0 B5R0.2 C#CCCC#C TS03439 [0,0,0,0,0,0|1,0,3]=4 1 B5R0.2 C#CCCC#N TS71657 [0,0,0,0,0,0|0,0,4]=4 2 B5R0.2 C#CCCCCl TS60430 [0,0,0,0,0,0|1,0,2]=3 3 B5R0.2 C#CCCCO TS71278 [0,0,0,0,0,0|1,0,2]=3 4 B5R0.2 C(C#CCBr)Br TS44092 [0,0,0,0,0,0|2,0,2]=4 5 B5R0.2 C(C#CCCl)Cl TS32544 [0,0,0,0,0,0|2,0,2]=4 6 B5R0.2 C(C#CCCl)O TS04053 [0,0,0,0,0,0|2,0,2]=4 7 B5R0.2 C(C#CCO)O TS03533 [0,0,0,0,0,0|2,0,2]=4 8 B5R0.2 C(C=CCBr)Br TS39560 [0,0,0,0,0,0|2,0,2]=4 9 B5R0.2 C(C=CCCl)Cl TS00388 [0,0,0,0,0,0|2,0,2]=4 10 B5R0.2 C(C=CCCl)Cl TS55820 [0,0,0,0,0,0|2,0,2]=4 11 B5R0.2 C(C=CCCl)N TS06635 [0,0,0,0,0,0|1,0,2]=3 12 B5R0.2 C(C=CCCl)O TS31740 [0,0,0,0,0,0|2,0,2]=4 13 B5R0.2 C(C=CCO)O TS33234 [0,0,0,0,0,0|2,0,2]=4 14 B5R0.2 C(C=CCl)ON TS94269 [0,0,0,0,0,0|2,0,2]=4 15 B5R0.2 C(CBr)N=C=O TS40811 [0,0,0,0,0,0|3,0,1]=4 16 B5R0.2 C(CBr)N=C=S TS42990 [0,0,0,0,0,0|3,0,1]=4 17 B5R0.2 C(CBr)OCCl TS45688 [0,0,0,0,0,0|3,0,0]=3 18 B5R0.2 C(CC#N)C#N TS71666 [0,0,0,0,0,0|1,0,3]=4 19 B5R0.2 C(CC#N)C=O TS71698 [0,0,0,0,0,0|1,0,3]=4 20 B5R0.2 C(CC#N)CCl TS33156 [0,0,0,0,0,0|1,0,2]=3 21 B5R0.2 C(CC#N)CI TS17989 [0,0,0,0,0,0|1,0,2]=3 22 B5R0.2 C(CC#N)C[Zn+] TS21545 [0,0,0,0,0,0|1,0,2]=3 23 B5R0.2 C(CC=O)C=O TS03527 [0,0,0,0,0,0|2,0,2]=4 24 B5R0.2 C(CC=O)C=O TS58456 [0,0,0,0,0,0|2,0,2]=4 25 B5R0.2 C(CCBr)CBr TS07886 [0,0,0,0,0,0|2,0,0]=2 26 B5R0.2 C(CCBr)CCl TS45376 [0,0,0,0,0,0|2,0,0]=2 27 B5R0.2 C(CCBr)CF TS10539 [0,0,0,0,0,0|2,0,0]=2 28 B5R0.2 C(CCBr)CO TS39737 [0,0,0,0,0,0|2,0,0]=2 29 B5R0.2 C(CCCl)CCl TS36204 [0,0,0,0,0,0|2,0,0]=2 30 B5R0.2 C(CCCl)CO TS33155 [0,0,0,0,0,0|2,0,0]=2 31 B5R0.2 C(CCF)CF TS03666 [0,0,0,0,0,0|2,0,0]=2 32 B5R0.2 C(CCF)CO TS03655 [0,0,0,0,0,0|2,0,0]=2 33 B5R0.2 C(CCI)CCl TS49510 [0,0,0,0,0,0|2,0,0]=2 34 B5R0.2 C(CCI)CI TS76368 [0,0,0,0,0,0|2,0,0]=2 35 B5R0.2 C(CCO)CN TS03609 [0,0,0,0,0,0|1,0,0]=1 36 B5R0.2 C(CCO)CO TS00383 [0,0,0,0,0,0|2,0,0]=2 37 B5R0.2 C(CCS)CO TS04107 [0,0,0,0,0,0|2,0,0]=2 38 B5R0.2 C(CCS)CS TS04933 [0,0,0,0,0,0|2,0,0]=2 39 B5R0.2 C(CC[Zn+])CCl TS25983 [0,0,0,0,0,0|2,0,0]=2 40 B5R0.2 C(CCl)N=C=O TS31715 [0,0,0,0,0,0|3,0,1]=4 41 B5R0.2 C(CCl)OCCl TS36384 [0,0,0,0,0,0|3,0,0]=3 42 B5R0.2 C(CCl)SC#N TS04877 [0,0,0,0,0,0|2,0,2]=4 43 B5R0.2 C(CNN)C#N TS03509 [0,0,0,0,0,0|2,0,1]=3 44 B5R0.2 C(CO)NCO TS03642 [0,0,0,0,0,0|3,0,0]=3 45 B5R0.2 C(CON)CS TS93047 [0,0,0,0,0,0|2,0,0]=2 46 B5R0.2 C=CCCC#N TS03446 [0,0,0,0,0,0|0,0,4]=4 47 B5R0.2 C=CCCC=C TS39876 [0,0,0,0,0,0|1,0,3]=4 48 B5R0.2 C=CCCC=O TS03486 [0,0,0,0,0,0|1,0,3]=4 49 B5R0.2 C=CCCCBr TS71399 [0,0,0,0,0,0|1,0,2]=3 50 B5R0.2 C=CCCCCl TS04057 [0,0,0,0,0,0|1,0,2]=3 51 B5R0.2 C=CCCCN TS03513 [0,0,0,0,0,0|0,0,2]=2 52 B5R0.2 C=CCCCN TS04880 [0,0,0,0,0,0|0,0,2]=2 53 B5R0.2 C=CCCCO TS33172 [0,0,0,0,0,0|1,0,2]=3 54 B5R0.2 C=CCCC[Zn+] TS44589 [0,0,0,0,0,0|1,0,2]=3 55 B5R0.2 C=CCC[Mg]Br TS42097 [0,0,0,0,0,0|2,0,2]=4 56 B5R0.2 C=COCCO TS03575 [0,0,0,0,0,0|2,0,2]=4 57 B5R0.2 CC#CCC#C TS03435 [0,0,0,0,0,0|1,0,3]=4 58 B5R0.2 CC#CCC=C TS71671 [0,0,0,0,0,0|1,0,3]=4 59 B5R0.2 CC=CCCO TS71749 [0,0,0,0,0,0|1,0,2]=3 60 B5R0.2 CC=CC[Mg]Cl TS32134 [0,0,0,0,0,0|2,0,2]=4 61 B5R0.2 CCC#CC#C TS03438 [0,0,0,0,0,0|1,0,3]=4 62 B5R0.2 CCC#CC=C TS71669 [0,0,0,0,0,0|1,0,3]=4 63 B5R0.2 CCC#CCC TS71689 [0,0,0,0,0,0|1,0,2]=3 64 B5R0.2 CCC#CCCl TS31620 [0,0,0,0,0,0|1,0,2]=3 65 B5R0.2 CCC#CCO TS65626 [0,0,0,0,0,0|1,0,2]=3 66 B5R0.2 CCC=CC=C TS03467 [0,0,0,0,0,0|1,0,3]=4 67 B5R0.2 CCC=CC=O TS03498 [0,0,0,0,0,0|1,0,3]=4 68 B5R0.2 CCCC#CC TS71682 [0,0,0,0,0,0|1,0,2]=3 69 B5R0.2 CCCC#CI TS51737 [0,0,0,0,0,0|1,0,2]=3 70 B5R0.2 CCCC=NO TS03560 [0,0,0,0,0,0|2,0,1]=3 71 B5R0.2 CCCCC#C TS71687 [0,0,0,0,0,0|1,0,1]=2 72 B5R0.2 CCCCC#N TS71704 [0,0,0,0,0,0|0,0,2]=2 73 B5R0.2 CCCCC=C TS71713 [0,0,0,0,0,0|1,0,1]=2 74 B5R0.2 CCCCC=O TS71764 [0,0,0,0,0,0|1,0,1]=2 75 B5R0.2 CCCCCBr TS00039 [0,0,0,0,0,0|1,0,0]=1 76 B5R0.2 CCCCCCl TS31742 [0,0,0,0,0,0|1,0,0]=1 77 B5R0.2 CCCCCF TS71848 [0,0,0,0,0,0|1,0,0]=1 78 B5R0.2 CCCCCI TS18547 [0,0,0,0,0,0|1,0,0]=1 79 B5R0.2 CCCCCN TS71782 [0,0,0,0,0,0|0,0,0]=0 80 B5R0.2 CCCCCO TS46186 [0,0,0,0,0,0|1,0,0]=1 81 B5R0.2 CCCCCO TS71798 [0,0,0,0,0,0|1,0,0]=1 82 B5R0.2 CCCCCS TS31699 [0,0,0,0,0,0|1,0,0]=1 83 B5R0.2 CCCCC[Si] TS03986 [0,0,0,0,0,0|1,0,0]=1 84 B5R0.2 CCCCC[Zn+] TS49168 [0,0,0,0,0,0|1,0,0]=1 85 B5R0.2 CCCCNC TS71774 [0,0,0,0,0,0|2,0,0]=2 86 B5R0.2 CCCCNN TS14187 [0,0,0,0,0,0|1,0,0]=1 87 B5R0.2 CCCCNN TS36035 [0,0,0,0,0,0|1,0,0]=1 88 B5R0.2 CCCCON TS36085 [0,0,0,0,0,0|1,0,0]=1 89 B5R0.2 CCCCON TS93805 [0,0,0,0,0,0|1,0,0]=1 90 B5R0.2 CCCCSC TS31691 [0,0,0,0,0,0|2,0,0]=2 91 B5R0.2 CCCC[Mg]Br TS11455 [0,0,0,0,0,0|2,0,0]=2 92 B5R0.2 CCCC[Mg]Cl TS32260 [0,0,0,0,0,0|2,0,0]=2 93 B5R0.2 CCCC[N+]#[C-] TS71702 [0,0,0,0,0,0|2,0,0]=2 94 B5R0.2 CCCC[Sn]=O TS17583 [0,0,0,0,0,0|2,0,0]=2 95 B5R0.2 CCCN=C=O TS03505 [0,0,0,0,0,0|2,0,1]=3 96 B5R0.2 CCCN=C=S TS03915 [0,0,0,0,0,0|2,0,1]=3 97 B5R0.2 CCCNCC TS71783 [0,0,0,0,0,0|2,0,0]=2 98 B5R0.2 CCCOC=C TS29507 [0,0,0,0,0,0|2,0,1]=3 99 B5R0.2 CCCOC=O TS03584 [0,0,0,0,0,0|2,0,1]=3 100 B5R0.2 CCCOCC TS71799 [0,0,0,0,0,0|2,0,0]=2 101 B5R0.2 CCCOCCl TS04165 [0,0,0,0,0,0|2,0,0]=2 102 B5R0.2 CCCON=O TS71824 [0,0,0,0,0,0|3,0,0]=3 103 B5R0.2 CCCSC#N TS03911 [0,0,0,0,0,0|1,0,2]=3 104 B5R0.2 CCCSCC TS31700 [0,0,0,0,0,0|2,0,0]=2 105 B5R0.2 CCCSSC TS04934 [0,0,0,0,0,0|3,0,0]=3 106 B5R0.2 CCN=NCC TS03539 [0,0,0,0,0,0|3,0,0]=3 107 B5R0.2 CCNCCN TS71809 [0,0,0,0,0,0|1,0,0]=1 108 B5R0.2 CCNCCO TS00085 [0,0,0,0,0,0|2,0,0]=2 109 B5R0.2 CCNNCC TS11360 [0,0,0,0,0,0|3,0,0]=3 110 B5R0.2 CCNNCC TS71806 [0,0,0,0,0,0|3,0,0]=3 111 B5R0.2 CCOC=CBr TS40963 [0,0,0,0,0,0|2,0,2]=4 112 B5R0.2 CCOC=CC TS71751 [0,0,0,0,0,0|2,0,2]=4 113 B5R0.2 CCOCC=C TS71744 [0,0,0,0,0,0|2,0,1]=3 114 B5R0.2 CCOCCBr TS10269 [0,0,0,0,0,0|2,0,0]=2 115 B5R0.2 CCOCCCl TS04162 [0,0,0,0,0,0|2,0,0]=2 116 B5R0.2 CCOCCO TS71837 [0,0,0,0,0,0|2,0,0]=2 117 B5R0.2 CCSCC=C TS03981 [0,0,0,0,0,0|2,0,1]=3 118 B5R0.2 CCSCCBr TS44968 [0,0,0,0,0,0|2,0,0]=2 119 B5R0.2 CCSCCCl TS36036 [0,0,0,0,0,0|2,0,0]=2 120 B5R0.2 CCSCCN TS31712 [0,0,0,0,0,0|1,0,0]=1 121 B5R0.2 CCSCCN TS37539 [0,0,0,0,0,0|1,0,0]=1 122 B5R0.2 CCSCCO TS59769 [0,0,0,0,0,0|2,0,0]=2 123 B5R0.2 CCSSCC TS59782 [0,0,0,0,0,0|3,0,0]=3 124 B5R0.2 CC[Se][Se]CC TS44786 [0,0,0,0,0,0|3,0,0]=3 125 B5R0.2 CNCCC#N TS03502 [0,0,0,0,0,0|1,0,2]=3 126 B5R0.2 CNCCCCl TS40140 [0,0,0,0,0,0|2,0,0]=2 127 B5R0.2 CNCCCN TS71808 [0,0,0,0,0,0|1,0,0]=1 128 B5R0.2 CNCCNC TS56355 [0,0,0,0,0,0|3,0,0]=3 129 B5R0.2 CNCCOC TS03607 [0,0,0,0,0,0|3,0,0]=3 130 B5R0.2 COCCC#N TS46471 [0,0,0,0,0,0|1,0,2]=3 131 B5R0.2 COCCCBr TS10272 [0,0,0,0,0,0|2,0,0]=2 132 B5R0.2 COCCCCl TS04163 [0,0,0,0,0,0|2,0,0]=2 133 B5R0.2 COCCCN TS03603 [0,0,0,0,0,0|1,0,0]=1 134 B5R0.2 COCCCO TS70643 [0,0,0,0,0,0|2,0,0]=2 135 B5R0.2 COCCOC TS07877 [0,0,0,0,0,0|3,0,0]=3 136 B5R0.2 COCC[Hg]Cl TS58532 [0,0,0,0,0,0|3,0,0]=3 137 B5R0.2 COCN=C=S TS03997 [0,0,0,0,0,0|3,0,1]=4 138 B5R0.2 CSCCCN TS65714 [0,0,0,0,0,0|1,0,0]=1 139 B5R0.2 CSCCCO TS04105 [0,0,0,0,0,0|2,0,0]=2 140 B5R0.2 CSSCC=C TS32437 [0,0,0,0,0,0|3,0,1]=4 141 B5R0.2 C[SiH2]CC[SiH2]C TS04760 [0,0,0,0,0,0|1,2,0]=3 142 B4R0.2 C#CCCN TS31717 [1,0,0,0,0,0|0,0,2]=3 143 B4R0.2 C#CCCO TS09504 [1,0,0,0,0,0|1,0,2]=4 144 B4R0.2 C(CBr)CBr TS46797 [1,0,0,0,0,0|2,0,0]=3 145 B4R0.2 C(CBr)CI TS27842 [1,0,0,0,0,0|2,0,0]=3 146 B4R0.2 C(CCl)C#N TS03611 [1,0,0,0,0,0|1,0,2]=4 147 B4R0.2 C(CCl)C=O TS71867 [1,0,0,0,0,0|2,0,1]=4 148 B4R0.2 C(CCl)CBr TS46925 [1,0,0,0,0,0|2,0,0]=3 149 B4R0.2 C(CCl)CCl TS31994 [1,0,0,0,0,0|2,0,0]=3 150 B4R0.2 C(CF)CBr TS37464 [1,0,0,0,0,0|2,0,0]=3 151 B4R0.2 C(CF)CF TS71664 [1,0,0,0,0,0|2,0,0]=3 152 B4R0.2 C(CI)CI TS93960 [1,0,0,0,0,0|2,0,0]=3 153 B4R0.2 C(CN)C#N TS03335 [1,0,0,0,0,0|1,0,1]=3 154 B4R0.2 C(CN)CBr TS09494 [1,0,0,0,0,0|1,0,0]=2 155 B4R0.2 C(CN)CCl TS00183 [1,0,0,0,0,0|1,0,0]=2 156 B4R0.2 C(CN)CF TS04405 [1,0,0,0,0,0|1,0,0]=2 157 B4R0.2 C(CN)CN TS07879 [1,0,0,0,0,0|1,0,0]=2 158 B4R0.2 C(CN)CN TS34480 [1,0,0,0,0,0|1,0,0]=2 159 B4R0.2 C(CN)CN TS40489 [1,0,0,0,0,0|1,0,0]=2 160 B4R0.2 C(CN)CO TS04258 [1,0,0,0,0,0|1,0,0]=2 161 B4R0.2 C(CN)CO TS08858 [1,0,0,0,0,0|1,0,0]=2 162 B4R0.2 C(CO)C#N TS02797 [1,0,0,0,0,0|1,0,2]=4 163 B4R0.2 C(CO)CBr TS59604 [1,0,0,0,0,0|2,0,0]=3 164 B4R0.2 C(CO)CCl TS02021 [1,0,0,0,0,0|2,0,0]=3 165 B4R0.2 C(CO)CF TS00151 [1,0,0,0,0,0|2,0,0]=3 166 B4R0.2 C(CO)CI TS70633 [1,0,0,0,0,0|2,0,0]=3 167 B4R0.2 C(CO)CO TS00379 [1,0,0,0,0,0|2,0,0]=3 168 B4R0.2 C(CO)NN TS55378 [1,0,0,0,0,0|2,0,0]=3 169 B4R0.2 C(CP)CP TS04129 [1,0,0,0,0,0|1,1,0]=3 170 B4R0.2 C(CS)C#N TS71771 [1,0,0,0,0,0|1,0,2]=4 171 B4R0.2 C(CS)CCl TS31868 [1,0,0,0,0,0|2,0,0]=3 172 B4R0.2 C(CS)CS TS04153 [1,0,0,0,0,0|2,0,0]=3 173 B4R0.2 C(OCCl)Cl TS32139 [1,0,0,0,0,0|3,0,0]=4 174 B4R0.2 C(OCF)F TS03457 [1,0,0,0,0,0|3,0,0]=4 175 B4R0.2 C(SCCl)Cl TS05629 [1,0,0,0,0,0|3,0,0]=4 176 B4R0.2 C=CCCBr TS03033 [1,0,0,0,0,0|1,0,2]=4 177 B4R0.2 C=CCCCl TS03638 [1,0,0,0,0,0|1,0,2]=4 178 B4R0.2 C=CCCN TS01596 [1,0,0,0,0,0|0,0,2]=3 179 B4R0.2 C=CCCN TS04120 [1,0,0,0,0,0|0,0,2]=3 180 B4R0.2 C=CCCO TS71598 [1,0,0,0,0,0|1,0,2]=4 181 B4R0.2 C=CCNN TS55729 [1,0,0,0,0,0|1,0,2]=4 182 B4R0.2 C=CCON TS31812 [1,0,0,0,0,0|1,0,2]=4 