0 B3R0.2 CB(O)O SY001105 [0,0,0,0,0,0|2,0,0]=2 1 B3R0.2 CC(=O)O SY001386 [0,0,0,0,0,0|1,0,1]=2 2 B3R0.2 CC(=O)O SY004125 [0,0,0,0,0,0|1,0,1]=2 3 B3R0.2 CC(=O)[O-] SY001322 [0,0,0,0,0,0|1,0,2]=3 4 B3R0.2 CC(=O)[O-] SY010327 [0,0,0,0,0,0|1,0,2]=3 5 B3R0.2 CC(=O)[O-] SY011498 [0,0,0,0,0,0|1,0,2]=3 6 B3R0.2 CC(=O)[O-] SY011745 [0,0,0,0,0,0|1,0,2]=3 7 B3R0.2 CC(=O)[O-] SY011809 [0,0,0,0,0,0|1,0,2]=3 8 B3R0.2 CC(=O)[O-] SY011846 [0,0,0,0,0,0|1,0,2]=3 9 B3R0.2 CC(=O)[O-] SY013501 [0,0,0,0,0,0|1,0,2]=3 10 B3R0.2 CC(=O)[O-] SY027391 [0,0,0,0,0,0|1,0,2]=3 11 B3R0.2 CC(=O)[O-] SY045651 [0,0,0,0,0,0|1,0,2]=3 12 B3R0.2 CC(=O)[O-] SY067119 [0,0,0,0,0,0|1,0,2]=3 13 B3R0.2 CC(=O)[O-] SY256925 [0,0,0,0,0,0|1,0,2]=3 14 B3R0.2 CC(=O)[O-] SY257453 [0,0,0,0,0,0|1,0,2]=3 15 B3R0.2 CC(C)N SY107348 [0,0,0,0,0,0|1,0,0]=1 16 B3R0.2 CN(C)C SY010907 [0,0,0,0,0,0|2,0,0]=2 17 B3R0.2 CS(=O)[O-] SY002584 [0,0,0,0,0,0|2,0,1]=3 18 B3R0.2 C[S+](C)C SY011509 [0,0,0,0,0,0|2,0,0]=2 19 B3R0.2 C[S+](C)C SY019516 [0,0,0,0,0,0|2,0,0]=2 20 B3R0.2 Cl[Bi](Cl)Cl SY010298 [0,0,0,0,0,0|4,0,0]=4 21 B3R0.2 Cl[Gd](Cl)Cl SY061124 [0,0,0,0,0,0|4,0,0]=4 22 B3R0.2 Cl[Ho](Cl)Cl SY061123 [0,0,0,0,0,0|4,0,0]=4 23 B3R0.2 Cl[Ir](Cl)Cl SY007840 [0,0,0,0,0,0|4,0,0]=4 24 B3R0.2 Cl[Nd](Cl)Cl SY061229 [0,0,0,0,0,0|4,0,0]=4 25 B3R0.2 Cl[Rh](Cl)Cl SY113105 [0,0,0,0,0,0|4,0,0]=4 26 B3R0.2 N=C(N)Cl SY009310 [0,0,0,0,0,0|3,0,1]=4 27 B3R0.2 N=C(N)N SY003172 [0,0,0,0,0,0|3,0,1]=4 28 B3R0.2 O=C([O-])[O-] SY001250 [0,0,0,0,0,0|2,0,2]=4 29 B3R0.2 O=C([O-])[O-] SY009169 [0,0,0,0,0,0|2,0,2]=4 30 B3R0.2 O=C([O-])[O-] SY011697 [0,0,0,0,0,0|2,0,2]=4 31 B3R0.2 O=C([O-])[O-] SY011713 [0,0,0,0,0,0|2,0,2]=4 32 B3R0.2 O=C([O-])[O-] SY011779 [0,0,0,0,0,0|2,0,2]=4 33 B3R0.2 O=C([O-])[O-] SY011799 [0,0,0,0,0,0|2,0,2]=4 34 B3R0.2 O=C([O-])[O-] SY011844 [0,0,0,0,0,0|2,0,2]=4 35 B3R0.2 O=C([O-])[O-] SY066643 [0,0,0,0,0,0|2,0,2]=4 36 