Ru](Cl)Cl CS11938 [1,0,0,0,0,0|1,0,0]=2 49 B3R0.2 N=C(N)N CS19174 [1,0,0,0,0,0|3,0,0]=4 50 B3R0.2 NC(N)=S CS12023 [1,0,0,0,0,0|3,0,0]=4 51 B3R0.2 O=C([O-])[O-] CS11119 [1,0,0,0,0,0|3,0,0]=4 52 B5R0.1 C=C(Cl)C[Zn]Cl MC116066 [0,1,0,0,0,0|1,0,1]=3 53 B5R0.1 C=C(Cl)C[Zn]Cl MC116067 [0,1,0,0,0,0|1,0,1]=3 54 B5R0.1 CC(=O)\C=N\O CS11520 [0,1,0,0,0,0|3,0,0]=4 55 B5R0.1 CC(=O)\C=N\O CS18968 [0,1,0,0,0,0|3,0,0]=4 56 B5R0.1 CC(C)=CCBr MC41900 [0,1,0,0,0,0|2,1,0]=4 57 B5R0.1 COCC(=O)Cl MC40491 [0,1,0,0,0,0|2,0,1]=4 58 B5R0.1 CSCC(=O)Cl MC106201 [0,1,0,0,0,0|2,0,1]=4 59 B5R0.1 C\C=C\C(=O)O MC41882 [0,1,0,0,0,0|3,0,0]=4 60 B5R0.3 CNC(=O)CCl MC21094 [0,1,0,0,0,0|2,0,1]=4 61 B5R0.3 O=CC(=O)CO MC427604 [0,1,0,0,0,0|3,0,0]=4 62 B5R0.3 OC(CCl)CCl MC428012 [0,1,0,0,0,0|1,0,2]=4 63 B5R0.4 N#CC(Cl)(Cl)Cl MC41946 [0,1,0,0,0,0|1,0,2]=4 64 B5R0.4 O=CC(Cl)(Cl)Cl MC41957 [0,1,0,0,0,0|1,0,1]=3 65 B5R0.5 CC(=O)C(=O)O MC41939 [0,1,0,0,0,0|3,0,0]=4 66 B5R0.5 CC(C)C(=O)Cl MC40490 [0,1,0,0,0,0|2,0,1]=4 67 B5R0.5 CC(Cl)C(=O)O MC20315 [0,1,0,0,0,0|2,0,1]=4 68 B5R0.5 CC(Cl)C(=O)O MC436860 [0,1,0,0,0,0|2,0,1]=4 69 B5R0.5 CN(C)C(=O)Cl MC428263 [0,1,0,0,0,0|3,0,0]=4 70 B5R0.5 NC(=O)C(N)=O MC20822 [0,1,0,0,0,0|3,0,0]=4 71 B5R0.5 O=C(O)C(=O)O CS11387 [0,1,0,0,0,0|3,0,0]=4 72 B5R0.5 O=C(O)C(=O)O MC425345 [0,1,0,0,0,0|3,0,0]=4 73 B5R0.5 O=C([O-])C(=O)[O-] MC114602 [0,1,0,0,0,0|3,0,0]=4 74 B5R0.5 O=C([O-])C(Cl)Cl MC21032 [0,1,0,0,0,0|1,0,1]=3 75 B2R0.1 Cl[PbH2]Cl MC440711 [2,0,0,0,0,0|1,0,0]=3 76 B4R0.2 C=CC[Pd]Cl MC444917 [1,1,0,0,0,0|1,0,1]=4 77 B4R0.2 C\C=C\C=O MC41879 [1,1,0,0,0,0|2,0,0]=4 78 B4R0.3 CP(=O)(Cl)Cl MC444881 [1,1,0,0,0,0|1,0,1]=4 79 B4R0.3 Cl[Au-](Cl)(Cl)Cl MC21152 [1,1,0,0,0,0|1,0,0]=3 80 B6R0.4 CC(C)=CC[Mg]Cl MC116049 [0,2,0,0,0,0|2,0,0]=4 81 B6R0.4 CC(C)=CC[Zn]Cl MC116080 [0,2,0,0,0,0|2,0,0]=4 82 B6R0.4 O=C(Cl)CCCCl MC40450 [0,2,0,0,0,0|1,0,1]=4 83 B6R0.7 O=C(Cl)C(Cl)(Cl)Cl MC40501 [0,2,0,0,0,0|0,0,1]=3 84 B4R1.2 CC1=CC1 MC20873 [1,0,0,1,0,0|2,0,0]=4 85 B6R1.2 ClC1=CC=NN1 CS16937 [0,1,0,1,0,0|2,0,0]=4 86 B6R1.2 ClC1=CN=CN1 CS10347 [0,1,0,1,0,0|2,0,0]=4 87 B6R1.2 ClC1=CNN=C1 CS18764 [0,1,0,1,0,0|2,0,0]=4 88 B6R1.2 ClC1=CSC=N1 CS14317 [0,1,0,1,0,0|2,0,0]=4 89 B6R1.2 ClC1=NC=CO1 MC106420 [0,1,0,1,0,0|2,0,0]=4 90 B6R1.2 ClC1=NC=NS1 CS13994 [0,1,0,1,0,0|2,0,0]=4 91 B6R1.2 ClC1=NN=CN1 CS18465 [0,1,0,1,0,0|2,0,0]=4 92 B6R1.2 ClC1=NNC=C1 MC103128 [0,1,0,1,0,0|2,0,0]=4 93 B6R1.2 ClC1=NNC=N1 CS13947 [0,1,0,1,0,0|2,0,0]=4