183 B4R0.2 CC#CCBr TS05801 [1,0,0,0,0,0|1,0,2]=4 184 B4R0.2 CC#CCO TS03272 [1,0,0,0,0,0|1,0,2]=4 185 B4R0.2 CC=CCCl TS03634 [1,0,0,0,0,0|1,0,2]=4 186 B4R0.2 CC=CCN TS01395 [1,0,0,0,0,0|0,0,2]=3 187 B4R0.2 CC=CCO TS71604 [1,0,0,0,0,0|1,0,2]=4 188 B4R0.2 CC=COC TS71611 [1,0,0,0,0,0|1,0,2]=4 189 B4R0.2 CCC#CBr TS05800 [1,0,0,0,0,0|1,0,2]=4 190 B4R0.2 CCC#CC TS03009 [1,0,0,0,0,0|0,0,2]=3 191 B4R0.2 CCC#CI TS47811 [1,0,0,0,0,0|1,0,2]=4 192 B4R0.2 CCC=C=C TS70908 [1,0,0,0,0,0|0,0,3]=4 193 B4R0.2 CCC=CBr TS33033 [1,0,0,0,0,0|1,0,2]=4 194 B4R0.2 CCC=CC TS03361 [1,0,0,0,0,0|0,0,2]=3 195 B4R0.2 CCC=CCl TS03636 [1,0,0,0,0,0|1,0,2]=4 196 B4R0.2 CCC=CCl TS03637 [1,0,0,0,0,0|1,0,2]=4 197 B4R0.2 CCC=NS TS31707 [1,0,0,0,0,0|2,0,1]=4 198 B4R0.2 CCCC#C TS70989 [1,0,0,0,0,0|0,0,2]=3 199 B4R0.2 CCCC#N TS03176 [1,0,0,0,0,0|0,0,2]=3 200 B4R0.2 CCCC=O TS71609 [1,0,0,0,0,0|1,0,1]=3 201 B4R0.2 CCCCBr TS37077 [1,0,0,0,0,0|1,0,0]=2 202 B4R0.2 CCCCBr TS93069 [1,0,0,0,0,0|1,0,0]=2 203 B4R0.2 CCCCC TS71613 [1,0,0,0,0,0|0,0,0]=1 204 B4R0.2 CCCCCl TS39594 [1,0,0,0,0,0|1,0,0]=2 205 B4R0.2 CCCCF TS71643 [1,0,0,0,0,0|1,0,0]=2 206 B4R0.2 CCCCI TS48513 [1,0,0,0,0,0|1,0,0]=2 207 B4R0.2 CCCCN TS03383 [1,0,0,0,0,0|0,0,0]=1 208 B4R0.2 CCCCN TS04172 [1,0,0,0,0,0|0,0,0]=1 209 B4R0.2 CCCCO TS03407 [1,0,0,0,0,0|1,0,0]=2 210 B4R0.2 CCCCS TS71854 [1,0,0,0,0,0|1,0,0]=2 211 B4R0.2 CCCC[O-] TS31364 [1,0,0,0,0,0|1,0,0]=2 212 B4R0.2 CCCC[O-] TS64270 [1,0,0,0,0,0|1,0,0]=2 213 B4R0.2 CCCC[O-] TS66591 [1,0,0,0,0,0|1,0,0]=2 214 B4R0.2 CCCC[O-] TS67287 [1,0,0,0,0,0|1,0,0]=2 215 B4R0.2 CCCC[O-] TS82799 [1,0,0,0,0,0|1,0,0]=2 216 B4R0.2 CCCC[O-] TS83727 [1,0,0,0,0,0|1,0,0]=2 217 B4R0.2 CCCC[S-] TS31943 [1,0,0,0,0,0|1,0,0]=2 218 B4R0.2 CCCC[Si] TS71817 [1,0,0,0,0,0|0,1,0]=2 219 B4R0.2 CCCC[Zn+] TS19474 [1,0,0,0,0,0|1,0,0]=2 220 B4R0.2 CCCNC TS03381 [1,0,0,0,0,0|1,0,0]=2 221 B4R0.2 CCCOC TS03404 [1,0,0,0,0,0|1,0,0]=2 222 B4R0.2 CCCO[NH3+] TS04256 [1,0,0,0,0,0|1,0,1]=3 223 B4R0.2 CCCSC TS71857 [1,0,0,0,0,0|1,0,0]=2 224 B4R0.2 CCC[Mg]Br TS07380 [1,0,0,0,0,0|2,0,0]=3 225 B4R0.2 CCC[Mg]Cl TS31623 [1,0,0,0,0,0|2,0,0]=3 226 B4R0.2 CCC[Zn]Br TS50817 [1,0,0,0,0,0|2,0,0]=3 227 B4R0.2 CCN=C=O TS01458 [1,0,0,0,0,0|2,0,1]=4 228 B4R0.2 CCN=C=S TS71772 [1,0,0,0,0,0|2,0,1]=4 229 B4R0.2 CCNC=O TS03379 [1,0,0,0,0,0|2,0,1]=4 230 B4R0.2 CCNCC TS03384 [1,0,0,0,0,0|1,0,0]=2 231 B4R0.2 CCNCC TS04169 [1,0,0,0,0,0|1,0,0]=2 232 B4R0.2 CCNCC TS05835 [1,0,0,0,0,0|1,0,0]=2 233 B4R0.2 CCNCC TS10368 [1,0,0,0,0,0|1,0,0]=2 234 B4R0.2 CCNCC TS12959 [1,0,0,0,0,0|1,0,0]=2 235 B4R0.2 CCOC#C TS71444 [1,0,0,0,0,0|1,0,2]=4 236 B4R0.2 CCOC=C TS71601 [1,0,0,0,0,0|1,0,2]=4 237 B4R0.2 CCOC=O TS03393 [1,0,0,0,0,0|2,0,1]=4 238 B4R0.2 CCOCC TS03401 [1,0,0,0,0,0|1,0,0]=2 239 B4R0.2 CCOCC TS42371 [1,0,0,0,0,0|1,0,0]=2 240 B4R0.2 CCOCC TS43884 [1,0,0,0,0,0|1,0,0]=2 241 B4R0.2 CCOCC TS68115 [1,0,0,0,0,0|1,0,0]=2 242 B4R0.2 CCOCC TS79120 [1,0,0,0,0,0|1,0,0]=2 243 B4R0.2 CCOCCl TS39832 [1,0,0,0,0,0|2,0,0]=3 244 B4R0.2 CCON=O TS71627 [1,0,0,0,0,0|3,0,0]=4 245 B4R0.2 CCPCC TS71830 [1,0,0,0,0,0|1,0,0]=2 246 B4R0.2 CCSC#N TS71770 [1,0,0,0,0,0|1,0,2]=4 247 B4R0.2 CCSC=C TS71813 [1,0,0,0,0,0|1,0,2]=4 248 B4R0.2 CCSCC TS71853 [1,0,0,0,0,0|1,0,0]=2 249 B4R0.2 CCSSC TS04155 [1,0,0,0,0,0|2,0,0]=3 250 B4R0.2 CC[Al+]CC TS32445 [1,0,0,0,0,0|1,0,0]=2 251 B4R0.2 CC[Al+]CC TS36486 [1,0,0,0,0,0|1,0,0]=2 252 B4R0.2 CC[Cd]CC TS45221 [1,0,0,0,0,0|1,0,0]=2 253 B4R0.2 CC[Ga+]CC TS42641 [1,0,0,0,0,0|1,0,0]=2 254 B4R0.2 CC[GeH2]CC TS36741 [1,0,0,0,0,0|0,1,0]=2 255 B4R0.2 CC[Hg]CC TS68206 [1,0,0,0,0,0|1,0,0]=2 256 B4R0.2 CC[Mg]CC TS71690 [1,0,0,0,0,0|1,0,0]=2 257 B4R0.2 CC[N-]CC TS71656 [1,0,0,0,0,0|1,0,0]=2 258 B4R0.2 CC[Se]CC TS37078 [1,0,0,0,0,0|1,0,0]=2 259 B4R0.2 CC[SiH2]CC TS71816 [1,0,0,0,0,0|0,1,0]=2 260 B4R0.2 CC[Te]CC TS15549 [1,0,0,0,0,0|1,0,0]=2 261 B4R0.2 CC[Zn]CC TS04983 [1,0,0,0,0,0|1,0,0]=2 262 B4R0.2 CNCC#N TS03334 [1,0,0,0,0,0|1,0,2]=4 263 B4R0.2 CNCC#N TS12514 [1,0,0,0,0,0|1,0,2]=4 264 B4R0.2 CNCC#N TS56312 [1,0,0,0,0,0|1,0,2]=4 265 B4R0.2 CNCCN TS03408 [1,0,0,0,0,0|1,0,0]=2 266 B4R0.2 CNCCO TS00099 [1,0,0,0,0,0|2,0,0]=3 267 B4R0.2 COCC#C TS09815 [1,0,0,0,0,0|1,0,2]=4 268 B4R0.2 COCC#N TS03371 [1,0,0,0,0,0|1,0,2]=4 269 B4R0.2 COCC=C TS94286 [1,0,0,0,0,0|1,0,2]=4 270 B4R0.2 COCC=O TS03388 [1,0,0,0,0,0|2,0,1]=4 271 B4R0.2 COCCBr TS65036 [1,0,0,0,0,0|2,0,0]=3 272 B4R0.2 COCCBr TS93982 [1,0,0,0,0,0|2,0,0]=3 273 B4R0.2 COCCCl TS03687 [1,0,0,0,0,0|2,0,0]=3 274 B4R0.2 COCCN TS71632 [1,0,0,0,0,0|1,0,0]=2 275 B4R0.2 COCCO TS71642 [1,0,0,0,0,0|2,0,0]=3 276 B4R0.2 COCC[O-] TS03754 [1,0,0,0,0,0|2,0,0]=3 277 B4R0.2 COCC[O-] TS44727 [1,0,0,0,0,0|2,0,0]=3 278 B4R0.2 COCC[O-] TS45853 [1,0,0,0,0,0|2,0,0]=3 279 B4R0.2 COCOC TS08721 [1,0,0,0,0,0|2,0,0]=3 280 B4R0.2 CSCC=C TS71811 [1,0,0,0,0,0|1,0,2]=4 281 B4R0.2 CSCCCl TS31867 [1,0,0,0,0,0|2,0,0]=3 282 B4R0.2 CSCCCl TS93571 [1,0,0,0,0,0|2,0,0]=3 283 B4R0.2 CSCCN TS03646 [1,0,0,0,0,0|1,0,0]=2 284 B4R0.2 CSCCO TS71862 [1,0,0,0,0,0|2,0,0]=3 285 B4R0.2 CSCSC TS04154 [1,0,0,0,0,0|2,0,0]=3 286 B4R0.2 CSSSC TS36187 [1,0,0,0,0,0|3,0,0]=4 287 B4R0.2 [2H]OCCC TS65595 [1,0,0,0,0,0|2,0,0]=3 288 B4R0.2 [Li]CCCC TS39912 [1,0,0,0,0,0|1,0,0]=2 289 B6R0.1 C(C#N)C(CCl)O TS04800 [0,1,0,0,0,0|1,0,2]=4 290 B6R0.1 C(C#N)[C@@H](CCl)O TS60183 [0,1,0,0,0,0|1,0,2]=4 291 B6R0.1 C(C#N)[C@@H](CO)O TS31545 [0,1,0,0,0,0|1,0,2]=4 292 B6R0.1 C(C#N)[C@H](CCl)O TS04801 [0,1,0,0,0,0|1,0,2]=4 293 B6R0.1 C(C(=O)OCO)N TS05233 [0,1,0,0,0,0|2,0,1]=4 294 B6R0.1 C(CBr)C(CBr)Br TS35747 [0,1,0,0,0,0|2,0,0]=3 295 B6R0.1 C(CBr)C(CCl)Cl TS38906 [0,1,0,0,0,0|2,0,0]=3 296 B6R0.1 C(CCl)C(CCl)O TS06819 [0,1,0,0,0,0|2,0,0]=3 297 B6R0.1 C(CN)C(=O)CN TS13627 [0,1,0,0,0,0|1,0,1]=3 298 B6R0.1 C(CO)C(=O)CN TS37313 [0,1,0,0,0,0|1,0,1]=3 299 B6R0.1 C(CO)C(CO)O TS04081 [0,1,0,0,0,0|2,0,0]=3 300 B6R0.1 C(CO)C(CO)O TS94708 [0,1,0,0,0,0|2,0,0]=3 301 B6R0.1 C(CO)[C@@H](CO)O TS94709 [0,1,0,0,0,0|2,0,0]=3 302 B6R0.1 C(CO)[C@H](CCl)O TS36026 [0,1,0,0,0,0|2,0,0]=3 303 B6R0.1 C(CO)[C@H](CO)O TS04082 [0,1,0,0,0,0|2,0,0]=3 304 B6R0.1 C([C@@H](COS)O)O TS31783 [0,1,0,0,0,0|3,0,0]=4 305 B6R0.1 C=CC(CCO)N TS31560 [0,1,0,0,0,0|1,0,2]=4 306 B6R0.1 CC(CC=O)SC TS32354 [0,1,0,0,0,0|2,0,1]=4 307 B6R0.1 CC(CCO)C=C TS31514 [0,1,0,0,0,0|1,0,2]=4 308 B6R0.1 CC(CCO)OC TS04039 [0,1,0,0,0,0|2,0,0]=3 309 B6R0.1 CC(COC)OC TS94098 [0,1,0,0,0,0|3,0,0]=4 310 B6R0.1 CC=C(C)CCO TS03864 [0,1,0,0,0,0|1,0,2]=4 311 B6R0.1 CCC(=O)CC#N TS31393 [0,1,0,0,0,0|0,0,3]=4 312 B6R0.1 CCC(=O)CSC TS32357 [0,1,0,0,0,0|2,0,1]=4 313 B6R0.1 CCC(=O)NCC TS03904 [0,1,0,0,0,0|2,0,1]=4 314 B6R0.1 CCC(=O)OCC TS03938 [0,1,0,0,0,0|2,0,1]=4 315 B6R0.1 CCC(=O)SCC TS32362 [0,1,0,0,0,0|2,0,1]=4 316 B6R0.1 CCC(C#CC)O TS31428 [0,1,0,0,0,0|1,0,2]=4 317 B6R0.1 CCC(C)C#CC TS03735 [0,1,0,0,0,0|1,0,2]=4 318 B6R0.1 CCC(C)C=CC TS03791 [0,1,0,0,0,0|1,0,2]=4 319 B6R0.1 CCC(C)CC#C TS03734 [0,1,0,0,0,0|1,0,1]=3 320 B6R0.1 CCC(C)CC=C TS03804 [0,1,0,0,0,0|1,0,1]=3 321 B6R0.1 CCC(C)CC=O TS31513 [0,1,0,0,0,0|1,0,1]=3 322 B6R0.1 CCC(C)CCBr TS42853 [0,1,0,0,0,0|1,0,0]=2 323 B6R0.1 CCC(C)CCO TS31615 [0,1,0,0,0,0|1,0,0]=2 324 B6R0.1 CCC(C)N=C=S TS04544 [0,1,0,0,0,0|2,0,1]=4 325 B6R0.1 CCC(C)ON=O TS31635 [0,1,0,0,0,0|3,0,0]=4 326 B6R0.1 CCC(C)SCC TS04755 [0,1,0,0,0,0|2,0,0]=3 327 B6R0.1 CCC(C=CC)O TS03868 [0,1,0,0,0,0|1,0,2]=4 328 B6R0.1 CCC(CC#C)O TS31435 [0,1,0,0,0,0|1,0,1]=3 329 B6R0.1 CCC(CC=C)O TS31532 [0,1,0,0,0,0|1,0,1]=3 330 B6R0.1 CCC(CCN)N TS03976 [0,1,0,0,0,0|0,0,0]=1 331 B6R0.1 CCC(COC)N TS04013 [0,1,0,0,0,0|2,0,0]=3 332 B6R0.1 CCC(COC)O TS04038 [0,1,0,0,0,0|2,0,0]=3 333 B6R0.1 CCCC(=C)C=O TS31425 [0,1,0,0,0,0|1,0,2]=4 334 B6R0.1 CCCC(=C)CC TS03794 [0,1,0,0,0,0|1,0,1]=3 335 B6R0.1 CCCC(=CC)C TS31455 [0,1,0,0,0,0|1,0,2]=4 336 B6R0.1 CCCC(=O)CC TS31522 [0,1,0,0,0,0|1,0,1]=3 337 B6R0.1 CCCC(=O)NN TS31598 [0,1,0,0,0,0|1,0,1]=3 338 B6R0.1 CCCC(=O)OC TS03955 [0,1,0,0,0,0|2,0,1]=4 339 B6R0.1 CCCC(=S)OC TS32358 [0,1,0,0,0,0|2,0,1]=4 340 B6R0.1 CCCC(C#C)O TS31446 [0,1,0,0,0,0|1,0,1]=3 341 B6R0.1 CCCC(C)C#C TS31387 [0,1,0,0,0,0|1,0,1]=3 342 B6R0.1 CCCC(C)C=C TS03798 [0,1,0,0,0,0|1,0,1]=3 343 B6R0.1 CCCC(C)C=O TS01565 [0,1,0,0,0,0|1,0,1]=3 344 B6R0.1 CCCC(C)CBr TS42857 [0,1,0,0,0,0|1,0,0]=2 345 B6R0.1 CCCC(C)CC TS03886 [0,1,0,0,0,0|1,0,0]=2 346 B6R0.1 CCCC(C)CO TS39282 [0,1,0,0,0,0|1,0,0]=2 347 B6R0.1 CCCC(C)NC TS03920 [0,1,0,0,0,0|2,0,0]=3 348 B6R0.1 CCCC(C=C)O TS03859 [0,1,0,0,0,0|1,0,1]=3 349 B6R0.1 CCCC(CBr)Br TS52925 [0,1,0,0,0,0|1,0,0]=2 350 B6R0.1 CCCC(CC)Br TS42856 [0,1,0,0,0,0|1,0,0]=2 351 B6R0.1 CCCC(CC)Cl TS04841 [0,1,0,0,0,0|1,0,0]=2 352 B6R0.1 CCCC(CC)I TS44109 [0,1,0,0,0,0|1,0,0]=2 353 B6R0.1 CCCC(CC)N TS31564 [0,1,0,0,0,0|1,0,0]=2 354 B6R0.1 CCCC(CC)O TS31611 [0,1,0,0,0,0|1,0,0]=2 355 B6R0.1 CCCC(CC)S TS40939 [0,1,0,0,0,0|1,0,0]=2 356 B6R0.1 CCCC(CC)[Zn+] TS24971 [0,1,0,0,0,0|1,0,0]=2 357 B6R0.1 CCCC(CCl)Cl TS06553 [0,1,0,0,0,0|1,0,0]=2 358 B6R0.1 CCCC(CO)O TS04026 [0,1,0,0,0,0|1,0,0]=2 359 B6R0.1 CCCN(C)N=O TS31599 [0,1,0,0,0,0|3,0,0]=4 360 B6R0.1 CCC[C@@H](CO)N TS04002 [0,1,0,0,0,0|1,0,0]=2 361 B6R0.1 CCC[C@@H](CO)O TS04042 [0,1,0,0,0,0|1,0,0]=2 362 B6R0.1 CCC[C@H](CO)N