B3R0.2 O=C([O-])[O-] SY076666 [0,0,0,0,0,0|2,0,2]=4 37 B3R0.2 O=C([O-])[O-] SY274515 [0,0,0,0,0,0|2,0,2]=4 38 B3R0.2 O=C([O-])[O-] SY288394 [0,0,0,0,0,0|2,0,2]=4 39 B3R0.2 O=[N+]([O-])[O-] SY061250 [0,0,0,0,0,0|3,0,1]=4 40 B3R0.2 O=[N+]([O-])[O-] SY061261 [0,0,0,0,0,0|3,0,1]=4 41 B3R0.2 O=[Ti]([O-])[O-] SY061132 [0,0,0,0,0,0|3,0,1]=4 42 B3R0.2 O=[Ti]([O-])[O-] SY284367 [0,0,0,0,0,0|3,0,1]=4 43 B3R0.2 O=[Ti]([O-])[O-] SY284368 [0,0,0,0,0,0|3,0,1]=4 44 B3R0.2 O=[V](=O)[O-] SY106462 [0,0,0,0,0,0|3,0,1]=4 45 B3R0.2 P(C)(C)=O SY009874 [0,0,0,0,0,0|1,0,1]=2 46 B3R0.2 P(C)(C)=O SY237149 [0,0,0,0,0,0|1,0,1]=2 47 B2R0.1 C=NO SY022552 [1,0,0,0,0,0|1,0,1]=3 48 B2R0.1 CC#N SY009905 [1,0,0,0,0,0|1,0,1]=3 49 B2R0.1 CNN SY114943 [1,0,0,0,0,0|2,0,0]=3 50 B2R0.1 CNO SY013476 [1,0,0,0,0,0|1,0,0]=2 51 B2R0.1 Cl[Pt]Cl SY011160 [1,0,0,0,0,0|3,0,0]=4 52 B2R0.1 Cl[Pt]Cl SY062001 [1,0,0,0,0,0|3,0,0]=4 53 B2R0.1 FCI SY274057 [1,0,0,0,0,0|2,0,0]=3 54 B2R0.1 I[Ca]I SY069679 [1,0,0,0,0,0|3,0,0]=4 55 B2R0.1 I[Co]I SY073177 [1,0,0,0,0,0|3,0,0]=4 56 B2R0.1 I[Pt]I SY296016 [1,0,0,0,0,0|3,0,0]=4 57 B2R0.1 N#C[O-] SY006099 [1,0,0,0,0,0|1,0,2]=4 58 B2R0.1 N=CN SY007749 [1,0,0,0,0,0|2,0,1]=4 59 B2R0.1 NCN SY106478 [1,0,0,0,0,0|2,0,0]=3 60 B2R0.1 O=C[O-] SY027875 [1,0,0,0,0,0|1,0,2]=4 61 B2R0.1 O=N[O-] SY010058 [1,0,0,0,0,0|2,0,1]=4 62 B2R0.1 O=[Ru]=O SY009293 [1,0,0,0,0,0|2,0,1]=4 63 B2R0.1 O=[Ru]=O SY010110 [1,0,0,0,0,0|2,0,1]=4 64 B2R0.1 O[Pd]O SY001180 [1,0,0,0,0,0|2,0,0]=3 65 B4R0.1 C#CC(C)N SY022798 [0,1,0,0,0,0|1,0,1]=3 66 B4R0.1 C=C(Br)CN SY122662 [0,1,0,0,0,0|1,0,2]=4 67 B4R0.1 C=C(Br)CN SY264242 [0,1,0,0,0,0|1,0,2]=4 68 B4R0.1 C=C(Br)CO SY043202 [0,1,0,0,0,0|1,0,2]=4 69 B4R0.1 C=C(C)CN SY018445 [0,1,0,0,0,0|1,0,1]=3 70 B4R0.1 C=C[C@H](C)N SY245785 [0,1,0,0,0,0|1,0,1]=3 71 B4R0.1 CC(=N)NN SY188423 [0,1,0,0,0,0|2,0,1]=4 72 B4R0.1 CC(=O)CN SY018511 [0,1,0,0,0,0|0,0,2]=3 73 B4R0.1 