TS04000 [0,1,0,0,0,0|1,0,0]=2 363 B6R0.1 CCNC(=O)CCl TS04876 [0,1,0,0,0,0|2,0,1]=4 364 B6R0.1 CCOC(=O)CBr TS56141 [0,1,0,0,0,0|2,0,1]=4 365 B6R0.1 CCOC(=O)CCl TS39825 [0,1,0,0,0,0|2,0,1]=4 366 B6R0.1 CCOC(=O)CF TS65215 [0,1,0,0,0,0|2,0,1]=4 367 B6R0.1 CCOC(=O)CN TS31646 [0,1,0,0,0,0|1,0,1]=3 368 B6R0.1 CCOC(=O)CN TS33221 [0,1,0,0,0,0|1,0,1]=3 369 B6R0.1 CCOC(=O)CO TS56147 [0,1,0,0,0,0|2,0,1]=4 370 B6R0.1 CCOC(=O)CS TS01466 [0,1,0,0,0,0|2,0,1]=4 371 B6R0.1 CCOC(=O)NN TS59780 [0,1,0,0,0,0|2,0,1]=4 372 B6R0.1 CCOC(CBr)Br TS25152 [0,1,0,0,0,0|2,0,0]=3 373 B6R0.1 CCOC(CCl)Cl TS06818 [0,1,0,0,0,0|2,0,0]=3 374 B6R0.1 CC[C@H](C)CCBr TS42859 [0,1,0,0,0,0|1,0,0]=2 375 B6R0.1 CC[C@H](C)CCO TS31612 [0,1,0,0,0,0|1,0,0]=2 376 B6R0.1 CNCC(CO)O TS04078 [0,1,0,0,0,0|2,0,0]=3 377 B6R0.1 COC(=O)CCBr TS56269 [0,1,0,0,0,0|2,0,1]=4 378 B6R0.1 COC(=O)CCCl TS04939 [0,1,0,0,0,0|2,0,1]=4 379 B6R0.1 COC(=O)CCN TS08577 [0,1,0,0,0,0|1,0,1]=3 380 B6R0.1 COC(=O)CCO TS65233 [0,1,0,0,0,0|2,0,1]=4 381 B6R0.1 COC(=O)CCS TS04824 [0,1,0,0,0,0|2,0,1]=4 382 B6R0.1 COCC(CCl)O TS36028 [0,1,0,0,0,0|2,0,0]=3 383 B6R0.1 COCC(CF)O TS31763 [0,1,0,0,0,0|2,0,0]=3 384 B6R0.1 COCC(CO)O TS04080 [0,1,0,0,0,0|2,0,0]=3 385 B6R0.1 CSCC(CO)O TS32525 [0,1,0,0,0,0|2,0,0]=3 386 B6R0.1 C[C@@H](CCO)CO TS04034 [0,1,0,0,0,0|2,0,0]=3 387 B6R0.1 C[C@H](CCO)CO TS04033 [0,1,0,0,0,0|2,0,0]=3 388 B6R0.4 B(CCCC)(Cl)Cl TS06333 [0,1,0,0,0,0|2,0,0]=3 389 B6R0.4 B(CCCC)(O)O TS94589 [0,1,0,0,0,0|2,0,0]=3 390 B6R0.4 C(CC(=O)Cl)CBr TS94813 [0,1,0,0,0,0|2,0,1]=4 391 B6R0.4 C(CC(=O)Cl)CCl TS33157 [0,1,0,0,0,0|2,0,1]=4 392 B6R0.4 C(CC(=O)N)CN TS37256 [0,1,0,0,0,0|1,0,1]=3 393 B6R0.4 C(CC(=O)O)CBr TS39744 [0,1,0,0,0,0|2,0,1]=4 394 B6R0.4 C(CC(=O)O)CI TS44433 [0,1,0,0,0,0|2,0,1]=4 395 B6R0.4 C(CC(=O)O)CN TS31643 [0,1,0,0,0,0|1,0,1]=3 396 B6R0.4 C(CC(=O)[O-])CO TS01692 [0,1,0,0,0,0|2,0,1]=4 397 B6R0.4 C(CCl)NC(=O)N TS04945 [0,1,0,0,0,0|2,0,1]=4 398 B6R0.4 C(CCl)OC(=O)N TS04987 [0,1,0,0,0,0|2,0,1]=4 399 B6R0.4 C(CNC(=S)S)N TS37061 [0,1,0,0,0,0|2,0,1]=4 400 B6R0.4 C(CO)NC(=O)N TS04021 [0,1,0,0,0,0|2,0,1]=4 401 B6R0.4 C(CO[N+](=O)[O-])N TS31727 [0,1,0,0,0,0|3,0,0]=4 402 B6R0.4 C(C[N+](=O)[O-])CO TS04073 [0,1,0,0,0,0|3,0,0]=4 403 B6R0.4 CC#CCC(C)C TS31389 [0,1,0,0,0,0|1,0,2]=4 404 B6R0.4 CC(=C)CCC=C TS03725 [0,1,0,0,0,0|1,0,2]=4 405 B6R0.4 CC(=C)CCCO TS31523 [0,1,0,0,0,0|1,0,1]=3 406 B6R0.4 CC(=CCCO)C TS03867 [0,1,0,0,0,0|1,0,2]=4 407 B6R0.4 CC(=O)CCC=C TS31440 [0,1,0,0,0,0|1,0,2]=4 408 B6R0.4 CC(=O)CCCCl TS03260 [0,1,0,0,0,0|1,0,1]=3 409 B6R0.4 CC(=O)CCCO TS39779 [0,1,0,0,0,0|1,0,1]=3 410 B6R0.4 CC(=O)CCSC TS32359 [0,1,0,0,0,0|2,0,1]=4 411 B6R0.4 CC(=O)NCCN TS31596 [0,1,0,0,0,0|1,0,1]=3 412 B6R0.4 CC(=O)NCCO TS03989 [0,1,0,0,0,0|2,0,1]=4 413 B6R0.4 CC(=O)NCCS TS04795 [0,1,0,0,0,0|2,0,1]=4 414 B6R0.4 CC(=O)OCCBr TS55164 [0,1,0,0,0,0|2,0,1]=4 415 B6R0.4 CC(=O)OCCCl TS04941 [0,1,0,0,0,0|2,0,1]=4 416 B6R0.4 CC(=O)OCCO TS31665 [0,1,0,0,0,0|2,0,1]=4 417 B6R0.4 CC(C)CCC#C TS03732 [0,1,0,0,0,0|1,0,1]=3 418 B6R0.4 CC(C)CCC=C TS03801 [0,1,0,0,0,0|1,0,1]=3 419 B6R0.4 CC(C)CCC=O TS39767 [0,1,0,0,0,0|1,0,1]=3 420 B6R0.4 CC(C)CCCBr TS42858 [0,1,0,0,0,0|1,0,0]=2 421 B6R0.4 CC(C)CCCO TS03963 [0,1,0,0,0,0|1,0,0]=2 422 B6R0.4 CC(C)CCNC TS03922 [0,1,0,0,0,0|2,0,0]=3 423 B6R0.4 CC(C)CN=C=S TS04543 [0,1,0,0,0,0|2,0,1]=4 424 B6R0.4 CC(C)COC=C TS31530 [0,1,0,0,0,0|2,0,1]=4 425 B6R0.4 CC(C)COC=O TS03939 [0,1,0,0,0,0|2,0,1]=4 426 B6R0.4 CC(C)CON=O TS03992 [0,1,0,0,0,0|3,0,0]=4 427 B6R0.4 CC(C)NCC#N TS03785 [0,1,0,0,0,0|1,0,2]=4 428 B6R0.4 CC(C)NCCN TS03977 [0,1,0,0,0,0|1,0,0]=2 429 B6R0.4 CC(C)NCCO TS04007 [0,1,0,0,0,0|2,0,0]=3 430 B6R0.4 CC(C)OCCN TS39675 [0,1,0,0,0,0|1,0,0]=2 431 B6R0.4 CC(C)OCCO TS04040 [0,1,0,0,0,0|2,0,0]=3 432 B6R0.4 CC(C)SCC=C TS04640 [0,1,0,0,0,0|2,0,1]=4 433 B6R0.4 CC(C)SCCO TS32430 [0,1,0,0,0,0|2,0,0]=3 434 B6R0.4 CC(CCC=C)Br TS11654 [0,1,0,0,0,0|1,0,1]=3 435 B6R0.4 CC(CCC=C)O TS31524 [0,1,0,0,0,0|1,0,1]=3 436 B6R0.4 CC(CCCBr)Br TS52922 [0,1,0,0,0,0|1,0,0]=2 437 B6R0.4 CC(CCCO)O TS04032 [0,1,0,0,0,0|1,0,0]=2 438 B6R0.4 CC=CCC(C)C TS03790 [0,1,0,0,0,0|1,0,2]=4 439 B6R0.4 CCC#CC(C)C TS03722 [0,1,0,0,0,0|1,0,2]=4 440 B6R0.4 CCC#CC(C)O TS31430 [0,1,0,0,0,0|1,0,2]=4 441 B6R0.4 CCC=CC(C)C TS03789 [0,1,0,0,0,0|1,0,2]=4 442 B6R0.4 CCCCC(=C)C TS31452 [0,1,0,0,0,0|1,0,1]=3 443 B6R0.4 CCCCC(=O)Br TS42846 [0,1,0,0,0,0|1,0,1]=3 444 B6R0.4 CCCCC(=O)C TS31529 [0,1,0,0,0,0|1,0,1]=3 445 B6R0.4 CCCCC(=O)Cl TS32451 [0,1,0,0,0,0|1,0,1]=3 446 B6R0.4 CCCCC(=O)N TS31554 [0,1,0,0,0,0|0,0,1]=2 447 B6R0.4 CCCCC(=O)O TS03958 [0,1,0,0,0,0|1,0,1]=3 448 B6R0.4 CCCCC(=O)[O-] TS04789 [0,1,0,0,0,0|1,0,1]=3 449 B6R0.4 CCCCC(=O)[O-] TS30457 [0,1,0,0,0,0|1,0,1]=3 450 B6R0.4 CCCCC(C)Br TS42855 [0,1,0,0,0,0|1,0,0]=2 451 B6R0.4 CCCCC(C)C TS03881 [0,1,0,0,0,0|1,0,0]=2 452 B6R0.4 CCCCC(C)Cl TS04843 [0,1,0,0,0,0|1,0,0]=2 453 B6R0.4 CCCCC(C)I TS44108 [0,1,0,0,0,0|1,0,0]=2 454 B6R0.4 CCCCC(C)N TS31565 [0,1,0,0,0,0|0,0,0]=1 455 B6R0.4 CCCCC(C)O TS31617 [0,1,0,0,0,0|1,0,0]=2 456 B6R0.4 CCCCN(C)C TS03927 [0,1,0,0,0,0|2,0,0]=3 457 B6R0.4 CCCC[C@@H](C)N TS03923 [0,1,0,0,0,0|0,0,0]=1 458 B6R0.4 CCCC[C@@H](C)O TS03965 [0,1,0,0,0,0|1,0,0]=2 459 B6R0.4 CCCC[C@H](C)N TS03919 [0,1,0,0,0,0|0,0,0]=1 460 B6R0.4 CCCC[C@H](C)O TS31613 [0,1,0,0,0,0|1,0,0]=2 461 B6R0.4 CCCC[N+](=O)[O-] TS31647 [0,1,0,0,0,0|2,0,0]=3 462 B6R0.4 CCCC[Si](C)C TS04645 [0,1,0,0,0,0|1,1,0]=3 463 B6R0.4 CCCC[Sn](=O)O TS43570 [0,1,0,0,0,0|2,0,0]=3 464 B6R0.4 CCCNC(=O)N TS31594 [0,1,0,0,0,0|1,0,1]=3 465 B6R0.4 CCCNC(=O)[O-] TS31634 [0,1,0,0,0,0|2,0,1]=4 466 B6R0.4 CCCNC(C)C TS03926 [0,1,0,0,0,0|2,0,0]=3 467 B6R0.4 CCCOC(=O)C TS03949 [0,1,0,0,0,0|2,0,1]=4 468 B6R0.4 CCCOC(=O)Cl TS55808 [0,1,0,0,0,0|2,0,1]=4 469 B6R0.4 CCCON(=O)=O TS04066 [0,1,0,0,0,0|3,0,0]=4 470 B6R0.4 CCCSC(=O)C TS32364 [0,1,0,0,0,0|2,0,1]=4 471 B6R0.4 CCCSC(=O)Cl TS06329 [0,1,0,0,0,0|2,0,1]=4 472 B6R0.4 CCCSC(C)C TS32368 [0,1,0,0,0,0|2,0,0]=3 473 B6R0.4 CCC[SiH2]C(Cl)Cl TS41736 [0,1,0,0,0,0|1,1,0]=3 474 B6R0.4 CCNCC(=C)C TS03829 [0,1,0,0,0,0|2,0,1]=4 475 B6R0.4 CCNCC(=O)O TS01936 [0,1,0,0,0,0|2,0,1]=4 476 B6R0.4 CCOCC(=O)O TS16814 [0,1,0,0,0,0|2,0,1]=4 477 B6R0.4 CCOCC(C)C TS03959 [0,1,0,0,0,0|2,0,0]=3 478 B6R0.4 CCSCC(=O)C TS32360 [0,1,0,0,0,0|2,0,1]=4 479 B6R0.4 CCSCC(=O)O TS04822 [0,1,0,0,0,0|2,0,1]=4 480 B6R0.4 CCSCC(C)C TS04752 [0,1,0,0,0,0|2,0,0]=3 481 B6R0.4 CN(C)CCC#N TS03786 [0,1,0,0,0,0|1,0,2]=4 482 B6R0.4 CN(C)CCCN TS39904 [0,1,0,0,0,0|1,0,0]=2 483 B6R0.4 CN(C)CCCO TS03999 [0,1,0,0,0,0|2,0,0]=3 484 B6R0.4 CNCCC(=O)O TS03990 [0,1,0,0,0,0|2,0,1]=4 485 B6R0.4 CNCCN(C)C TS39408 [0,1,0,0,0,0|3,0,0]=4 486 B6R0.4 COCCC(=O)O TS31660 [0,1,0,0,0,0|2,0,1]=4 487 B6R0.4 C[C@@H](CCC=C)O TS03860 [0,1,0,0,0,0|1,0,1]=3 488 B6R0.6 C#CCCCC#C TS71858 [0,1,0,0,0,0|1,0,2]=4 489 B6R0.6 C#CCCCCCl TS04652 [0,1,0,0,0,0|1,0,1]=3 490 B6R0.6 C#CCCCCO TS31426 [0,1,0,0,0,0|1,0,1]=3 491 B6R0.6 C#CCOCCO TS31499 [0,1,0,0,0,0|1,0,2]=4 492 B6R0.6 C(CBr)OCCBr TS08788 [0,1,0,0,0,0|2,0,0]=3 493 B6R0.6 C(CC#N)CC#N TS56169 [0,1,0,0,0,0|0,0,3]=4 494 B6R0.6 C(CC#N)CC#N TS93878 [0,1,0,0,0,0|0,0,3]=4 495 B6R0.6 C(CC=O)CC=O TS03842 [0,1,0,0,0,0|1,0,2]=4 496 B6R0.6 C(CC=O)CC=O TS38555 [0,1,0,0,0,0|1,0,2]=4 497 B6R0.6 C(CCBr)CC#N TS11479 [0,1,0,0,0,0|0,0,2]=3 498 B6R0.6 C(CCBr)CCBr TS07888 [0,1,0,0,0,0|1,0,0]=2 499 B6R0.6 C(CCCl)CC#N TS08706 [0,1,0,0,0,0|0,0,2]=3 500 B6R0.6 C(CCCl)CC=O TS32450 [0,1,0,0,0,0|1,0,1]=3 501 B6R0.6 C(CCCl)CCBr TS48788 [0,1,0,0,0,0|1,0,0]=2 502 B6R0.6 C(CCCl)CCCl TS06550 [0,1,0,0,0,0|1,0,0]=2 503 B6R0.6 C(CCCl)CCI TS53384 [0,1,0,0,0,0|1,0,0]=2 504 B6R0.6 C(CCCl)CC[Zn+] TS28126 [0,1,0,0,0,0|1,0,0]=2 505 B6R0.6 C(CCI)CCI TS77462 [0,1,0,0,0,0|1,0,0]=2 506 B6R0.6 C(CCN)CCN TS03978 [0,1,0,0,0,0|0,0,0]=1 507 B6R0.6 C(CCN)CCN TS45899 [0,1,0,0,0,0|0,0,0]=1 508 B6R0.6 C(CCN)CCO TS04006 [0,1,0,0,0,0|0,0,0]=1 509 B6R0.6 C(CCO)CC=O TS03340 [0,1,0,0,0,0|1,0,1]=3 510 B6R0.6 C(CCO)CCBr TS09812 [0,1,0,0,0,0|1,0,0]=2 511 B6R0.6 C(CCO)CCCl TS71520 [0,1,0,0,0,0|1,0,0]=2 512 B6R0.6 C(CCO)CCO TS46820 [0,1,0,0,0,0|1,0,0]=2 513 B6R0.6 C(CCS)CCS TS37065 [0,1,0,0,0,0|1,0,0]=2 514 B6R0.6 C(CC[Zn+])CC#N TS24406 [0,1,0,0,0,0|0,0,2]=3 515 B6R0.6 C(CCl)NCCCl TS55773 [0,1,0,0,0,0|2,0,0]=3 516 B6R0.6 C(CCl)OCCCl TS00044 [0,1,0,0,0,0|2,0,0]=3 517 B6R0.6 C(CI)OCCI TS63369 [0,1,0,0,0,0|2,0,0]=3 518 B6R0.6 C(CN=C=O)CCl TS04799 [0,1,0,0,0,0|2,0,1]=4 519 B6R0.6 C(CN=C=S)CBr TS14498 [0,1,0,0,0,0|2,0,1]=4 520 B6R0.6 C(CN=C=S)CCl TS06025 [0,1,0,0,0,0|2,0,1]=4 521 B6R0.6 C(CNCCN)N TS04014 [0,1,0,0,0,0|1,0,0]=2 522 B6R0.6 C(CNCCO)N TS00063 [0,1,0,0,0,0|1,0,0]=2 523 B6R0.6 C(CO)NCCO TS04076 [0,1,0,0,0,0|2,0,0]=3 524 B6R0.6 C(CO)NCCO TS37530 [0,1,0,0,0,0|2,0,0]=3 525 B6R0.6 C(CO)NCCO TS76269 [0,1,0,0,0,0|2,0,0]=3 526 B6R0.6 C(COCC=O)O TS31664 [0,1,0,0,0,0|2,0,1]=4 527 B6R0.6 C(COCCCl)O TS36027 [0,1,0,0,0,0|2,0,0]=3 528 B6R0.6 C(COCCN)N TS04047 [0,1,0,0,0,0|1,0,0]=2 529 B6R0.6 C(COCCN)N TS47125 [0,1,0,0,0,0|1,0,0]=2 530 B6R0.6 C(COCCO)N TS04075 [0,1,0,0,0,0|1,0,0]=2 531 B6R0.6 C(COCCO)O TS01431 [0,1,0,0,0,0|2,0,0]=3 532 B6R0.6 C(COCCS)O TS32524 [0,1,0,0,0,0|2,0,0]=3 533 B6R0.6 C(CS)OCCS TS37236 [0,1,0,0,0,0|2,0,0]=3 534 B6R0.6 C(CSCCN)N TS32436 [0,1,0,0,0,0|1,0,0]=2 535 B6R0.6 C(CSCCO)N TS04873 [0,1,0,0,0,0|1,0,0]=2 536 B6R0.6 C(CSCCO)O TS32771 [0,1,0,0,0,0|2,0,0]=3 537 B6R0.6 C(CSCCS)S TS10516 [0,1,0,0,0,0|2,0,0]=3 538 B6R0.6 C=CCCCC#C TS03679 [0,1,0,0,0,0|1,0,2]=4 539 B6R0.6 C=CCCCC=C TS03728 [0,1,0,0,0,0|1,0,2]=4 540 B6R0.6 C=CCCCCBr TS33003 [0,1,0,0,0,0|1,0,1]=3 541 B6R0.6 C=CCCCCCl TS04773 [0,1,0,0,0,0|1,0,1]=3 542 B6R0.6 C=CCCCCN TS03830 [0,1,0,0,0,0|0,0,1]=2 543 B6R0.6 C=CCCCCO TS71562 [0,1,0,0,0,0|1,0,1]=3 544 B6R0.6 C=CCCOCCl TS04837 [0,1,0,0,0,0|1,0,2]=4 545 B6R0.6 C=CCOCCBr TS42844 [0,1,0,0,0,0|1,0,2]=4 546 B6R0.6 C=CCOCCCl TS32452 [0,1,0,0,0,0|1,0,2]=4 547 B6R0.6 C=CCOCCO TS31592 [0,1,0,0,0,0|1,0,2]=4 548 B6R0.6 CC=CCCCO TS31509 [0,1,0,0,0,0|1,0,1]=3 549 B6R0.6 CC=CCCCO TS31521 [0,1,0,0,0,0|1,0,1]=3 550 B6R0.6 CCC#CCC=C TS03677 [0,1,0,0,0,0|1,0,2]=4 551 B6R0.6 CCC#COCC TS31433 [0,1,0,0,0,0|1,0,2]=4 552 B6R0.6 CCC=CCC=O TS31443 [0,1,0,0,0,0|1,0,2]=4 553 B6R0.6 CCC=CCCO TS31511 [0,1,0,0,0,0|1,0,1]=3 554 B6R0.6 CCC=CCCO TS31515 [0,1,0,0,0,0|1,0,1]=3 555 B6R0.6 CCCC#CC=C TS03678 [0,1,0,0,0,0|1,0,2]=4 556 B6R0.6 CCCC#CCC TS03730 [0,1,0,0,0,0|1,0,1]=3 557 B6R0.6 CCCC=CC=O TS31421 [0,1,0,0,0,0|1,0,2]=4 558 B6R0.6 CCCC=CC=O TS31438 [0,1,0,0,0,0|1,0,2]=4 559 B6R0.6 CCCC=CC=O TS31444 [0,1,0,0,0,0|1,0,2]=4 560 B6R0.6 CCCC=CCO TS03865 [0,1,0,0,0,0|1,0,1]=3 561 B6R0.6 CCCCC#CC TS03724 [0,1,0,0,0,0|1,0,1]=3 562 B6R0.6 CCCCC=CBr TS11653 [0,1,0,0,0,0|1,0,1]=3 563 B6R0.6 CCCCC=CC TS03803 [0,1,0,0,0,0|1,0,1]=3 564 B6R0.6 CCCCCC#C TS03726 [0,1,0,0,0,0|1,0,0]=2 565 B6R0.6 CCCCCC#N TS31405 [0,1,0,0,0,0|0,0,1]=2 566 B6R0.6 CCCCCC=C TS31453 [0,1,0,0,0,0|1,0,0]=2 567 B6R0.6 CCCCCC=O TS39877 [0,1,0,0,0,0|1,0,0]=2 568 B6R0.6 CCCCCCBr TS00036 [0,1,0,0,0,0|1,0,0]=2 569 B6R0.6 CCCCCCC TS03885 [0,1,0,0,0,0|1,0,0]=2 570 B6R0.6 CCCCCCCl TS04842 [0,1,0,0,0,0|1,0,0]=2 571 B6R0.6 CCCCCCF TS31676 [0,1,0,0,0,0|1,0,0]=2 572 B6R0.6 CCCCCCI TS93973 [0,1,0,0,0,0|1,0,0]=2 573 B6R0.6 CCCCCCN TS31561 [0,1,0,0,0,0|0,0,0]=1 574 B6R0.6 CCCCCCN TS37145 [0,1,0,0,0,0|0,0,0]=1 575 B6R0.6 CCCCCCO TS39881 [0,1,0,0,0,0|1,0,0]=2 576 B6R0.6 CCCCCCS TS04753 [0,1,0,0,0,0|1,0,0]=2 577 B6R0.6 CCCCCC[SiH3] TS04643 [0,1,0,0,0,0|1,0,0]=2 578 B6R0.6 CCCCCC[Zn+] TS24970 [0,1,0,0,0,0|1,0,0]=2 579 B6R0.6 CCCCCNC TS03916 [0,1,0,0,0,0|0,0,0]=1 580 B6R0.6 CCCCCNN TS06331 [0,1,0,0,0,0|0,0,0]=1 581 B6R0.6 CCCCCSC TS04750 [0,1,0,0,0,0|1,0,0]=2 582 B6R0.6 CCCCC[Mg]Cl TS36578 [0,1,0,0,0,0|1,0,0]=2 583 B6R0.6 CCCCN=C=O TS93082 [0,1,0,0,0,0|1,0,1]=3 584 B6R0.6 CCCCN=C=S TS04546 [0,1,0,0,0,0|1,0,1]=3 585 B6R0.6 CCCCNC=O TS03902 [0,1,0,0,0,0|1,0,1]=3 586 B6R0.6 CCCCNCC TS03925 [0,1,0,0,0,0|1,0,0]=2 587 B6R0.6 CCCCOC=C TS33237 [0,1,0,0,0,0|1,0,1]=3 588 B6R0.6 CCCCOC=O TS03954 [0,1,0,0,0,0|1,0,1]=3 589 B6R0.6 CCCCOCC TS03964 [0,1,0,0,0,0|1,0,0]=2 590 B6R0.6 CCCCOCCl TS04949 [0,1,0,0,0,0|1,0,0]=2 591 B6R0.6 CCCCON=O TS31645 [0,1,0,0,0,0|1,0,1]=3 592 B6R0.6 CCCCSC#N TS04545 [0,1,0,0,0,0|0,0,2]=3 593 B6R0.6 CCCCSCC TS04749 [0,1,0,0,0,0|1,0,0]=2 594 B6R0.6 CCCCS[SnH]=O TS23939 [0,1,0,0,0,0|2,0,0]=3 595 B6R0.6 CCCNCCC TS39857 [0,1,0,0,0,0|1,0,0]=2 596 B6R0.6 CCCNCCN TS03973 [0,1,0,0,0,0|0,0,0]=1 597 B6R0.6 CCCNCCO TS04001 [0,1,0,0,0,0|1,0,0]=2 598 B6R0.6 CCCOCCC TS03967 [0,1,0,0,0,0|1,0,0]=2 599 B6R0.6 CCCOCCC TS49356 [0,1,0,0,0,0|1,0,0]=2 600 B6R0.6 CCCOCCCl TS04951 [0,1,0,0,0,0|1,0,0]=2 601 B6R0.6 CCCOCCN TS04012 [0,1,0,0,0,0|0,0,0]=1 602 B6R0.6 CCCSC=CC TS04637 [0,1,0,0,0,0|1,0,2]=4 603 B6R0.6 CCCSCC=C TS04636 [0,1,0,0,0,0|1,0,1]=3 604 B6R0.6 CCCSCCC TS04756 [0,1,0,0,0,0|1,0,0]=2 605 B6R0.6 CCCSCCO TS32433 [0,1,0,0,0,0|1,0,0]=2 606 B6R0.6 CCCSSCC TS37066 [0,1,0,0,0,0|2,0,0]=3 607 B6R0.6 CCCSSSC TS10513 [0,1,0,0,0,0|3,0,0]=4 608 B6R0.6 CCC[Hg]CCC TS35002 [0,1,0,0,0,0|1,0,0]=2 609 B6R0.6 CCNCCC#N TS03784 [0,1,0,0,0,0|0,0,2]=3 610 B6R0.6 CCNCCCN TS03975 [0,1,0,0,0,0|0,0,0]=1 611 B6R0.6 CCNCCNC TS03972 [0,1,0,0,0,0|1,0,0]=2 612 B6R0.6 CCOCCC#N TS03822 [0,1,0,0,0,0|0,0,2]=3 613 B6R0.6 CCOCCCBr TS12340 [0,1,0,0,0,0|1,0,0]=2 614 B6R0.6 CCOCCCCl TS04950 [0,1,0,0,0,0|1,0,0]=2 615 B6R0.6 CCOCCCN TS04010 [0,1,0,0,0,0|0,0,0]=1 616 B6R0.6 CCOCCCO TS04028 [0,1,0,0,0,0|1,0,0]=2 617 B6R0.6 CCOCCOC TS04027 [0,1,0,0,0,0|2,0,0]=3 618 B6R0.6 CCOCOCC TS74492 [0,1,0,0,0,0|2,0,0]=3 619 B6R0.6 CCSCCCO TS32432 [0,1,0,0,0,0|1,0,0]=2 620 B6R0.6 CCSSCC=C TS36882 [0,1,0,0,0,0|2,0,1]=4 621 B6R0.6 CCSSSCC TS10514 [0,1,0,0,0,0|3,0,0]=4 622 B6R0.6 CNCCCNC TS56351 [0,1,0,0,0,0|1,0,0]=2 623 B6R0.6 COCCCCBr TS03145 [0,1,0,0,0,0|1,0,0]=2 624 B6R0.6 COCCCCCl TS39592 [0,1,0,0,0,0|1,0,0]=2 625 B6R0.6 COCCCCO TS07977 [0,1,0,0,0,0|1,0,0]=2 626 B6R0.6 COCCOC=C TS03941 [0,1,0,0,0,0|2,0,1]=4 627 B6R0.6 COCCOCCl TS39595 [0,1,0,0,0,0|2,0,0]=3 628 B6R0.6 COCOCCBr TS44958 [0,1,0,0,0,0|2,0,0]=3 629 B6R0.6 CSCCCCO TS32429 [0,1,0,0,0,0|1,0,0]=2 630 B6R0.6 CSCCCSC TS37067 [0,1,0,0,0,0|2,0,0]=3 631 B6R0.6 [Li]CCCCCC TS03654 [0,1,0,0,0,0|1,0,0]=2 632 B6R1.1 C1CC=COC1 TS02542 [0,0,0,1,0,0|1,0,2]=4 633 B6R1.1 C1CCC=CC1 TS34559 [0,0,0,1,0,0|1,0,1]=3 634 B6R1.1 C1CCCCC1 TS71717 [0,0,0,1,0,0|1,0,0]=2 635 B6R1.1 C1CCNCC1 TS03510 [0,0,0,1,0,0|0,0,0]=1 636 B6R1.1 C1CCNCC1 TS04882 [0,0,0,1,0,0|0,0,0]=1 637 B6R1.1 C1CCNCC1 TS10261 [0,0,0,1,0,0|0,0,0]=1 638 B6R1.1 C1CCNNC1 TS42014 [0,0,0,1,0,0|1,0,0]=2 639 B6R1.1 C1CCOCC1 TS26775 [0,0,0,1,0,0|1,0,0]=2 640 B6R1.1 C1CCOCC1 TS71756 [0,0,0,1,0,0|1,0,0]=2 641 B6R1.1 C1CCSCC1 TS03983 [0,0,0,1,0,0|1,0,0]=2 642 B6R1.1 C1CNC=NC1 TS71709 [0,0,0,1,0,0|1,0,1]=3 643 B6R1.1 C1CNCC=C1 TS86919 [0,0,0,1,0,0|0,0,2]=3 644 B6R1.1 C1CNCCN1 TS03538 [0,0,0,1,0,0|1,0,0]=2 645 B6R1.1 C1CNCCN1 TS15278 [0,0,0,1,0,0|1,0,0]=2 646 B6R1.1 C1CNCCN1 TS42015 [0,0,0,1,0,0|1,0,0]=2 647 B6R1.1 C1COCCN1 TS03564 [0,0,0,1,0,0|1,0,0]=2 648 B6R1.1 C1COCCN1 TS04991 [0,0,0,1,0,0|1,0,0]=2 649 B6R1.1 C1COCCO1 TS27395 [0,0,0,1,0,0|2,0,0]=3 650 B6R1.1 C1COCCO1 TS27687 [0,0,0,1,0,0|2,0,0]=3 651 B6R1.1 C1COCCO1 TS46811 [0,0,0,1,0,0|2,0,0]=3 652 B6R1.1 C1CSCCN1 TS00278 [0,0,0,1,0,0|1,0,0]=2 653 B6R1.1 C1CSCCN1 TS37319 [0,0,0,1,0,0|1,0,0]=2 654 B6R1.1 C1CSCCO1 TS31683 [0,0,0,1,0,0|2,0,0]=3 655 B6R1.1 C1CSCCS1 TS32441 [0,0,0,1,0,0|2,0,0]=3 656 B6R1.1 C1CSCSC1 TS59890 [0,0,0,1,0,0|2,0,0]=3 657 B6R1.1 C1NCNCN1 TS71769 [0,0,0,1,0,0|2,0,0]=3 658 B6R1.1 C1OCOCO1 TS03622 [0,0,0,1,0,0|3,0,0]=4 659 B6R1.1 C1SCSCS1 TS37237 [0,0,0,1,0,0|3,0,0]=4 660 B6R1.2 C1C(=O)NCN1 TS32972 [0,0,0,1,0,0|2,0,1]=4 661 B6R1.2 C1C(CO[NH2+]1)O TS36081 [0,0,0,1,0,0|3,0,0]=4 662 B6R1.2 C1C=CCC1N TS04803 [0,0,0,1,0,0|0,0,2]=3 663 B6R1.2 C1C=CCC1O TS71171 [0,0,0,1,0,0|1,0,2]=4 664 B6R1.2 C1CC(=N)SC1 TS03910 [0,0,0,1,0,0|1,0,2]=4 665 B6R1.2 C1CC(=NC1)N TS04838 [0,0,0,1,0,0|1,0,1]=3 666 B6R1.2 C1CC(=O)NC1 TS39938 [0,0,0,1,0,0|1,0,1]=3 667 B6R1.2 C1CC(=O)NC1 TS63365 [0,0,0,1,0,0|1,0,1]=3 668 B6R1.2 C1CC(=O)SC1 TS31607 [0,0,0,1,0,0|2,0,1]=4 669 B6R1.2 C1CC(=S)NC1 TS03912 [0,0,0,1,0,0|1,0,1]=3 670 B6R1.2 C1CC(C=C1)Cl TS31621 [0,0,0,1,0,0|1,0,2]=4 671 B6R1.2 C1CC(OC1)N TS03559 [0,0,0,1,0,0|1,0,0]=2 672 B6R1.2 C1CC=C(C1)Cl TS31619 [0,0,0,1,0,0|1,0,2]=4 673 B6R1.2 C1CCC(=O)C1 TS03493 [0,0,0,1,0,0|1,0,1]=3 674 B6R1.2 C1CCC(C1)Br TS55827 [0,0,0,1,0,0|1,0,0]=2 675 B6R1.2 C1CCC(C1)Br TS68904 [0,0,0,1,0,0|1,0,0]=2 676 B6R1.2 C1CCC(C1)Cl TS04055 [0,0,0,1,0,0|1,0,0]=2 677 B6R1.2 C1CCC(C1)I TS18162 [0,0,0,1,0,0|1,0,0]=2 678 B6R1.2 C1CCC(C1)N TS34563 [0,0,0,1,0,0|0,0,0]=1 679 B6R1.2 C1CCC(C1)O TS71762 [0,0,0,1,0,0|1,0,0]=2 680 B6R1.2 C1CCC(C1)S TS03980 [0,0,0,1,0,0|1,0,0]=2 681 B6R1.2 C1CCC(C1)[SiH3] TS03890 [0,0,0,1,0,0|1,0,0]=2 682 B6R1.2 C1CCC(C1)[Zn+] TS44590 [0,0,0,1,0,0|1,0,0]=2 683 B6R1.2 C1CCN(C1)N TS03537 [0,0,0,1,0,0|1,0,0]=2 684 B6R1.2 C1CCN(C1)N TS32538 [0,0,0,1,0,0|1,0,0]=2 685 B6R1.2 C1CCS(=O)C1 TS31677 [0,0,0,1,0,0|2,0,0]=3 686 B6R1.2 C1CNC(=O)N1 TS93146 [0,0,0,1,0,0|2,0,1]=4 687 B6R1.2 C1CNC(=S)N1 TS31609 [0,0,0,1,0,0|2,0,1]=4 688 B6R1.2 C1CNCC1=O TS88446 [0,0,0,1,0,0|2,0,1]=4 689 B6R1.2 C1CNCC1F TS36083 [0,0,0,1,0,0|2,0,0]=3 690 B6R1.2 C1CNCC1F TS46663 [0,0,0,1,0,0|2,0,0]=3 691 B6R1.2 C1CNCC1N TS32537 [0,0,0,1,0,0|1,0,0]=2 692 B6R1.2 C1CNCC1O TS02802 [0,0,0,1,0,0|2,0,0]=3 693 B6R1.2 C1CNC[C@@H]1F TS00303 [0,0,0,1,0,0|2,0,0]=3 694 B6R1.2 C1CNC[C@@H]1F TS03597 [0,0,0,1,0,0|2,0,0]=3 695 B6R1.2 C1CNC[C@@H]1N TS03541 [0,0,0,1,0,0|1,0,0]=2 696 B6R1.2 C1CNC[C@@H]1N TS42016 [0,0,0,1,0,0|1,0,0]=2 697 B6R1.2 C1CNC[C@@H]1O TS87275 [0,0,0,1,0,0|2,0,0]=3 698 B6R1.2 C1CNC[C@@H]1O TS87623 [0,0,0,1,0,0|2,0,0]=3 699 B6R1.2 C1CNC[C@H]1F TS08083 [0,0,0,1,0,0|2,0,0]=3 700 B6R1.2 C1CNC[C@H]1F TS88030 [0,0,0,1,0,0|2,0,0]=3 701 B6R1.2 C1CNC[C@H]1N TS39939 [0,0,0,1,0,0|1,0,0]=2 702 B6R1.2 C1CNC[C@H]1N TS42017 [0,0,0,1,0,0|1,0,0]=2 703 B6R1.2 C1CNC[C@H]1O TS46618 [0,0,0,1,0,0|2,0,0]=3 704 B6R1.2 C1CNC[C@H]1O TS46665 [0,0,0,1,0,0|2,0,0]=3 705 B6R1.2 C1CNC[C@H]1O TS91049 [0,0,0,1,0,0|2,0,0]=3 706 B6R1.2 C1CNC[C@H]1O TS94423 [0,0,0,1,0,0|2,0,0]=3 707 B6R1.2 C1CNNC1=O TS04946 [0,0,0,1,0,0|2,0,1]=4 708 B6R1.2 C1COC(=O)N1 TS03552 [0,0,0,1,0,0|2,0,1]=4 709 B6R1.2 C1COC(=S)N1 TS03998 [0,0,0,1,0,0|2,0,1]=4 710 B6R1.2 C1COCC1=O TS01440 [0,0,0,1,0,0|2,0,1]=4 