CC(C)NN SY008422 [0,1,0,0,0,0|1,0,0]=2 74 B4R0.1 CC(C)NO SY059927 [0,1,0,0,0,0|0,0,0]=1 75 B4R0.1 CC(C)ON SY019006 [0,1,0,0,0,0|0,0,0]=1 76 B4R0.1 CC(N)CBr SY268996 [0,1,0,0,0,0|1,0,0]=2 77 B4R0.1 CC(N)CF SY045872 [0,1,0,0,0,0|1,0,0]=2 78 B4R0.1 CC(S)CO SY195125 [0,1,0,0,0,0|0,1,0]=2 79 B4R0.1 CCB(O)O SY004385 [0,1,0,0,0,0|2,0,0]=3 80 B4R0.1 CCC(=N)N SY018521 [0,1,0,0,0,0|2,0,1]=4 81 B4R0.1 CCC(N)=O SY048276 [0,1,0,0,0,0|1,0,2]=4 82 B4R0.1 CCS(=O)[O-] SY005659 [0,1,0,0,0,0|2,0,1]=4 83 B4R0.1 CC[C@H](C)N SY059203 [0,1,0,0,0,0|1,0,0]=2 84 B4R0.1 CNC(N)=O SY018863 [0,1,0,0,0,0|1,0,2]=4 85 B4R0.1 COC(=N)N SY021749 [0,1,0,0,0,0|2,0,1]=4 86 B4R0.1 COC(=N)N SY023512 [0,1,0,0,0,0|2,0,1]=4 87 B4R0.1 CSC(=N)N SY001378 [0,1,0,0,0,0|2,0,1]=4 88 B4R0.1 C[C@@H](Cl)CO SY240135 [0,1,0,0,0,0|1,0,0]=2 89 B4R0.1 C[C@@H](N)CF SY044783 [0,1,0,0,0,0|1,0,0]=2 90 B4R0.1 C[C@@H](O)CN SY002691 [0,1,0,0,0,0|0,0,0]=1 91 B4R0.1 C[C@@H](O)CO SY003769 [0,1,0,0,0,0|0,0,0]=1 92 B4R0.1 C[C@H](N)CF SY044781 [0,1,0,0,0,0|1,0,0]=2 93 B4R0.1 C[C@H](O)CO SY003770 [0,1,0,0,0,0|0,0,0]=1 94 B4R0.1 C\C(Cl)=N\O SY307714 [0,1,0,0,0,0|1,0,1]=3 95 B4R0.1 C\C(N)=N\O SY011082 [0,1,0,0,0,0|1,0,1]=3 96 B4R0.1 FC(F)CI SY027169 [0,1,0,0,0,0|2,0,0]=3 97 B4R0.1 N=C(N)CCl SY116175 [0,1,0,0,0,0|2,0,1]=4 98 B4R0.1 NC(=S)CF SY153543 [0,1,0,0,0,0|1,1,1]=4 99 B4R0.1 NCC(F)F SY013766 [0,1,0,0,0,0|2,0,0]=3 100 B4R0.1 NCC(N)=O SY003860 [0,1,0,0,0,0|1,0,2]=4 101 B4R0.1 NCC(N)=O SY104505 [0,1,0,0,0,0|1,0,2]=4 102 B4R0.1 O=C([O-])CI SY066613 [0,1,0,0,0,0|1,0,2]=4 103 B4R0.1 ON=C(Br)Br SY007120 [0,1,0,0,0,0|2,0,1]=4 104 B4R0.3 CS(=O)(=O)[O-] SY003606 [0,1,0,0,0,0|2,0,1]=4 105 B4R0.3 CS(C)(=N)=O SY037343 [0,1,0,0,0,0|1,0,1]=3 106 B4R0.3 CS(N)(=O)=O SY001366 [0,1,0,0,0,0|2,0,1]=4 107 B4R0.3 C[B-](F)(F)F SY021937 [0,1,0,0,0,0|3,0,0]=4 108 B4R0.3 C[N+](C)(C)C SY037155 [0,1,0,0,0,0|2,0,0]=3 109 B4R0.3 C[N+](C)(C)[O-] SY010773 [0,1,0,0,0,0|1,0,1]=3 110 B4R0.3 C[S+](C)(C)=O SY002188 [0,1,0,0,0,0|1,0,1]=3 111 B4R0.3 C[S+](C)(C)=O SY036350 [0,1,0,0,0,0|1,0,1]=3 112 B4R0.3 C[S+](C)(C)=O SY039178 [0,1,0,0,0,0|1,0,1]=3 113 B4R0.3 FC(F)(F)[S-] SY046964 [0,1,0,0,0,0|2,1,0]=4 114 B4R0.3 O=P([O-])([O-])O SY010082 [0,1,0,0,0,0|3,0,0]=4 115 B4R1.2 IC1CC1 SY046875 [0,0,0,1,0,0|1,0,0]=2 116 B4R1.2 O=C1CC1 SY037762 [0,0,0,1,0,0|0,0,2]=3 117 B4R1.2 OC1CC1 SY028267 [0,0,0,1,0,0|0,0,0]=1 118 B1R0.1 Br[Ag] SY059381 [2,0,0,0,0,0|2,0,0]=4 119 B1R0.1 CN SY236298 [2,0,0,0,0,0|1,0,0]=3 120 B1R0.1 [C-]#[O+] SY009926 [2,0,0,0,0,0|0,0,2]=4 121 B3R0.1 CCON SY009566 [1,1,0,0,0,0|0,0,0]=2 122 B3R0.1 CNOC SY001763 [1,1,0,0,0,0|1,0,0]=3 123 B3R0.1 COCBr SY029084 [1,1,0,0,0,0|1,0,0]=3 124 B3R0.1 C[Se][Se]C SY048201 [1,1,0,0,0,0|1,0,0]=3 125 B3R0.1 FCCI SY024380 [1,1,0,0,0,0|1,0,0]=3 126 B3R0.1 ICCI SY045649 [1,1,0,0,0,0|1,0,0]=3 127 B3R0.1 NCCF SY009337 [1,1,0,0,0,0|1,0,0]=3 128 B3R0.1 NCCI SY155633 [1,1,0,0,0,0|1,0,0]=3 129 B3R0.1 N\C=N\O SY086195 [1,1,0,0,0,0|1,0,1]=4 130 B5R0.1 C#CCC(=O)O SY040154 [0,2,0,0,0,0|1,0,1]=4 131 B5R0.1 CC#CC(C)=O SY262884 [0,2,0,0,0,0|0,0,2]=4 132 B5R0.1 CC(=O)CCN SY263173 [0,2,0,0,0,0|0,0,2]=4 133 B5R0.1 CC(=O)CCO SY002849 [0,2,0,0,0,0|0,0,2]=4 134 B5R0.1 CC(=O)NCO SY047960 [0,2,0,0,0,0|0,0,2]=4 135 B5R0.1 CC(=O)OCBr SY051438 [0,2,0,0,0,0|0,0,2]=4 136 B5R0.1 CC(=O)\C=N/O SY112549 [0,2,0,0,0,0|1,0,1]=4 137 B5R0.1 CC(C)CON SY013358 [0,2,0,0,0,0|0,0,0]=2 138 B5R0.1 CC(C)N=[N+]=[N-] SY197245 [0,2,0,0,0,0|1,0,0]=3 139 B5R0.1 CC(I)=CCI SY237855 [0,2,0,0,0,0|1,0,1]=4 140 B5R0.1 CC(N)CCF SY299085 [0,2,0,0,0,0|1,0,0]=3 141 B5R0.1 CC(N)CCO SY030187 [0,2,0,0,0,0|1,0,0]=3 142 B5R0.1 CC(O)CCBr SY216789 [0,2,0,0,0,0|0,0,0]=2 143 B5R0.1 CCCB(O)O SY030878 [0,2,0,0,0,0|2,0,0]=4 144 B5R0.1 CCC[C@@H](C)O SY045083 [0,2,0,0,0,0|0,0,0]=2 145 B5R0.1 CCNC(C)=O SY016499 [0,2,0,0,0,0|0,0,2]=4 146 B5R0.1 CN(C)CC=O SY114927 [0,2,0,0,0,0|1,0,1]=4 147 B5R0.1 CN(C)CCBr SY004492 [0,2,0,0,0,0|2,0,0]=4 148 B5R0.1 CN(C)CCI SY219257 [0,2,0,0,0,0|2,0,0]=4 149 B5R0.1 CN(C)CCI SY247759 [0,2,0,0,0,0|2,0,0]=4 150 B5R0.1 CN(C)CCI SY247769 [0,2,0,0,0,0|2,0,0]=4 151 B5R0.1 CNCC(=O)O SY001630 [0,2,0,0,0,0|1,0,1]=4 152 B5R0.1 CNCC(C)O SY083968 [0,2,0,0,0,0|0,0,0]=2 153 B5R0.1 CNCC(F)F SY181997 [0,2,0,0,0,0|2,0,0]=4 154 B5R0.1 CNC[C@H](C)O SY131109 [0,2,0,0,0,0|0,0,0]=2 155 B5R0.1 COCC(C)Br SY074290 [0,2,0,0,0,0|1,0,0]=3 156 B5R0.1 COC[C@@H](C)N SY034826 [0,2,0,0,0,0|1,0,0]=3 157 B5R0.1 COC[C@@H](C)N SY056838 [0,2,0,0,0,0|1,0,0]=3 158 B5R0.1 CSCS(C)=O SY049552 [0,2,0,0,0,0|1,0,1]=4 159 B5R0.1 C[C@@H](O)CCO SY049450 [0,2,0,0,0,0|0,0,0]=2 160 B5R0.1 C[C@H](N)CC#N SY121969 [0,2,0,0,0,0|1,0,0]=3 161 B5R0.1 C[C@H](N)CC#N SY294704 [0,2,0,0,0,0|1,0,0]=3 162 B5R0.1 C[C@H](N)CCO SY022986 [0,2,0,0,0,0|1,0,0]=3 163 B5R0.1 C\C(I)=C/CI SY237856 [0,2,0,0,0,0|1,0,1]=4 164 B5R0.1 C\C(I)=C\CI SY237854 [0,2,0,0,0,0|1,0,1]=4 165 B5R0.1 C\C(I)=C\CO SY246995 [0,2,0,0,0,0|1,0,1]=4 166 B5R0.1 C\C(I)=C\CO SY252919 [0,2,0,0,0,0|1,0,1]=4 167 B5R0.1 C\C=C\B(O)O SY027001 [0,2,0,0,0,0|2,0,0]=4 168 B5R0.1 O=C(O)CCF SY008508 [0,2,0,0,0,0|1,0,1]=4 169 B5R0.1 O=C(O)CCO SY003982 [0,2,0,0,0,0|1,0,1]=4 170 B5R0.3 C#CC(O)C#C SY263075 [0,2,0,0,0,0|0,0,2]=4 171 B5R0.3 C#C[C@H](C)OC SY282343 [0,2,0,0,0,0|0,0,1]=3 172 B5R0.3 C=C(CI)CI SY280389 [0,2,0,0,0,0|1,0,1]=4 173 B5R0.3 C=C(CO)CO SY009429 [0,2,0,0,0,0|0,0,2]=4 174 B5R0.3 C=C(OC)OC SY274566 [0,2,0,0,0,0|0,0,2]=4 175 B5R0.3 C=CC(C)ON SY039116 [0,2,0,0,0,0|0,0,1]=3 176 B5R0.3 C=CC(O)CO SY275096 [0,2,0,0,0,0|0,0,1]=3 177 B5R0.3 C=C[C@@H](N)CO SY211186 [0,2,0,0,0,0|1,0,1]=4 178 B5R0.3 C=C[C@H](N)CO SY101322 [0,2,0,0,0,0|1,0,1]=4 179 B5R0.3 CC(=CI)CI SY271392 [0,2,0,0,0,0|1,0,1]=4 180 B5R0.3 CC(CBr)CBr SY038831 [0,2,0,0,0,0|1,0,0]=3 181 