711 B6R1.2 C1COCC1Br TS88092 [0,0,0,1,0,0|2,0,0]=3 712 B6R1.2 C1COCC1Cl TS31737 [0,0,0,1,0,0|2,0,0]=3 713 B6R1.2 C1COCC1I TS86694 [0,0,0,1,0,0|2,0,0]=3 714 B6R1.2 C1COCC1N TS89945 [0,0,0,1,0,0|1,0,0]=2 715 B6R1.2 C1COCC1O TS06712 [0,0,0,1,0,0|2,0,0]=3 716 B6R1.2 C1COCC1O TS59434 [0,0,0,1,0,0|2,0,0]=3 717 B6R1.2 C1COCC1O TS89114 [0,0,0,1,0,0|2,0,0]=3 718 B6R1.2 C1COC[C@@H]1I TS91739 [0,0,0,1,0,0|2,0,0]=3 719 B6R1.2 C1COC[C@@H]1N TS04989 [0,0,0,1,0,0|1,0,0]=2 720 B6R1.2 C1COC[C@@H]1N TS85171 [0,0,0,1,0,0|1,0,0]=2 721 B6R1.2 C1COC[C@@H]1O TS01967 [0,0,0,1,0,0|2,0,0]=3 722 B6R1.2 C1COC[C@H]1I TS88696 [0,0,0,1,0,0|2,0,0]=3 723 B6R1.2 C1COC[C@H]1N TS46680 [0,0,0,1,0,0|1,0,0]=2 724 B6R1.2 C1COC[C@H]1O TS59862 [0,0,0,1,0,0|2,0,0]=3 725 B6R1.2 C1CSC(=N1)N TS06330 [0,0,0,1,0,0|2,0,1]=4 726 B6R1.2 C1CSC(=O)N1 TS03996 [0,0,0,1,0,0|2,0,1]=4 727 B6R1.2 C1CSCC1=O TS81072 [0,0,0,1,0,0|2,0,1]=4 728 B6R1.2 C1CSCC1Cl TS32541 [0,0,0,1,0,0|2,0,0]=3 729 B6R1.2 C1CSCC1N TS04016 [0,0,0,1,0,0|1,0,0]=2 730 B6R1.2 C1CSCC1O TS31682 [0,0,0,1,0,0|2,0,0]=3 731 B6R1.2 CC1=CCCC1 TS71683 [0,0,0,1,0,0|1,0,1]=3 732 B6R1.2 CC1=CCCO1 TS03492 [0,0,0,1,0,0|1,0,2]=4 733 B6R1.2 CC1=NCCC1 TS32917 [0,0,0,1,0,0|0,0,2]=3 734 B6R1.2 CC1=NCCO1 TS71733 [0,0,0,1,0,0|1,0,2]=4 735 B6R1.2 CC1=NCCS1 TS03913 [0,0,0,1,0,0|1,0,2]=4 736 B6R1.2 CC1CCCC1 TS22155 [0,0,0,1,0,0|1,0,0]=2 737 B6R1.2 CC1CCCC1 TS22325 [0,0,0,1,0,0|1,0,0]=2 738 B6R1.2 CC1CCCC1 TS31194 [0,0,0,1,0,0|1,0,0]=2 739 B6R1.2 CC1CCCC1 TS69413 [0,0,0,1,0,0|1,0,0]=2 740 B6R1.2 CC1CCCC1 TS77214 [0,0,0,1,0,0|1,0,0]=2 741 B6R1.2 CC1CCCC1 TS77590 [0,0,0,1,0,0|1,0,0]=2 742 B6R1.2 CC1CCCN1 TS03512 [0,0,0,1,0,0|0,0,0]=1 743 B6R1.2 CC1CCCO1 TS71748 [0,0,0,1,0,0|1,0,0]=2 744 B6R1.2 CC1CCCS1 TS03982 [0,0,0,1,0,0|1,0,0]=2 745 B6R1.2 CC1CCNC1 TS04878 [0,0,0,1,0,0|2,0,0]=3 746 B6R1.2 CC1CCOC1 TS71755 [0,0,0,1,0,0|2,0,0]=3 747 B6R1.2 CC1CCSC1 TS03984 [0,0,0,1,0,0|2,0,0]=3 748 B6R1.2 CC1COCO1 TS03579 [0,0,0,1,0,0|2,0,0]=3 749 B6R1.2 CC1OCCO1 TS03576 [0,0,0,1,0,0|2,0,0]=3 750 B6R1.2 CC1SCCS1 TS32438 [0,0,0,1,0,0|2,0,0]=3 751 B6R1.2 CN1CCCC1 TS85196 [0,0,0,1,0,0|2,0,0]=3 752 B6R1.2 C[C@@H]1CCNC1 TS46531 [0,0,0,1,0,0|2,0,0]=3 753 B6R1.2 C[C@H]1CCCN1 TS08127 [0,0,0,1,0,0|0,0,0]=1 754 B6R1.2 C[C@H]1CCCN1 TS59864 [0,0,0,1,0,0|0,0,0]=1 755 B6R1.2 C[C@H]1CCNC1 TS04879 [0,0,0,1,0,0|2,0,0]=3 756 B6R1.3 C1C(O1)CCBr TS08876 [0,0,0,1,0,0|2,0,0]=3 757 B6R1.3 C1CC1CC#N TS03449 [0,0,0,1,0,0|0,0,2]=3 758 B6R1.3 C1CC1CCN TS85780 [0,0,0,1,0,0|0,0,0]=1 759 B6R1.3 C1CC1CCO TS00981 [0,0,0,1,0,0|1,0,0]=2 760 B6R1.3 C1CC1CNN TS90736 [0,0,0,1,0,0|1,0,0]=2 761 B6R1.3 C1CC1N=C=S TS55841 [0,0,0,1,0,0|2,0,1]=4 762 B6R1.3 C1CN1CCN TS32539 [0,0,0,1,0,0|1,0,0]=2 763 B6R1.3 C1[C@@H](O1)CCBr TS40969 [0,0,0,1,0,0|2,0,0]=3 764 B6R1.3 C1[C@H](O1)CCBr TS40971 [0,0,0,1,0,0|2,0,0]=3 765 B6R1.3 CCC[C@H]1CO1 TS71750 [0,0,0,1,0,0|1,0,0]=2 766 B6R1.3 COC[C@@H]1CO1 TS03586 [0,0,0,1,0,0|2,0,0]=3 767 B6R1.3 COC[C@H]1CO1 TS03578 [0,0,0,1,0,0|2,0,0]=3 768 B6R1.3 CSCC1CO1 TS31681 [0,0,0,1,0,0|2,0,0]=3 769 B6R1.4 CC1C(CN1)O TS92907 [0,0,0,1,0,0|2,0,0]=3 770 B6R1.6 C1C(CN1)C#N TS04769 [0,0,0,1,0,0|1,0,2]=4 771 B6R1.6 C1C(CN1)CO TS91597 [0,0,0,1,0,0|2,0,0]=3 772 B6R1.6 C1C(CO1)CI TS85854 [0,0,0,1,0,0|2,0,0]=3 773 B6R1.6 C1C(CO1)CN TS89704 [0,0,0,1,0,0|1,0,0]=2 774 B6R1.6 C1C(CO1)CO TS90138 [0,0,0,1,0,0|2,0,0]=3 775 B6R1.6 C1C(CS1)CN TS87824 [0,0,0,1,0,0|1,0,0]=2 776 B6R1.6 C1CC(C1)C#N TS03443 [0,0,0,1,0,0|0,0,2]=3 777 B6R1.6 C1CC(C1)C=O TS03489 [0,0,0,1,0,0|1,0,1]=3 778 B6R1.6 C1CC(C1)CBr TS07532 [0,0,0,1,0,0|1,0,0]=2 779 B6R1.6 C1CC(C1)CN TS89840 [0,0,0,1,0,0|0,0,0]=1 780 B6R1.6 C1CC(C1)CO TS71752 [0,0,0,1,0,0|1,0,0]=2 781 B6R1.6 C1CC(C1)NN TS01400 [0,0,0,1,0,0|1,0,0]=2 782 B6R1.6 C1CC(C1)NN TS03544 [0,0,0,1,0,0|1,0,0]=2 783 B6R1.6 C1CNC1CN TS01756 [0,0,0,1,0,0|1,0,0]=2 784 B6R1.6 C1CNC1CO TS88277 [0,0,0,1,0,0|1,0,0]=2 785 B6R1.6 C1CN[C@H]1CO TS86313 [0,0,0,1,0,0|1,0,0]=2 786 B6R1.6 C1COC1CBr TS40968 [0,0,0,1,0,0|2,0,0]=3 787 B6R1.6 C1COC1CI TS91254 [0,0,0,1,0,0|2,0,0]=3 788 B6R1.6 C1COC1CN TS86216 [0,0,0,1,0,0|1,0,0]=2 789 B6R1.6 C1COC1CO TS88229 [0,0,0,1,0,0|2,0,0]=3 790 B6R1.6 CCC1CCC1 TS71715 [0,0,0,1,0,0|1,0,0]=2 791 B6R1.6 CNC1CNC1 TS03543 [0,0,0,1,0,0|3,0,0]=4 792 B6R1.6 CNC1COC1 TS89249 [0,0,0,1,0,0|3,0,0]=4 793 B6R1.6 COC1CNC1 TS02818 [0,0,0,1,0,0|3,0,0]=4 794 B6R1.6 COC1CSC1 TS31679 [0,0,0,1,0,0|3,0,0]=4 795 B6R1.8 C=C1CC1CO TS03490 [0,0,0,1,0,0|1,0,2]=4 796 B6R1.8 CC1CC1CO TS71767 [0,0,0,1,0,0|1,0,0]=2 797 B6R1.8 CC[C@@H]1C[C@@H]1C TS71712 [0,0,0,1,0,0|1,0,0]=2 798 B3R0.1 C#CCN TS03647 [2,0,0,0,0,0|0,0,2]=4 799 B3R0.1 C#CCN TS07975 [2,0,0,0,0,0|0,0,2]=4 800 B3R0.1 C(C#N)N TS01341 [2,0,0,0,0,0|1,0,1]=4 801 B3R0.1 C(C#N)N TS01342 [2,0,0,0,0,0|1,0,1]=4 802 B3R0.1 C(CBr)Br TS59882 [2,0,0,0,0,0|2,0,0]=4 803 B3R0.1 C(CBr)Cl TS00022 [2,0,0,0,0,0|2,0,0]=4 804 B3R0.1 C(CBr)F TS46917 [2,0,0,0,0,0|2,0,0]=4 805 B3R0.1 C(CBr)N TS11328 [2,0,0,0,0,0|1,0,0]=3 806 B3R0.1 C(CBr)N TS55165 [2,0,0,0,0,0|1,0,0]=3 807 B3R0.1 C(CBr)O TS55163 [2,0,0,0,0,0|2,0,0]=4 808 B3R0.1 C(CCl)Cl TS31460 [2,0,0,0,0,0|2,0,0]=4 809 B3R0.1 C(CCl)F TS71692 [2,0,0,0,0,0|2,0,0]=4 810 B3R0.1 C(CCl)N TS55277 [2,0,0,0,0,0|1,0,0]=3 811 B3R0.1 C(CCl)O TS00074 [2,0,0,0,0,0|2,0,0]=4 812 B3R0.1 C(CCl)[SiH3] TS31360 [2,0,0,0,0,0|1,1,0]=4 813 B3R0.1 C(CF)F TS02711 [2,0,0,0,0,0|2,0,0]=4 814 B3R0.1 C(CF)N TS31476 [2,0,0,0,0,0|1,0,0]=3 815 B3R0.1 C(CF)O TS01026 [2,0,0,0,0,0|2,0,0]=4 816 B3R0.1 C(CI)Cl TS51200 [2,0,0,0,0,0|2,0,0]=4 817 B3R0.1 C(CI)F TS45712 [2,0,0,0,0,0|2,0,0]=4 818 B3R0.1 C(CI)I TS93956 [2,0,0,0,0,0|2,0,0]=4 819 B3R0.1 C(CI)O TS13090 [2,0,0,0,0,0|2,0,0]=4 820 B3R0.1 C(CN)N TS03440 [2,0,0,0,0,0|1,0,0]=3 821 B3R0.1 C(CN)N TS03650 [2,0,0,0,0,0|1,0,0]=3 822 B3R0.1 C(CN)N TS05804 [2,0,0,0,0,0|1,0,0]=3 823 B3R0.1 C(CN)N TS22305 [2,0,0,0,0,0|1,0,0]=3 824 B3R0.1 C(CN)N TS26096 [2,0,0,0,0,0|1,0,0]=3 825 B3R0.1 C(CN)N TS65589 [2,0,0,0,0,0|1,0,0]=3 826 B3R0.1 C(CN)N TS70395 [2,0,0,0,0,0|1,0,0]=3 827 B3R0.1 C(CN)N TS76811 [2,0,0,0,0,0|1,0,0]=3 828 B3R0.1 C(CN)N TS79362 [2,0,0,0,0,0|1,0,0]=3 829 B3R0.1 C(CN)[NH3+] TS03740 [2,0,0,0,0,0|1,0,0]=3 830 B3R0.1 C(CO)N TS08649 [2,0,0,0,0,0|1,0,0]=3 831 B3R0.1 C(CO)N TS31412 [2,0,0,0,0,0|1,0,0]=3 832 B3R0.1 C(CO)N TS31567 [2,0,0,0,0,0|1,0,0]=3 833 B3R0.1 C(CO)N TS93285 [2,0,0,0,0,0|1,0,0]=3 834 B3R0.1 C(CO)O TS02439 [2,0,0,0,0,0|2,0,0]=4 835 B3R0.1 C(CP)O TS03426 [2,0,0,0,0,0|1,1,0]=4 836 B3R0.1 C(CP)P TS03658 [2,0,0,0,0,0|1,1,0]=4 837 B3R0.1 C(CS)N TS03420 [2,0,0,0,0,0|1,0,0]=3 838 B3R0.1 C(CS)N TS39644 [2,0,0,0,0,0|1,0,0]=3 839 B3R0.1 C(CS)O TS71649 [2,0,0,0,0,0|2,0,0]=4 840 B3R0.1 C(CS)S TS74490 [2,0,0,0,0,0|2,0,0]=4 841 B3R0.1 C(C[O-])O TS70846 [2,0,0,0,0,0|2,0,0]=4 842 B3R0.1 C(C[SiH3])[SiH3] TS03631 [2,0,0,0,0,0|0,2,0]=4 843 B3R0.1 C=CCN TS01644 [2,0,0,0,0,0|0,0,2]=4 844 B3R0.1 CCC#C TS65570 [2,0,0,0,0,0|0,0,2]=4 845 B3R0.1 CCC#N TS65577 [2,0,0,0,0,0|0,0,2]=4 846 B3R0.1 CCC=C TS02407 [2,0,0,0,0,0|0,0,2]=4 847 B3R0.1 CCC=O TS02416 [2,0,0,0,0,0|1,0,1]=4 848 B3R0.1 CCC=S TS71851 [2,0,0,0,0,0|1,0,1]=4 849 B3R0.1 CCCBr TS00040 [2,0,0,0,0,0|1,0,0]=3 850 B3R0.1 CCCCl TS71653 [2,0,0,0,0,0|1,0,0]=3 851 B3R0.1 CCCF TS65692 [2,0,0,0,0,0|1,0,0]=3 852 B3R0.1 CCCI TS45076 [2,0,0,0,0,0|1,0,0]=3 853 B3R0.1 CCCN TS02429 [2,0,0,0,0,0|0,0,0]=2 854 B3R0.1 CCCN TS03705 [2,0,0,0,0,0|0,0,0]=2 855 B3R0.1 CCCS TS03410 [2,0,0,0,0,0|1,0,0]=3 856 B3R0.1 CCC[O-] TS03458 [2,0,0,0,0,0|1,0,0]=3 857 B3R0.1 CCC[O-] TS37676 [2,0,0,0,0,0|1,0,0]=3 858 B3R0.1 CCC[O-] TS56091 [2,0,0,0,0,0|1,0,0]=3 859 B3R0.1 CCC[S-] TS03782 [2,0,0,0,0,0|1,0,0]=3 860 B3R0.1 CCNC TS03706 [2,0,0,0,0,0|1,0,0]=3 861 B3R0.1 CCNC TS16623 [2,0,0,0,0,0|1,0,0]=3 862 B3R0.1 CCNO TS64941 [2,0,0,0,0,0|2,0,0]=4 863 B3R0.1 CCOC TS65588 [2,0,0,0,0,0|1,0,0]=3 864 B3R0.1 CCON TS31411 [2,0,0,0,0,0|1,0,0]=3 865 B3R0.1 CCSC TS71648 [2,0,0,0,0,0|1,0,0]=3 866 B3R0.1 CC[Hg]Cl TS30124 [2,0,0,0,0,0|2,0,0]=4 867 B3R0.1 CC[Mg]Br TS36790 [2,0,0,0,0,0|2,0,0]=4 868 B3R0.1 CC[Mg]I TS93021 [2,0,0,0,0,0|2,0,0]=4 869 B3R0.1 CNNC TS05803 [2,0,0,0,0,0|2,0,0]=4 870 B3R0.1 CNNC TS65590 [2,0,0,0,0,0|2,0,0]=4 871 B3R0.1 CNOC TS01578 [2,0,0,0,0,0|2,0,0]=4 872 B3R0.1 COCBr TS36040 [2,0,0,0,0,0|2,0,0]=4 873 B3R0.1 COCCl TS56228 [2,0,0,0,0,0|2,0,0]=4 874 B3R0.1 COCI TS13091 [2,0,0,0,0,0|2,0,0]=4 875 B3R0.1 CSSC TS34583 [2,0,0,0,0,0|2,0,0]=4 876 B3R0.1 C[Se][Se]C TS15888 [2,0,0,0,0,0|2,0,0]=4 877 B3R0.1 C[SiH2]C[SiH3] TS03630 [2,0,0,0,0,0|0,2,0]=4 878 B5R0.1 B(CCC)(O)O TS59317 [1,1,0,0,0,0|2,0,0]=4 879 B5R0.1 C(CBr)C(=N)N TS40973 [1,1,0,0,0,0|1,0,1]=4 880 B5R0.1 C(CBr)C(=O)N TS10109 [1,1,0,0,0,0|1,0,1]=4 881 B5R0.1 C(CCl)C(=O)N TS04118 [1,1,0,0,0,0|1,0,1]=4 882 B5R0.1 C(CN)C(=O)N TS36032 [1,1,0,0,0,0|1,0,1]=4 883 B5R0.1 C(CN)C(=O)O TS02667 [1,1,0,0,0,0|1,0,1]=4 884 B5R0.1 C(CP(=O)O)N TS94065 [1,1,0,0,0,0|2,0,0]=4 885 B5R0.1 C(CS(=O)O)N TS31804 [1,1,0,0,0,0|2,0,0]=4 886 B5R0.1 CC#CC(C)C TS71688 [1,1,0,0,0,0|0,0,2]=4 887 B5R0.1 CC#C[C@H](C)O TS03495 [1,1,0,0,0,0|0,0,2]=4 888 B5R0.1 CC(=C)CCO TS71766 [1,1,0,0,0,0|1,0,1]=4 889 B5R0.1 CC(=CCN)C TS04881 [1,1,0,0,0,0|0,0,2]=4 890 B5R0.1 CC(=CCN)C TS63606 [1,1,0,0,0,0|0,0,2]=4 891 B5R0.1 CC(=CCN)C TS70656 [1,1,0,0,0,0|0,0,2]=4 892 B5R0.1 CC(=O)CCO TS39752 [1,1,0,0,0,0|1,0,1]=4 893 B5R0.1 CC(=O)CCS TS31678 [1,1,0,0,0,0|1,0,1]=4 894 B5R0.1 CC(=O)COC TS03573 [1,1,0,0,0,0|1,0,1]=4 895 B5R0.1 CC(=O)CSC TS31685 [1,1,0,0,0,0|1,0,1]=4 896 B5R0.1 CC(C)CC#C TS03469 [1,1,0,0,0,0|0,0,2]=4 897 B5R0.1 CC(C)CC#N TS71700 [1,1,0,0,0,0|0,0,2]=4 898 B5R0.1 CC(C)CC=O TS71746 [1,1,0,0,0,0|1,0,1]=4 899 B5R0.1 CC(C)CCBr TS09985 [1,1,0,0,0,0|1,0,0]=3 900 B5R0.1 CC(C)CCCl TS31743 [1,1,0,0,0,0|1,0,0]=3 901 B5R0.1 CC(C)CCI TS18548 [1,1,0,0,0,0|1,0,0]=3 902 B5R0.1 CC(C)CCN TS71773 [1,1,0,0,0,0|0,0,0]=2 903 B5R0.1 CC(C)CCO TS71804 [1,1,0,0,0,0|1,0,0]=3 904 B5R0.1 CC(C)CCS TS31696 [1,1,0,0,0,0|1,0,0]=3 905 B5R0.1 CC(C)CC[Zn+] TS49167 [1,1,0,0,0,0|1,0,0]=3 906 B5R0.1 CC(C)CNC TS01600 [1,1,0,0,0,0|1,0,0]=3 907 B5R0.1 CC(C)CNN TS04103 [1,1,0,0,0,0|1,0,0]=3 908 B5R0.1 CC(C)CON TS36090 [1,1,0,0,0,0|1,0,0]=3 909 B5R0.1 CC(C)CSC TS31693 [1,1,0,0,0,0|1,0,0]=3 910 B5R0.1 CC(C)OCCl TS04160 [1,1,0,0,0,0|2,0,0]=4 911 B5R0.1 CC(CC#C)O TS03487 [1,1,0,0,0,0|0,0,2]=4 912 B5R0.1 CC(CC#N)Br TS40583 [1,1,0,0,0,0|0,0,2]=4 913 B5R0.1 CC(CC=C)O TS71743 [1,1,0,0,0,0|0,0,2]=4 914 B5R0.1 CC(CC=O)O TS03574 [1,1,0,0,0,0|1,0,1]=4 915 B5R0.1 CC(CCBr)Br TS21967 [1,1,0,0,0,0|1,0,0]=3 916 B5R0.1 CC(CCN)O TS02231 [1,1,0,0,0,0|0,0,0]=2 917 B5R0.1 CC(CCO)N TS60329 [1,1,0,0,0,0|1,0,0]=3 918 B5R0.1 CC(CCO)O TS71832 [1,1,0,0,0,0|1,0,0]=3 919 B5R0.1 CC(CCS)S TS04931 [1,1,0,0,0,0|1,0,0]=3 920 B5R0.1 CC(COC)N TS03608 [1,1,0,0,0,0|1,0,0]=3 921 B5R0.1 CC(COC)O TS71841 [1,1,0,0,0,0|1,0,0]=3 922 B5R0.1 CC=CC(C)C TS71719 [1,1,0,0,0,0|0,0,2]=4 923 B5R0.1 CC=CC(C)O TS71747 [1,1,0,0,0,0|0,0,2]=4 924 B5R0.1 CCC=C(C)C TS71718 [1,1,0,0,0,0|0,0,2]=4 925 B5R0.1 CCCC(=C)C TS71722 [1,1,0,0,0,0|0,0,1]=3 926 B5R0.1 CCCC(=N)N TS03542 [1,1,0,0,0,0|0,0,1]=3 927 B5R0.1 CCCC(=N)N TS04952 [1,1,0,0,0,0|0,0,1]=3 928 B5R0.1 CCCC(=O)Br TS40964 [1,1,0,0,0,0|1,0,1]=4 929 B5R0.1 CCCC(=O)C TS71754 [1,1,0,0,0,0|0,0,1]=3 930 B5R0.1 CCCC(=O)Cl TS16539 [1,1,0,0,0,0|1,0,1]=4 931 B5R0.1 CCCC(=O)N TS03561 [1,1,0,0,0,0|0,0,1]=3 932 B5R0.1 CCCC(=O)O TS03572 [1,1,0,0,0,0|1,0,1]=4 933 B5R0.1 CCCC(=O)O TS63934 [1,1,0,0,0,0|1,0,1]=4 934 B5R0.1 CCCC(=O)[O-] TS04184 [1,1,0,0,0,0|1,0,1]=4 935 B5R0.1 CCCC(=O)[O-] TS04232 [1,1,0,0,0,0|1,0,1]=4 936 B5R0.1 CCCC(=O)[O-] TS44539 [1,1,0,0,0,0|1,0,1]=4 937 B5R0.1 CCCC(=S)Cl TS37257 [1,1,0,0,0,0|1,0,1]=4 938 B5R0.1 CCCC(=S)O TS04825 [1,1,0,0,0,0|1,0,1]=4 939 B5R0.1 CCCC(C)Br TS09989 [1,1,0,0,0,0|0,0,0]=2 940 B5R0.1 CCCC(C)Cl TS31741 [1,1,0,0,0,0|0,0,0]=2 941 B5R0.1 CCCC(C)I TS18550 [1,1,0,0,0,0|0,0,0]=2 942 B5R0.1 CCCC(C)O TS03596 [1,1,0,0,0,0|0,0,0]=2 943 B5R0.1 CCCC(C)S TS31692 [1,1,0,0,0,0|0,0,0]=2 944 B5R0.1 CCCC(C)[Zn+] TS49166 [1,1,0,0,0,0|0,0,0]=2 945 B5R0.1 CCCC(Cl)Cl TS36206 [1,1,0,0,0,0|1,0,0]=3 946 B5R0.1 CCCN(C)C TS71775 [1,1,0,0,0,0|1,0,0]=3 947 B5R0.1 CCCP(Cl)Cl TS07061 [1,1,0,0,0,0|2,0,0]=4 948 B5R0.1 CCC[C@@H](C)O TS71801 [1,1,0,0,0,0|0,0,0]=2 949 B5R0.1 CCC[C@H](C)O TS71800 [1,1,0,0,0,0|0,0,0]=2 950 B5R0.1 CCC[N+](=O)[O-] TS71821 [1,1,0,0,0,0|2,0,0]=4 951 B5R0.1 CCNC(=N)N TS04994 [1,1,0,0,0,0|1,0,1]=4 952 B5R0.1 CCNC(=O)C TS03563 [1,1,0,0,0,0|1,0,1]=4 953 B5R0.1 CCNC(=O)N TS03591 [1,1,0,0,0,0|1,0,1]=4 954 B5R0.1 CCNC(=S)N TS31687 [1,1,0,0,0,0|1,0,1]=4 955 B5R0.1 CCNC(=[NH2+])N TS56393 [1,1,0,0,0,0|1,0,1]=4 956 B5R0.1 CCNC(C)C TS71777 [1,1,0,0,0,0|1,0,0]=3 957 B5R0.1 CCOC(=C)C TS71753 [1,1,0,0,0,0|1,0,1]=4 958 B5R0.1 CCOC(=O)C TS03585 [1,1,0,0,0,0|1,0,1]=4 959 B5R0.1 CCOC(=O)C TS03625 [1,1,0,0,0,0|1,0,1]=4 960 B5R0.1 CCOC(=O)C TS71827 [1,1,0,0,0,0|1,0,1]=4 961 B5R0.1 CCOC(=O)N TS59479 [1,1,0,0,0,0|1,0,1]=4 962 B5R0.1 CCOC(=S)C TS31684 [1,1,0,0,0,0|1,0,1]=4 963 B5R0.1 CCOC(C)C TS03595 [1,1,0,0,0,0|1,0,0]=3 964 B5R0.1 CCOC(C)Cl TS04164 [1,1,0,0,0,0|1,0,0]=3 965 B5R0.1 CCO[SiH](C)C TS04048 [1,1,0,0,0,0|1,1,0]=4 966 B5R0.1 CCSC(=S)C TS32440 [1,1,0,0,0,0|1,0,1]=4 967 B5R0.1 CCSC(C)C TS31689 [1,1,0,0,0,0|1,0,0]=3 968 B5R0.1 CN(C)CCBr TS25321 [1,1,0,0,0,0|2,0,0]=4 969 B5R0.1 CN(C)CCN TS00990 [1,1,0,0,0,0|1,0,0]=3 970 B5R0.1 CN(C)CCO TS03600 [1,1,0,0,0,0|2,0,0]=4 971 B5R0.1 CN(C)CCS TS31711 [1,1,0,0,0,0|2,0,0]=4 972 B5R0.1 CN(C)CCS TS37538 [1,1,0,0,0,0|2,0,0]=4 973 B5R0.1 CN(C)CCS TS37540 [1,1,0,0,0,0|2,0,0]=4 974 B5R0.1 CNCC(=O)N TS36031 [1,1,0,0,0,0|1,0,1]=4 975 B5R0.1 COCC(=N)N TS36030 [1,1,0,0,0,0|1,0,1]=4 976 B5R0.1 CSCC(=N)N TS31686 [1,1,0,0,0,0|1,0,1]=4 977 B5R0.1 CSCC(=O)N TS93570 [1,1,0,0,0,0|1,0,1]=4 978 B5R0.1 CSCS(=O)C TS05065 [1,1,0,0,0,0|2,0,0]=4 979 B5R0.1 C[C@@H](CC#N)O TS71734 [1,1,0,0,0,0|0,0,2]=4 980 B5R0.1 C[C@@H](CCO)O TS71843 [1,1,0,0,0,0|1,0,0]=3 981 B5R0.1 C[C@@H](COC)N TS03602 [1,1,0,0,0,0|1,0,0]=3 982 B5R0.1 C[C@@H](COC)O TS71834 [1,1,0,0,0,0|1,0,0]=3 983 B5R0.1 C[C@H](CC#N)O TS03507 [1,1,0,0,0,0|0,0,2]=4 984 B5R0.1 C[C@H](CC=C)O TS03535 [1,1,0,0,0,0|0,0,2]=4 985 B5R0.1 C[C@H](CCO)N TS93947 [1,1,0,0,0,0|1,0,0]=3 986 B5R0.1 C[C@H](CCO)O TS71835 [1,1,0,0,0,0|1,0,0]=3 987 B5R0.1 C[C@H](COC)O TS00301 [1,1,0,0,0,0|1,0,0]=3 988 B5R0.3 C(C(=O)CN)N TS11357 [1,1,0,0,0,0|1,0,1]=4 989 B5R0.3 C(C(CBr)Br)Br TS54387 [1,1,0,0,0,0|2,0,0]=4 990 B5R0.3 C(C(CBr)Br)Cl TS25944 [1,1,0,0,0,0|2,0,0]=4 991 B5R0.3 C(C(CBr)Br)O TS22312 [1,1,0,0,0,0|2,0,0]=4 992 B5R0.3 C(C(CBr)O)Br TS22311 [1,1,0,0,0,0|2,0,0]=4 993 B5R0.3 C(C(CBr)O)F TS10809 [1,1,0,0,0,0|2,0,0]=4 994 B5R0.3 C(C(CBr)O)O TS10534 [1,1,0,0,0,0|2,0,0]=4 995 B5R0.3 C(C(CCl)Cl)Cl TS07383 [1,1,0,0,0,0|2,0,0]=4 996 B5R0.3 C(C(CCl)Cl)O TS36383 [1,1,0,0,0,0|2,0,0]=4 997 B5R0.3 C(C(CCl)O)Cl TS07880 [1,1,0,0,0,0|2,0,0]=4 998 B5R0.3 C(C(CCl)O)F TS31988 [1,1,0,0,0,0|2,0,0]=4 999 B5R0.3 C(C(CCl)O)O TS08669 [1,1,0,0,0,0|2,0,0]=4 1000 B5R0.3 C(C(CF)Cl)F TS32129 [1,1,0,0,0,0|2,0,0]=4 1001 B5R0.3 C(C(CF)O)F TS03710 [1,1,0,0,0,0|2,0,0]=4 1002 B5R0.3 C(C(CN)O)N TS46792 [1,1,0,0,0,0|1,0,0]=3 1003 B5R0.3 C(C(CO)N)O TS65262 [1,1,0,0,0,0|2,0,0]=4 1004 B5R0.3 C(C(CO)N)O TS65263 [1,1,0,0,0,0|2,0,0]=4 1005 B5R0.3 C(C(CO)N)O TS74211 [1,1,0,0,0,0|2,0,0]=4 1006 B5R0.3 C(C(CO)O)N TS39698 [1,1,0,0,0,0|1,0,0]=3 1007 B5R0.3 C(C(CO)O)O TS03653 [1,1,0,0,0,0|2,0,0]=4 1008 B5R0.3 C(C(CO)O)O TS64624 [1,1,0,0,0,0|2,0,0]=4 1009 B5R0.3 C(C(CO)O)O TS93602 [1,1,0,0,0,0|2,0,0]=4 1010 B5R0.3 C(C(CS)O)O TS31781 [1,1,0,0,0,0|2,0,0]=4 1011 B5R0.3 C(C(CS)S)O TS47162 [1,1,0,0,0,0|2,0,0]=4 1012 B5R0.3 C([C@@H](CBr)O)O TS10532 [1,1,0,0,0,0|2,0,0]=4 1013 B5R0.3 C([C@@H](CCl)O)N TS93716 [1,1,0,0,0,0|1,0,0]=3 1014 B5R0.3 C([C@@H](CCl)O)O TS59492 [1,1,0,0,0,0|2,0,0]=4 1015 B5R0.3 C([C@@H](CO)O)N TS05290 [1,1,0,0,0,0|1,0,0]=3 1016 B5R0.3 C([C@@H](CO)O)N TS08134 [1,1,0,0,0,0|1,0,0]=3 1017 B5R0.3 C([C@H](CBr)O)O TS10533 [1,1,0,0,0,0|2,0,0]=4 1018 B5R0.3 C([C@H](CO)O)N TS08079 [1,1,0,0,0,0|1,0,0]=3 1019 B5R0.3 CC(CCl)CBr TS00026 [1,1,0,0,0,0|2,0,0]=4 1020 B5R0.3 CC(CO)CO TS71833 [1,1,0,0,0,0|2,0,0]=4 1021 B5R0.3 CC(OC)OC TS71840 [1,1,0,0,0,0|2,0,0]=4 1022 B5R0.3 CC([Se]C)[Se]C TS44785 [1,1,0,0,0,0|2,0,0]=4 1023 B5R0.3 CCC(=C)CC TS71714 [1,1,0,0,0,0|0,0,1]=3 1024 B5R0.3 CCC(=O)CBr TS00020 [1,1,0,0,0,0|1,0,1]=4 1025 B5R0.3 CCC(=O)CC TS00240 [1,1,0,0,0,0|0,0,1]=3 1026 B5R0.3 CCC(=O)CCl TS31736 [1,1,0,0,0,0|1,0,1]=4 1027 B5R0.3 CCC(=O)CO TS05538 [1,1,0,0,0,0|1,0,1]=4 1028 B5R0.3 CCC(=O)NC TS03562 [1,1,0,0,0,0|1,0,1]=4 1029 B5R0.3 CCC(=O)NN TS03589 [1,1,0,0,0,0|1,0,1]=4 1030 B5R0.3 CCC(=O)OC TS03587 [1,1,0,0,0,0|1,0,1]=4 1031 B5R0.3 CCC(=S)OC TS31680 [1,1,0,0,0,0|1,0,1]=4 1032 B5R0.3 CCC(C#C)O TS03494 [1,1,0,0,0,0|0,0,2]=4 1033 B5R0.3 CCC(C#N)O TS03503 [1,1,0,0,0,0|0,0,2]=4 1034 B5R0.3 CCC(C)C#C TS03468 [1,1,0,0,0,0|0,0,2]=4 1035 B5R0.3 CCC(C)C=O TS03536 [1,1,0,0,0,0|1,0,1]=4 1036 B5R0.3 CCC(C)CBr TS09987 [1,1,0,0,0,0|1,0,0]=3 1037 B5R0.3 CCC(C)CC TS03546 [1,1,0,0,0,0|0,0,0]=2 1038 B5R0.3 CCC(C)CCl TS31746 [1,1,0,0,0,0|1,0,0]=3 1039 B5R0.3 CCC(C)CI TS18546 [1,1,0,0,0,0|1,0,0]=3 1040 B5R0.3 CCC(C)CN TS71788 [1,1,0,0,0,0|0,0,0]=2 1041 B5R0.3 CCC(C)CO TS03593 [1,1,0,0,0,0|1,0,0]=3 1042 B5R0.3 CCC(C)CS TS31698 [1,1,0,0,0,0|1,0,0]=3 1043 B5R0.3 CCC(C)NC TS04995 [1,1,0,0,0,0|1,0,0]=3 1044 B5R0.3 CCC(C)NC TS71785 [1,1,0,0,0,0|1,0,0]=3 1045 B5R0.3 CCC(C)OC TS71803 [1,1,0,0,0,0|1,0,0]=3 1046 B5R0.3 CCC(C)ON TS36089 [1,1,0,0,0,0|1,0,0]=3 1047 B5R0.3 CCC(C)SC TS31697 [1,1,0,0,0,0|1,0,0]=3 1048 B5R0.3 CCC(C)[Mg]Br TS11456 [1,1,0,0,0,0|2,0,0]=4 1049 B5R0.3 CCC(C)[Mg]Cl TS32262 [1,1,0,0,0,0|2,0,0]=4 1050 B5R0.3 CCC(C=C)O TS71760 [1,1,0,0,0,0|0,0,2]=4 1051 B5R0.3 CCC(CBr)Br TS21966 [1,1,0,0,0,0|1,0,0]=3 1052 B5R0.3 CCC(CBr)Cl TS13062 [1,1,0,0,0,0|1,0,0]=3 1053 B5R0.3 CCC(CBr)O TS10270 [1,1,0,0,0,0|1,0,0]=3 1054 B5R0.3 CCC(CC)Br TS09988 [1,1,0,0,0,0|0,0,0]=2 1055 B5R0.3 CCC(CC)Cl TS31745 [1,1,0,0,0,0|0,0,0]=2 1056 B5R0.3 CCC(CC)F TS71849 [1,1,0,0,0,0|0,0,0]=2 1057 B5R0.3 CCC(CC)I TS18549 [1,1,0,0,0,0|0,0,0]=2 1058 B5R0.3 CCC(CC)N TS00440 [1,1,0,0,0,0|0,0,0]=2 1059 B5R0.3 CCC(CC)O TS00239 [1,1,0,0,0,0|0,0,0]=2 1060 B5R0.3 CCC(CC)[Zn+] TS49169 [1,1,0,0,0,0|0,0,0]=2 1061 B5R0.3 CCC(CCl)Cl TS36203 [1,1,0,0,0,0|1,0,0]=3 1062 B5R0.3 CCC(CN)N TS71807 [1,1,0,0,0,0|0,0,0]=2 1063 B5R0.3 