B5R0.3 CC(CI)CI SY248411 [0,2,0,0,0,0|1,0,0]=3 182 B5R0.3 CCC(Br)CC SY050135 [0,2,0,0,0,0|1,0,0]=3 183 B5R0.3 CC[C@@H](N)CO SY049464 [0,2,0,0,0,0|1,0,0]=3 184 B5R0.3 CC[C@H](N)CF SY045883 [0,2,0,0,0,0|1,0,0]=3 185 B5R0.3 CNC(=N)NC SY270827 [0,2,0,0,0,0|1,0,1]=4 186 B5R0.3 CNC(=O)CBr SY106596 [0,2,0,0,0,0|0,0,2]=4 187 B5R0.3 CNC(=O)CCl SY003250 [0,2,0,0,0,0|0,0,2]=4 188 B5R0.3 CNC(=O)CN SY024913 [0,2,0,0,0,0|0,0,2]=4 189 B5R0.3 CNC(=O)CN SY066423 [0,2,0,0,0,0|0,0,2]=4 190 B5R0.3 CNC(=O)NC SY004507 [0,2,0,0,0,0|0,0,2]=4 191 B5R0.3 CNC(C)C#N SY019549 [0,2,0,0,0,0|1,0,0]=3 192 B5R0.3 CNC(C)CO SY082195 [0,2,0,0,0,0|0,0,0]=2 193 B5R0.3 COC(=O)CN SY001589 [0,2,0,0,0,0|0,0,2]=4 194 B5R0.3 COC(=O)CO SY003097 [0,2,0,0,0,0|0,0,2]=4 195 B5R0.3 COC(C)CBr SY298794 [0,2,0,0,0,0|0,0,0]=2 196 B5R0.3 CO[C@@H](C)CN SY114788 [0,2,0,0,0,0|0,0,0]=2 197 B5R0.3 C\C(=C/I)CO SY270524 [0,2,0,0,0,0|0,0,2]=4 198 B5R0.3 C\C(=C\I)CI SY248780 [0,2,0,0,0,0|1,0,1]=4 199 B5R0.3 FCC(I)CF SY249443 [0,2,0,0,0,0|1,0,0]=3 200 B5R0.3 NCC(Br)CBr SY006726 [0,2,0,0,0,0|1,0,0]=3 201 B5R0.3 NCC(F)CO SY260924 [0,2,0,0,0,0|1,0,0]=3 202 B5R0.3 NCC(O)CN SY013661 [0,2,0,0,0,0|0,0,0]=2 203 B5R0.3 NC[C@@H](O)CO SY008127 [0,2,0,0,0,0|0,0,0]=2 204 B5R0.3 NC[C@H](O)CBr SY294054 [0,2,0,0,0,0|0,0,0]=2 205 B5R0.3 NC[C@H](O)CCl SY060396 [0,2,0,0,0,0|0,0,0]=2 206 B5R0.3 O=C(CO)CO SY038299 [0,2,0,0,0,0|0,0,2]=4 207 B5R0.3 OC(CBr)CBr SY012889 [0,2,0,0,0,0|0,0,0]=2 208 B5R0.4 CC(C)(Br)C=O SY251082 [0,2,0,0,0,0|0,0,1]=3 209 B5R0.4 CC(C)(C)CCl SY048171 [0,2,0,0,0,0|1,0,0]=3 210 B5R0.4 CC(C)(C)NO SY036171 [0,2,0,0,0,0|0,0,0]=2 211 B5R0.4 CC(C)(C)ON SY025901 [0,2,0,0,0,0|0,0,0]=2 212 B5R0.4 CC(C)(F)CBr SY027377 [0,2,0,0,0,0|1,0,0]=3 213 B5R0.4 CC(C)(F)CI SY028245 [0,2,0,0,0,0|1,0,0]=3 214 B5R0.4 CC(C)(F)CO SY029466 [0,2,0,0,0,0|0,0,0]=2 215 B5R0.4 CC(C)(N)C#N SY046540 [0,2,0,0,0,0|1,0,0]=3 216 B5R0.4 CC(C)(O)CBr SY236333 [0,2,0,0,0,0|0,0,0]=2 217 B5R0.4 CC(C)(O)CN SY022204 [0,2,0,0,0,0|0,0,0]=2 218 B5R0.4 CC(C)(O)CO SY107922 [0,2,0,0,0,0|0,0,0]=2 219 B5R0.4 CC(F)(F)CN SY029653 [0,2,0,0,0,0|1,0,0]=3 220 B5R0.4 CC(F)(F)CO SY029658 [0,2,0,0,0,0|1,0,0]=3 221 B5R0.4 CCS(=O)(=O)O SY036762 [0,2,0,0,0,0|2,0,0]=4 222 B5R0.4 CNS(C)(=O)=O SY004768 [0,2,0,0,0,0|1,0,1]=4 223 B5R0.4 CO[Si](C)(C)Cl SY249087 [0,2,0,0,0,0|0,1,0]=3 224 B5R0.4 FC(F)(F)CI SY001054 [0,2,0,0,0,0|2,0,0]=4 225 B5R0.4 NCC(F)(F)F SY017101 [0,2,0,0,0,0|2,0,0]=4 226 B5R0.4 NCP(=O)(O)O SY011283 [0,2,0,0,0,0|2,0,0]=4 227 B5R0.4 OCC(F)(F)Br SY216189 [0,2,0,0,0,0|2,0,0]=4 228 B5R0.5 C=C(C)C(C)O SY145959 [0,2,0,0,0,0|0,0,0]=2 229 B5R0.5 CC(=O)C(F)F SY013768 [0,2,0,0,0,0|0,0,2]=4 230 B5R0.5 CC(Br)C(N)=O SY106825 [0,2,0,0,0,0|1,0,1]=4 231 B5R0.5 CC(C)B(O)O SY006229 [0,2,0,0,0,0|0,0,0]=2 232 B5R0.5 CC(C)C(=N)N SY024838 [0,2,0,0,0,0|1,0,0]=3 233 B5R0.5 CC(C)C(I)I SY248412 [0,2,0,0,0,0|1,0,0]=3 234 B5R0.5 CC(C)C(N)=O SY015332 [0,2,0,0,0,0|0,0,1]=3 235 B5R0.5 CC(C)[C@H](C)N SY059202 [0,2,0,0,0,0|1,0,0]=3 236 B5R0.5 CC(N)C(=O)O SY005245 [0,2,0,0,0,0|1,0,0]=3 237 B5R0.5 CC(N)C(N)=O SY012823 [0,2,0,0,0,0|1,0,1]=4 238 B5R0.5 CC(N)C(N)=O SY027188 [0,2,0,0,0,0|1,0,1]=4 239 B5R0.5 C[C@@H](Br)C(=O)O SY102226 [0,2,0,0,0,0|1,0,0]=3 240 B5R0.5 C[C@@H](N)C(=O)O SY002277 [0,2,0,0,0,0|1,0,0]=3 241 B5R0.5 C[C@@H](N)C(N)=O SY030965 [0,2,0,0,0,0|1,0,1]=4 242 B5R0.5 C[C@@H](N)C(N)=O SY111070 [0,2,0,0,0,0|1,0,1]=4 243 B5R0.5 C[C@@H](O)C(N)=O SY022608 [0,2,0,0,0,0|0,0,1]=3 244 B5R0.5 C[C@@H](O)[C@@H](C)O SY047189 [0,2,0,0,0,0|0,0,0]=2 245 B5R0.5 C[C@H](Cl)C(=O)O SY018972 [0,2,0,0,0,0|1,0,0]=3 246 B5R0.5 C[C@H](N)C(N)=O SY031439 [0,2,0,0,0,0|1,0,1]=4 247 B5R0.5 C[C@H](O)[C@H](C)O SY057405 [0,2,0,0,0,0|0,0,0]=2 248 B5R0.5 O=C(O)C(F)Br SY040308 [0,2,0,0,0,0|1,0,1]=4 249 B5R0.5 O=C(O)C(F)Cl SY275169 [0,2,0,0,0,0|1,0,1]=4 250 B5R0.5 O=C(O)[C@@H](F)Cl SY276751 [0,2,0,0,0,0|1,0,1]=4 251 B5R0.5 O=C(O)[C@H](F)Cl SY276752 [0,2,0,0,0,0|1,0,1]=4 252 B5R1.2 BrC1CCC1 SY013810 [0,1,0,1,0,0|1,0,0]=3 253 B5R1.2 BrC1CNC1 SY097761 [0,1,0,1,0,0|1,0,0]=3 254 B5R1.2 CC1CCN1 SY099118 [0,1,0,1,0,0|1,0,0]=3 255 B5R1.2 CC1CNC1 SY056983 [0,1,0,1,0,0|1,0,0]=3 256 B5R1.2 C[C@@H]1CCN1 SY261901 [0,1,0,1,0,0|1,0,0]=3 257 B5R1.2 C[C@H]1CCN1 SY249704 [0,1,0,1,0,0|1,0,0]=3 258 B5R1.2 ClC1COC1 SY059296 [0,1,0,1,0,0|1,0,0]=3 259 B5R1.2 FC1CNC1 SY018074 [0,1,0,1,0,0|1,0,0]=3 260 B5R1.2 IC1CCC1 SY233989 [0,1,0,1,0,0|1,0,0]=3 261 B5R1.2 IC1COC1 SY009160 [0,1,0,1,0,0|1,0,0]=3 262 B5R1.2 NC1CCC1 SY013751 [0,1,0,1,0,0|1,0,0]=3 263 B5R1.2 NC1CNC1 SY033623 [0,1,0,1,0,0|1,0,0]=3 264 B5R1.2 NC1COC1 SY009105 [0,1,0,1,0,0|1,0,0]=3 265 B5R1.2 NC1CSC1 SY097616 [0,1,0,1,0,0|1,0,0]=3 266 B5R1.2 O=C1CNC1 SY027144 [0,1,0,1,0,0|0,0,2]=4 267 B5R1.2 O=C1COC1 SY003915 [0,1,0,1,0,0|0,0,2]=4 268 B5R1.2 OC1CNC1 SY002482 [0,1,0,1,0,0|0,0,0]=2 269 B5R1.2 OC1COC1 SY002910 [0,1,0,1,0,0|0,0,0]=2 270 B5R1.2 OC1CSC1 SY099721 [0,1,0,1,0,0|0,0,0]=2 271 B5R1.3 ICC1CC1 SY266775 [0,1,0,1,0,0|1,0,0]=3 272 B5R1.3 NNC1CC1 SY024161 [0,1,0,1,0,0|1,0,0]=3 273 B5R1.3 OC[C@@H]1CO1 SY013955 [0,1,0,1,0,0|0,0,0]=2 274 B5R1.3 OC[C@H]1CO1 SY031944 [0,1,0,1,0,0|0,0,0]=2 275 B5R1.4 C[C@@H]1O[C@H]1C SY224137 [0,1,0,1,0,0|0,0,0]=2 276 B5R1.4 NC1CC1F SY265040 [0,1,0,1,0,0|1,0,0]=3 277 B5R1.4 NC1CC1N SY249366 [0,1,0,1,0,0|1,0,0]=3 278 B5R1.4 N[C@@H]1C[C@H]1F SY259032 [0,1,0,1,0,0|1,0,0]=3 279 B5R1.4 N[C@@H]1C[C@H]1N SY253855 [0,1,0,1,0,0|1,0,0]=3 280 B5R1.4 N[C@H]1C[C@H]1F SY265042 [0,1,0,1,0,0|1,0,0]=3 281 B5R1.4 N[C@H]1C[C@H]1N SY249367 [0,1,0,1,0,0|1,0,0]=3 282 B5R1.5 CC1(N)CC1 SY029028 [0,1,0,1,0,0|1,0,0]=3 283 B5R1.5 CC1(O)CC1 SY022540 [0,1,0,1,0,0|0,0,0]=2 284 B5R1.5 NC1(O)CC1 SY278292 [0,1,0,1,0,0|0,0,0]=2 285 B5R1.5 O=S1(=O)CC1 SY268817 [0,1,0,1,0,0|1,0,1]=4