CCC(CN)O TS03604 [1,1,0,0,0,0|0,0,0]=2 1064 B5R0.3 CCC(CO)N TS03601 [1,1,0,0,0,0|1,0,0]=3 1065 B5R0.3 CCC(CS)S TS04932 [1,1,0,0,0,0|1,0,0]=3 1066 B5R0.3 CCN(C)CC TS71781 [1,1,0,0,0,0|1,0,0]=3 1067 B5R0.3 CCN(CC)O TS03599 [1,1,0,0,0,0|1,0,0]=3 1068 B5R0.3 CCP(CC)Cl TS36025 [1,1,0,0,0,0|1,0,0]=3 1069 B5R0.3 CCS(=O)CC TS04104 [1,1,0,0,0,0|1,0,0]=3 1070 B5R0.3 CC[Al](CC)Cl TS27650 [1,1,0,0,0,0|1,0,0]=3 1071 B5R0.3 CC[C@@H](CO)O TS71836 [1,1,0,0,0,0|1,0,0]=3 1072 B5R0.3 CC[C@H](C)C#N TS71705 [1,1,0,0,0,0|0,0,2]=4 1073 B5R0.3 CC[C@H](C)CBr TS39655 [1,1,0,0,0,0|1,0,0]=3 1074 B5R0.3 CC[C@H](C)CCl TS31744 [1,1,0,0,0,0|1,0,0]=3 1075 B5R0.3 CC[C@H](CO)N TS03605 [1,1,0,0,0,0|1,0,0]=3 1076 B5R0.3 CC[C@H](CO)O TS71838 [1,1,0,0,0,0|1,0,0]=3 1077 B5R0.3 CC[SiH](C)CC TS03988 [1,1,0,0,0,0|0,1,0]=3 1078 B5R0.3 CC[Sn](=O)CC TS17584 [1,1,0,0,0,0|1,0,0]=3 1079 B5R0.3 CNC(=O)CN TS36033 [1,1,0,0,0,0|1,0,1]=4 1080 B5R0.3 COC(=O)CN TS36079 [1,1,0,0,0,0|1,0,1]=4 1081 B5R0.3 COC(=O)CN TS93910 [1,1,0,0,0,0|1,0,1]=4 1082 B5R0.3 C[C@@H](CO)CBr TS10268 [1,1,0,0,0,0|2,0,0]=4 1083 B5R0.3 C[C@H](CO)CBr TS10271 [1,1,0,0,0,0|2,0,0]=4 1084 B7R0.2 C(C(CN)N)C(=O)O TS32339 [0,2,0,0,0,0|1,0,1]=4 1085 B7R0.2 C([C@@H](CN)N)C(=O)O TS08133 [0,2,0,0,0,0|1,0,1]=4 1086 B7R0.2 C([C@H](CN)N)C(=O)O TS08078 [0,2,0,0,0,0|1,0,1]=4 1087 B7R0.2 C([C@H](CN)O)C(=O)O TS32382 [0,2,0,0,0,0|1,0,1]=4 1088 B7R0.2 CC(C)CC(C#C)O TS04314 [0,2,0,0,0,0|1,0,1]=4 1089 B7R0.2 CC(C)CC(C)C=C TS04359 [0,2,0,0,0,0|1,0,1]=4 1090 B7R0.2 CC(C)CC(C)CO TS04618 [0,2,0,0,0,0|1,0,0]=3 1091 B7R0.2 CC(C)C[C@H](CO)N TS39858 [0,2,0,0,0,0|1,0,0]=3 1092 B7R0.2 CC(C)OC(=O)CN TS41311 [0,2,0,0,0,0|1,0,1]=4 1093 B7R0.2 CC(CN(C)C)CCl TS13112 [0,2,0,0,0,0|2,0,0]=4 1094 B7R0.2 CCC(=C)CC(C)C TS04352 [0,2,0,0,0,0|1,0,1]=4 1095 B7R0.2 CCC(=O)CC(C)C TS32113 [0,2,0,0,0,0|1,0,1]=4 1096 B7R0.2 CCC(C)CC(=C)C TS04345 [0,2,0,0,0,0|1,0,1]=4 1097 B7R0.2 CCC(C)CC(=O)C TS04467 [0,2,0,0,0,0|1,0,1]=4 1098 B7R0.2 CCC(C)CC(=O)Cl TS05950 [0,2,0,0,0,0|1,0,1]=4 1099 B7R0.2 CCC(C)CC(=O)O TS04597 [0,2,0,0,0,0|1,0,1]=4 1100 B7R0.2 CCC(C)CC(C)C TS04502 [0,2,0,0,0,0|1,0,0]=3 1101 B7R0.2 CCC(C)CC(C)N TS04563 [0,2,0,0,0,0|0,0,0]=2 1102 B7R0.2 CCC(C)CC(C)N TS10102 [0,2,0,0,0,0|0,0,0]=2 1103 B7R0.2 CCC(C)CC(C)O TS32253 [0,2,0,0,0,0|1,0,0]=3 1104 B7R0.2 CCC(C)NC(=O)N TS04603 [0,2,0,0,0,0|1,0,1]=4 1105 B7R0.2 CCC(CC(=C)C)O TS32110 [0,2,0,0,0,0|1,0,1]=4 1106 B7R0.2 CCC(CC(=O)O)N TS04672 [0,2,0,0,0,0|1,0,1]=4 1107 B7R0.2 CCC(CC(=O)O)O TS32318 [0,2,0,0,0,0|1,0,1]=4 1108 B7R0.2 CCC(CC(C)C)O TS32246 [0,2,0,0,0,0|1,0,0]=3 1109 B7R0.2 CCC(CC(C)O)O TS32344 [0,2,0,0,0,0|1,0,0]=3 1110 B7R0.2 CC[C@@H](C)CC(=O)O TS04583 [0,2,0,0,0,0|1,0,1]=4 1111 B7R0.2 CC[C@@H](CC(=O)O)N TS32279 [0,2,0,0,0,0|1,0,1]=4 1112 B7R0.2 CC[C@H](C)CC(=O)O TS04594 [0,2,0,0,0,0|1,0,1]=4 1113 B7R0.2 CC[C@H](CC(=O)O)N TS04666 [0,2,0,0,0,0|1,0,1]=4 1114 B7R0.2 CN(C)CC(CO)O TS65701 [0,2,0,0,0,0|2,0,0]=4 1115 B7R0.3 C(CC(=O)NN)CO TS32340 [0,2,0,0,0,0|1,0,1]=4 1116 B7R0.3 C(CC(CN)Cl)CCl TS17567 [0,2,0,0,0,0|0,0,0]=2 1117 B7R0.3 C(CC(CO)O)CO TS32424 [0,2,0,0,0,0|1,0,0]=3 1118 B7R0.3 C=CCCC(CBr)Br TS26768 [0,2,0,0,0,0|1,0,1]=4 1119 B7R0.3 CC(CCCN)CN TS04630 [0,2,0,0,0,0|0,0,0]=2 1120 B7R0.3 CCC#CC(CC)O TS31952 [0,2,0,0,0,0|1,0,1]=4 1121 B7R0.3 CCC(=O)NCCO TS32284 [0,2,0,0,0,0|1,0,1]=4 1122 B7R0.3 CCC(C)CC=CC TS31972 [0,2,0,0,0,0|1,0,1]=4 1123 B7R0.3 CCC(C)CN=C=S TS36443 [0,2,0,0,0,0|1,0,1]=4 1124 B7R0.3 CCC(C)SCC=C TS05618 [0,2,0,0,0,0|1,0,1]=4 1125 B7R0.3 CCC(CC#CC)O TS04317 [0,2,0,0,0,0|1,0,1]=4 1126 B7R0.3 CCC(CCC=C)O TS32091 [0,2,0,0,0,0|1,0,0]=3 1127 B7R0.3 CCC=CC(C)CC TS31968 [0,2,0,0,0,0|1,0,1]=4 1128 B7R0.3 CCCCC(=C)CC TS04366 [0,2,0,0,0,0|1,0,0]=3 1129 B7R0.3 CCCCC(=CC)C TS04336 [0,2,0,0,0,0|1,0,1]=4 1130 B7R0.3 CCCCC(=NO)C TS04540 [0,2,0,0,0,0|0,0,2]=4 1131 B7R0.3 CCCCC(=O)CC TS04462 [0,2,0,0,0,0|1,0,0]=3 1132 B7R0.3 CCCCC(=O)NC TS32169 [0,2,0,0,0,0|0,0,1]=3 1133 B7R0.3 CCCCC(=O)NN TS04606 [0,2,0,0,0,0|0,0,1]=3 1134 B7R0.3 CCCCC(=O)OC TS32226 [0,2,0,0,0,0|1,0,1]=4 1135 B7R0.3 CCCCC(C#C)O TS31937 [0,2,0,0,0,0|1,0,0]=3 1136 B7R0.3 CCCCC(C)CBr TS14345 [0,2,0,0,0,0|1,0,0]=3 1137 B7R0.3 CCCCC(C)CC TS32121 [0,2,0,0,0,0|1,0,0]=3 1138 B7R0.3 CCCCC(C)CO TS32251 [0,2,0,0,0,0|1,0,0]=3 1139 B7R0.3 CCCCC(C=C)O TS04474 [0,2,0,0,0,0|1,0,0]=3 1140 B7R0.3 CCCCC(CBr)Br TS85274 [0,2,0,0,0,0|1,0,0]=3 1141 B7R0.3 CCCCC(CC)Br TS14340 [0,2,0,0,0,0|1,0,0]=3 1142 B7R0.3 CCCCC(CC)N TS04554 [0,2,0,0,0,0|0,0,0]=2 1143 B7R0.3 CCCCC(CC)O TS04628 [0,2,0,0,0,0|1,0,0]=3 1144 B7R0.3 CCCCC(CCl)Cl TS10545 [0,2,0,0,0,0|1,0,0]=3 1145 B7R0.3 CCCCC(CO)N TS32290 [0,2,0,0,0,0|0,0,0]=2 1146 B7R0.3 CCCCC(CO)O TS32342 [0,2,0,0,0,0|1,0,0]=3 1147 B7R0.3 CCCCN(C)N=O TS04602 [0,2,0,0,0,0|1,0,1]=4 1148 B7R0.3 CCCC[C@@H](CO)N TS32293 [0,2,0,0,0,0|0,0,0]=2 1149 B7R0.3 CCCC[C@H](CO)N TS32292 [0,2,0,0,0,0|0,0,0]=2 1150 B7R0.3 CCCNC(C)CC TS04555 [0,2,0,0,0,0|1,0,0]=3 1151 B7R0.3 CCCOC(=O)CCl TS06137 [0,2,0,0,0,0|1,0,1]=4 1152 B7R0.3 CCCOC(=O)CN TS41315 [0,2,0,0,0,0|0,0,1]=3 1153 B7R0.3 CCCSC(=O)CC TS05773 [0,2,0,0,0,0|1,0,1]=4 1154 B7R0.3 CCOCC(CO)O TS04807 [0,2,0,0,0,0|1,0,0]=3 1155 B7R0.3 CCSCC(CO)O TS06111 [0,2,0,0,0,0|1,0,0]=3 1156 B7R0.3 CC[C@H](C)CCCO TS04624 [0,2,0,0,0,0|1,0,0]=3 1157 B7R0.3 COC(=O)CCCBr TS09599 [0,2,0,0,0,0|1,0,1]=4 1158 B7R0.3 COC(=O)CCCCl TS06131 [0,2,0,0,0,0|1,0,1]=4 1159 B7R0.3 COC(=O)CCCI TS52575 [0,2,0,0,0,0|1,0,1]=4 1160 B7R0.3 COC(=O)CCCN TS41316 [0,2,0,0,0,0|0,0,1]=3 1161 B7R0.3 COCCC(=O)NN TS32330 [0,2,0,0,0,0|1,0,1]=4 1162 B7R0.3 CSCCC(CO)N TS06018 [0,2,0,0,0,0|1,0,0]=3 1163 B7R0.3 CSCC[C@@H](CO)N TS07679 [0,2,0,0,0,0|1,0,0]=3 1164 B7R0.3 CSCC[C@H](CO)N TS22806 [0,2,0,0,0,0|1,0,0]=3 1165 B7R0.3 C[C@H](CO)OCOC TS94527 [0,2,0,0,0,0|2,0,0]=4 1166 B7R0.5 C(CN)C(C(=O)O)N TS32337 [0,2,0,0,0,0|1,0,1]=4 1167 B7R0.5 C(CN)C(C(=O)O)N TS51238 [0,2,0,0,0,0|1,0,1]=4 1168 B7R0.5 C(CN)C(C(=O)O)O TS02964 [0,2,0,0,0,0|1,0,1]=4 1169 B7R0.5 C(CN)[C@@H](C(=O)O)N TS01514 [0,2,0,0,0,0|1,0,1]=4 1170 B7R0.5 C(CN)[C@@H](C(=O)O)N TS54154 [0,2,0,0,0,0|1,0,1]=4 1171 B7R0.5 C(CN)[C@@H](C(=O)O)O TS46625 [0,2,0,0,0,0|1,0,1]=4 1172 B7R0.5 C(CN)[C@H](C(=O)O)F TS04856 [0,2,0,0,0,0|1,0,1]=4 1173 B7R0.5 C(CN)[C@H](C(=O)O)N TS04719 [0,2,0,0,0,0|1,0,1]=4 1174 B7R0.5 C(CN)[C@H](C(=O)O)N TS51237 [0,2,0,0,0,0|1,0,1]=4 1175 B7R0.5 CC(C)C(C)CC=C TS04343 [0,2,0,0,0,0|1,0,1]=4 1176 B7R0.5 CC(C)C(CC=C)O TS32108 [0,2,0,0,0,0|1,0,1]=4 1177 B7R0.5 CC(C)N(C)CCO TS32296 [0,2,0,0,0,0|2,0,0]=4 1178 B7R0.5 CCCC(=C)C(C)C TS04341 [0,2,0,0,0,0|1,0,1]=4 1179 B7R0.5 CCCC(=O)C(C)C TS32114 [0,2,0,0,0,0|1,0,1]=4 1180 B7R0.5 CCCC(C(=O)Cl)Br TS18873 [0,2,0,0,0,0|1,0,1]=4 1181 B7R0.5 CCCC(C(=O)O)Br TS14719 [0,2,0,0,0,0|1,0,1]=4 1182 B7R0.5 CCCC(C(=O)O)N TS04663 [0,2,0,0,0,0|1,0,1]=4 1183 B7R0.5 CCCC(C(=O)[O-])O TS06422 [0,2,0,0,0,0|1,0,1]=4 1184 B7R0.5 CCCC(C(C)Br)Br TS61926 [0,2,0,0,0,0|1,0,0]=3 1185 B7R0.5 CCCC(C(C)C)O TS32239 [0,2,0,0,0,0|1,0,0]=3 1186 B7R0.5 CCCC(C)C(=C)C TS31970 [0,2,0,0,0,0|1,0,1]=4 1187 B7R0.5 CCCC(C)C(=O)C TS04464 [0,2,0,0,0,0|1,0,1]=4 1188 B7R0.5 CCCC(C)C(=O)Cl TS05952 [0,2,0,0,0,0|1,0,1]=4 1189 B7R0.5 CCCC(C)C(C)C TS04507 [0,2,0,0,0,0|1,0,0]=3 1190 B7R0.5 CCCC(C)C(C)O TS32245 [0,2,0,0,0,0|1,0,0]=3 1191 B7R0.5 CCC[C@@H](C(=O)N)N TS41224 [0,2,0,0,0,0|0,0,1]=3 1192 B7R0.5 CCC[C@@H](C(=O)O)N TS93993 [0,2,0,0,0,0|1,0,1]=4 1193 B7R0.5 CCC[C@H](C(=O)O)N TS04664 [0,2,0,0,0,0|1,0,1]=4 1194 B7R0.5 CCNC(C)C(C)C TS04548 [0,2,0,0,0,0|2,0,0]=4 1195 B7R0.5 CCOC(=O)C(C)N TS55877 [0,2,0,0,0,0|1,0,1]=4 1196 B7R0.5 CCOC(=O)[C@@H](C)N TS41313 [0,2,0,0,0,0|1,0,1]=4 1197 B7R0.5 CCOC(=O)[C@H](C)N TS02287 [0,2,0,0,0,0|1,0,1]=4 1198 B7R0.5 CCOC(C(F)F)O TS05132 [0,2,0,0,0,0|2,0,0]=4 1199 B7R0.7 C(CCl)C(=O)CCCl TS46816 [0,2,0,0,0,0|1,0,1]=4 1200 B7R0.7 C(CO)C(=O)CCO TS04717 [0,2,0,0,0,0|1,0,1]=4 1201 B7R0.7 C(CS(=O)CCO)O TS06287 [0,2,0,0,0,0|2,0,0]=4 1202 B7R0.7 CC(CCBr)CCBr TS27082 [0,2,0,0,0,0|1,0,0]=3 1203 B7R0.7 CC(CCI)CCI TS78357 [0,2,0,0,0,0|1,0,0]=3 1204 B7R0.7 CC(CCO)CCO TS04739 [0,2,0,0,0,0|1,0,0]=3 1205 B7R0.7 CCCC(=CCC)C TS31954 [0,2,0,0,0,0|1,0,1]=4 1206 B7R0.7 CCCC(=O)CCC TS32100 [0,2,0,0,0,0|1,0,0]=3 1207 B7R0.7 CCCC(=O)OCC TS32219 [0,2,0,0,0,0|1,0,1]=4 1208 B7R0.7 CCCC(=O)OCCl TS55810 [0,2,0,0,0,0|1,0,1]=4 1209 B7R0.7 CCCC(=S)OCC TS05779 [0,2,0,0,0,0|1,0,1]=4 1210 B7R0.7 CCCC(=S)OCC TS07488 [0,2,0,0,0,0|1,0,1]=4 1211 B7R0.7 CCCC(C)C=NO TS32167 [0,2,0,0,0,0|0,0,2]=4 1212 B7R0.7 CCCC(C)CC=C TS31971 [0,2,0,0,0,0|1,0,0]=3 1213 B7R0.7 CCCC(C)CCC TS04512 [0,2,0,0,0,0|1,0,0]=3 1214 B7R0.7 CCCC(C)CCO TS32249 [0,2,0,0,0,0|1,0,0]=3 1215 B7R0.7 CCCC(C)N=C=S TS36445 [0,2,0,0,0,0|1,0,1]=4 1216 B7R0.7 CCCC(C)OCC TS32250 [0,2,0,0,0,0|1,0,0]=3 1217 B7R0.7 CCCC(C=CC)O TS04465 [0,2,0,0,0,0|1,0,1]=4 1218 B7R0.7 CCCC(CC=C)O TS04466 [0,2,0,0,0,0|1,0,0]=3 1219 B7R0.7 CCCC(CCC)Br TS14339 [0,2,0,0,0,0|1,0,0]=3 1220 B7R0.7 CCCC(CCC)Cl TS36889 [0,2,0,0,0,0|1,0,0]=3 1221 B7R0.7 CCCC(CCC)N TS02992 [0,2,0,0,0,0|1,0,0]=3 1222 B7R0.7 CCCC(CCC)O TS04625 [0,2,0,0,0,0|1,0,0]=3 1223 B7R0.7 CCCC(CCC)[Zn+] TS62077 [0,2,0,0,0,0|1,0,0]=3 1224 B7R0.7 CCCC(CCO)S TS36876 [0,2,0,0,0,0|1,0,0]=3 1225 B7R0.7 CCCN(C)CCC TS04549 [0,2,0,0,0,0|1,0,0]=3 1226 B7R0.7 CCCS(=O)CCC TS36875 [0,2,0,0,0,0|1,0,0]=3 1227 B7R0.7 CCC[C@@H](C)CCO TS32231 [0,2,0,0,0,0|1,0,0]=3 1228 B7R0.7 CCOC(=O)CCBr TS08511 [0,2,0,0,0,0|1,0,1]=4 1229 B7R0.7 CCOC(=O)CCCl TS66003 [0,2,0,0,0,0|1,0,1]=4 1230 B7R0.7 CCOC(=O)CCI TS56139 [0,2,0,0,0,0|1,0,1]=4 1231 B7R0.7 CCOC(=O)CCN TS01886 [0,2,0,0,0,0|0,0,1]=3 1232 B7R0.7 CCOC(=O)CCN TS04667 [0,2,0,0,0,0|0,0,1]=3 1233 B7R0.7 CCOC(=O)CCS TS05923 [0,2,0,0,0,0|1,0,1]=4 1234 B7R0.7 CCOC(=O)CC[Zn+] TS62340 [0,2,0,0,0,0|1,0,1]=4 1235 B7R0.7 CCOC(=O)CNC TS01479 [0,2,0,0,0,0|1,0,1]=4 1236 B7R0.7 CCOC(=O)CNN TS56149 [0,2,0,0,0,0|1,0,1]=4 1237 B7R0.7 CCOC(C)OCC TS04742 [0,2,0,0,0,0|2,0,0]=4 1238 B7R0.7 CCOC(OCC)[SiH3] TS36880 [0,2,0,0,0,0|2,0,0]=4 1239 B7R0.7 CN(CCN)CCN TS32301 [0,2,0,0,0,0|1,0,0]=3 1240 B7R0.7 CN(CCO)CCO TS04786 [0,2,0,0,0,0|2,0,0]=4 1241 B7R0.7 COCC(COC)O TS59495 [0,2,0,0,0,0|2,0,0]=4 1242 B7R0.7 CSCC(CSC)O TS10235 [0,2,0,0,0,0|2,0,0]=4 1243 B7R0.10 C(C(C(CBr)Br)Br)Br TS80123 [0,2,0,0,0,0|2,0,0]=4 1244 B7R0.10 C(C(C(CBr)O)O)Br TS27686 [0,2,0,0,0,0|2,0,0]=4 1245 B7R0.10 C(C(C(CO)Br)Br)O TS85188 [0,2,0,0,0,0|2,0,0]=4 1246 B7R0.10 C([C@@H]([C@H](CO)O)O)O TS32487 [0,2,0,0,0,0|2,0,0]=4 1247 B7R0.10 C([C@@H]([C@H](CS)O)O)S TS41446 [0,2,0,0,0,0|2,0,0]=4 1248 B7R0.10 C([C@H]([C@@H](CO)O)O)O TS32486 [0,2,0,0,0,0|2,0,0]=4 1249 B7R0.10 C([C@H]([C@@H](CS)O)O)S TS41447 [0,2,0,0,0,0|2,0,0]=4 1250 B7R0.10 C([C@H]([C@H](CBr)Br)Br)Br TS80124 [0,2,0,0,0,0|2,0,0]=4 1251 B7R0.10 C([C@H]([C@H](CS)O)O)S TS41444 [0,2,0,0,0,0|2,0,0]=4 1252 B7R0.10 CCC(C(=O)CC)O TS32221 [0,2,0,0,0,0|1,0,1]=4 1253 B7R0.10 CCC(C(C)C=O)S TS05778 [0,2,0,0,0,0|1,0,1]=4 1254 B7R0.10 CCC(C(C)CO)S TS36877 [0,2,0,0,0,0|1,0,0]=3 1255 B7R0.10 CCC(C(CC)Br)Br TS61927 [0,2,0,0,0,0|1,0,0]=3 1256 B7R0.10 CCC(C)C(=C)CC TS04351 [0,2,0,0,0,0|1,0,1]=4 1257 B7R0.10 CCC(C)C(=O)CC TS04477 [0,2,0,0,0,0|1,0,1]=4 1258 B7R0.10 CCC(C)C(C)C=C TS04364 [0,2,0,0,0,0|1,0,1]=4 1259 B7R0.10 CCC(C)C(C)C=O TS04460 [0,2,0,0,0,0|1,0,1]=4 1260 B7R0.10 CCC(C)C(C)CC TS04508 [0,2,0,0,0,0|1,0,0]=3 1261 B7R0.10 CCC(C)C(C)CO TS32242 [0,2,0,0,0,0|1,0,0]=3 1262 B7R0.10 CCC(C)C(CC)O TS04626 [0,2,0,0,0,0|1,0,0]=3 1263 B7R0.10 CC[C@@H](C)[C@H](CO)N TS22803 [0,2,0,0,0,0|1,0,0]=3 1264 B7R0.11 CC(C)(CCO)OC TS04745 [0,2,0,0,0,0|2,0,0]=4 1265 B7R0.11 CCC(C)(C)CC=C TS02214 [0,2,0,0,0,0|1,0,1]=4 1266 B7R0.11 CCC(C)(C)CCBr TS14343 [0,2,0,0,0,0|1,0,0]=3 1267 B7R0.11 CCC(C)(C)CCCl TS36891 [0,2,0,0,0,0|1,0,0]=3 1268 B7R0.11 CCC(C)(C)CCO TS32247 [0,2,0,0,0,0|1,0,0]=3 1269 B7R0.11 CCC(C)(C)OCC TS32244 [0,2,0,0,0,0|2,0,0]=4 1270 B7R0.11 CCC(C)(CC=C)O TS04476 [0,2,0,0,0,0|1,0,1]=4 1271 B7R0.11 CCCC(C)(C#C)O TS04309 [0,2,0,0,0,0|1,0,1]=4 1272 B7R0.11 CCCC(C)(C)C=C TS04346 [0,2,0,0,0,0|1,0,1]=4 1273 B7R0.11 CCCC(C)(C)CC TS32122 [0,2,0,0,0,0|1,0,0]=3 1274 B7R0.11 CCCC(C)(CC)Cl TS36886 [0,2,0,0,0,0|1,0,0]=3 1275 B7R0.11 CCCC(C)(CC)O TS04623 [0,2,0,0,0,0|1,0,0]=3 1276 B7R0.11 CCCC(C=O)(Cl)Cl TS10544 [0,2,0,0,0,0|1,0,1]=4 1277 B7R0.11 CCO[C@@](C)(CO)O TS94520 [0,2,0,0,0,0|2,0,0]=4 1278 B7R0.12 CCC(CC)CCO TS32252 [0,2,0,0,0,0|1,0,0]=3 1279 B7R0.12 CCCC(CC)CC TS04503 [0,2,0,0,0,0|1,0,0]=3 1280 B7R0.12 CCCC(CC)CO TS32241 [0,2,0,0,0,0|1,0,0]=3 1281 B7R0.12 CCCC(CO)CO TS32343 [0,2,0,0,0,0|1,0,0]=3 1282 B7R0.12 CCCN(CC)CC TS04562 [0,2,0,0,0,0|2,0,0]=4 1283 B7R0.12 CCN(CC)CCBr TS29610 [0,2,0,0,0,0|2,0,0]=4 1284 B7R0.12 CCN(CC)CCCl TS06027 [0,2,0,0,0,0|2,0,0]=4 1285 B7R0.12 CCN(CC)CCCl TS13111 [0,2,0,0,0,0|2,0,0]=4 1286 B7R0.12 CCN(CC)CCN TS16125 [0,2,0,0,0,0|1,0,0]=3 1287 B7R0.12 CCN(CC)CCN TS56347 [0,2,0,0,0,0|1,0,0]=3 1288 B7R0.12 CCN(CC)CCO TS32287 [0,2,0,0,0,0|2,0,0]=4 1289 B7R0.12 CCN(CC)CCO TS41323 [0,2,0,0,0,0|2,0,0]=4 1290 B7R0.12 CCN(CC)CCO TS92957 [0,2,0,0,0,0|2,0,0]=4 1291 B7R0.12 CCN(CC)CCS TS36786 [0,2,0,0,0,0|2,0,0]=4 1292 B7R0.12 CCN(CC)CCS TS45065 [0,2,0,0,0,0|2,0,0]=4 1293 B7R0.12 CCN(CCO)N=O TS32331 [0,2,0,0,0,0|2,0,0]=4 1294 B7R0.12 COC(CCBr)OC TS09492 [0,2,0,0,0,0|2,0,0]=4 1295 B7R0.4 B(CCCCC)(O)O TS01615 [0,2,0,0,0,0|1,0,0]=3 1296 B7R0.4 C(CC(=O)O)CON TS18930 [0,2,0,0,0,0|1,0,1]=4 1297 B7R0.4 C(CCBr)CC(=N)N TS47673 [0,2,0,0,0,0|0,0,1]=3 1298 B7R0.4 C(CCBr)CC(=O)Cl TS71477 [0,2,0,0,0,0|1,0,1]=4 1299 B7R0.4 C(CCBr)CC(=O)O TS14721 [0,2,0,0,0,0|1,0,1]=4 1300 B7R0.4 C(CCCl)CC(=O)Cl TS10542 [0,2,0,0,0,0|1,0,1]=4 1301 B7R0.4 C(CCCl)CC(=O)O TS06138 [0,2,0,0,0,0|1,0,1]=4 1302 B7R0.4 C(CCN)CC(=O)O TS04661 [0,2,0,0,0,0|0,0,1]=3 1303 B7R0.4 C(CCN)CC(=O)O TS41314 [0,2,0,0,0,0|0,0,1]=3 1304 B7R0.4 C(CNCC(=O)O)N TS32336 [0,2,0,0,0,0|1,0,1]=4 1305 B7R0.4 C(COCC(=O)N)O TS32389 [0,2,0,0,0,0|1,0,1]=4 1306 B7R0.4 CC#CCCC(C)C TS31843 [0,2,0,0,0,0|1,0,1]=4 1307 B7R0.4 CC(=O)CCCC#N TS04252 [0,2,0,0,0,0|0,0,2]=4 1308 B7R0.4 CC(=O)CCCCBr TS47671 [0,2,0,0,0,0|1,0,0]=3 1309 B7R0.4 CC(=O)CCCCCl TS05947 [0,2,0,0,0,0|1,0,0]=3 1310 B7R0.4 CC(=O)OCCCCl TS06130 [0,2,0,0,0,0|1,0,1]=4 1311 B7R0.4 CC(C)CCCC=C TS31960 [0,2,0,0,0,0|1,0,0]=3 1312 B7R0.4 CC(C)CCCCBr TS14341 [0,2,0,0,0,0|1,0,0]=3 1313 B7R0.4 CC(C)CCCCCl TS36890 [0,2,0,0,0,0|1,0,0]=3 1314 B7R0.4 CC(C)CCN=C=S TS05485 [0,2,0,0,0,0|1,0,1]=4 1315 B7R0.4 CC(C)CCOC=O TS32212 [0,2,0,0,0,0|1,0,1]=4 1316 B7R0.4 CC(C)CCON=O TS01922 [0,2,0,0,0,0|1,0,1]=4 1317 B7R0.4 CC(C)COCCO TS04743 [0,2,0,0,0,0|1,0,0]=3 1318 B7R0.4 CC(C)CSCCO TS36873 [0,2,0,0,0,0|1,0,0]=3 1319 B7R0.4 CC(C)NCCCN TS04629 [0,2,0,0,0,0|0,0,0]=2 1320 B7R0.4 CC(C)NCCOC TS32291 [0,2,0,0,0,0|2,0,0]=4 1321 B7R0.4 CC(C)OCCC#N TS32022 [0,2,0,0,0,0|0,0,2]=4 1322 B7R0.4 CC(C)OCCCN TS32297 [0,2,0,0,0,0|0,0,0]=2 1323 B7R0.4 CC(CCCCO)O TS04744 [0,2,0,0,0,0|1,0,0]=3 1324 B7R0.4 CC(CNCCN)O TS32351 [0,2,0,0,0,0|0,0,0]=2 1325 B7R0.4 CC=CCCC(C)C TS31977 [0,2,0,0,0,0|1,0,1]=4 1326 B7R0.4 CCC#CCC(C)C TS04215 [0,2,0,0,0,0|1,0,1]=4 1327 B7R0.4 CCC#CCC(C)O TS31938 [0,2,0,0,0,0|1,0,1]=4 1328 B7R0.4 CCC#CCN(C)C TS31890 [0,2,0,0,0,0|0,0,2]=4 1329 B7R0.4 CCC=CCC(C)C TS04361 [0,2,0,0,0,0|1,0,1]=4 1330 B7R0.4 CCCC=CC(C)C TS04365 [0,2,0,0,0,0|1,0,1]=4 1331 B7R0.4 CCCCC=C(C)C TS04347 [0,2,0,0,0,0|1,0,1]=4 1332 B7R0.4 CCCCCC(=C)C TS04340 [0,2,0,0,0,0|1,0,0]=3 1333 B7R0.4 CCCCCC(=O)C TS32098 [0,2,0,0,0,0|1,0,0]=3 1334 B7R0.4 CCCCCC(=O)Cl TS05948 [0,2,0,0,0,0|1,0,0]=3 1335 B7R0.4 CCCCCC(=O)N TS32152 [0,2,0,0,0,0|0,0,0]=2 1336 B7R0.4 CCCCCC(=O)O TS32204 [0,2,0,0,0,0|1,0,0]=3 1337 B7R0.4 CCCCCC(=O)[O-] TS37174 [0,2,0,0,0,0|1,0,0]=3 1338 B7R0.4 CCCCCC(=O)[O-] TS58596 [0,2,0,0,0,0|1,0,0]=3 1339 B7R0.4 CCCCCC(C)Br TS14342 [0,2,0,0,0,0|1,0,0]=3 1340 B7R0.4 CCCCCC(C)C TS32120 [0,2,0,0,0,0|1,0,0]=3 1341 B7R0.4 CCCCCC(C)Cl TS05959 [0,2,0,0,0,0|1,0,0]=3 1342 B7R0.4 CCCCCC(C)N TS04560 [0,2,0,0,0,0|0,0,0]=2 1343 B7R0.4 CCCCCC(C)O TS32255 [0,2,0,0,0,0|1,0,0]=3 1344 B7R0.4 CCCCC[C@@H](C)N TS04556 [0,2,0,0,0,0|0,0,0]=2 1345 B7R0.4 CCCCC[C@@H](C)O TS04622 [0,2,0,0,0,0|1,0,0]=3 1346 B7R0.4 CCCCC[C@H](C)N TS04553 [0,2,0,0,0,0|0,0,0]=2 1347 B7R0.4 CCCCC[C@H](C)O TS32248 [0,2,0,0,0,0|1,0,0]=3 1348 B7R0.4 CCCCC[N+](=O)[O-] TS04659 [0,2,0,0,0,0|0,0,1]=3 1349 B7R0.4 CCCCNC(=O)C TS32171 [0,2,0,0,0,0|1,0,1]=4 1350 B7R0.4 CCCCNC(=O)N TS04607 [0,2,0,0,0,0|0,0,1]=3 1351 B7R0.4 CCCCNC(=S)N TS05781 [0,2,0,0,0,0|0,0,1]=3 1352 B7R0.4 CCCCOC(=O)C TS32218 [0,2,0,0,0,0|1,0,1]=4 1353 B7R0.4 CCCCOC(=O)Cl TS16538 [0,2,0,0,0,0|1,0,1]=4 1354 B7R0.4 CCCCOC(=O)N TS04660 [0,2,0,0,0,0|0,0,1]=3 1355 B7R0.4 CCCCOC(=S)C TS05777 [0,2,0,0,0,0|1,0,1]=4 1356 B7R0.4 CCCCOC(Cl)Cl TS10816 [0,2,0,0,0,0|1,0,0]=3 1357 B7R0.4 CCCCON(=O)=O TS32384 [0,2,0,0,0,0|1,0,1]=4 1358 B7R0.4 CCCCSC(C)C TS05791 [0,2,0,0,0,0|1,0,0]=3 1359 B7R0.4 CCCNCC(=O)O TS04670 [0,2,0,0,0,0|1,0,1]=4 1360 B7R0.4 CCCOCC(=O)O TS32314 [0,2,0,0,0,0|1,0,1]=4 1361 B7R0.4 CCCOCC(C)O TS04740 [0,2,0,0,0,0|1,0,0]=3 1362 B7R0.4 CCCSCC(=O)O TS05921 [0,2,0,0,0,0|1,0,1]=4 1363 B7R0.4 CCCSCC(C)C TS05789 [0,2,0,0,0,0|1,0,0]=3 1364 B7R0.4 CCNCCN(C)C TS04631 [0,2,0,0,0,0|1,0,0]=3 1365 B7R0.4 CCOCCC(=O)C TS04589 [0,2,0,0,0,0|1,0,1]=4 1366 B7R0.4 CCOCCC(=O)O TS32325 [0,2,0,0,0,0|1,0,1]=4 1367 B7R0.4 CCO[SiH2]CN(C)C TS36788 [0,2,0,0,0,0|1,1,0]=4 1368 B7R0.4 CCSCCC(C)C TS05793 [0,2,0,0,0,0|1,0,0]=3 1369 B7R0.4 CN(C)CCCC#N TS04320 [0,2,0,0,0,0|0,0,2]=4 1370 B7R0.4 CN(C)CCCC=O TS32154 [0,2,0,0,0,0|1,0,1]=4 1371 B7R0.4 CN(C)CCCCN TS32257 [0,2,0,0,0,0|0,0,0]=2 1372 B7R0.4 CN(C)CCCCO TS32288 [0,2,0,0,0,0|1,0,0]=3 1373 B7R0.4 CNCCCC(=O)O TS41308 [0,2,0,0,0,0|1,0,1]=4 1374 B7R0.4 CNCCCN(C)C TS08611 [0,2,0,0,0,0|1,0,0]=3 1375 B7R0.4 COCCNC(=S)N TS05925 [0,2,0,0,0,0|1,0,1]=4 1376 B7R0.4 C[C@H](CCCCO)O TS04737 [0,2,0,0,0,0|1,0,0]=3 1377 B7R0.6 CC(C)CCC(=C)C TS31967 [0,2,0,0,0,0|1,0,1]=4 1378 B7R0.6 CC(C)CCC(=O)C TS32095 [0,2,0,0,0,0|1,0,1]=4 1379 B7R0.6 CC(C)CCC(=O)Cl TS05954 [0,2,0,0,0,0|1,0,1]=4 1380 B7R0.6 CC(C)CCC(=O)O TS32208 [0,2,0,0,0,0|1,0,1]=4 1381 B7R0.6 CC(C)CCC(C)C TS04511 [0,2,0,0,0,0|1,0,0]=3 1382 B7R0.6 CC(C)CCC(C)N TS04558 [0,2,0,0,0,0|0,0,0]=2 1383 B7R0.6 CC(C)CCC(C)O TS32237 [0,2,0,0,0,0|1,0,0]=3 1384 B7R0.6 CC(C)CNC(=O)N TS04600 [0,2,0,0,0,0|1,0,1]=4 1385 B7R0.6 CC(C)CNC(=S)N TS05782 [0,2,0,0,0,0|1,0,1]=4 1386 B7R0.6 CC(C)COC(=O)N TS32285 [0,2,0,0,0,0|1,0,1]=4 1387 B7R0.6 CC(CCC(=C)C)O TS32103 [0,2,0,0,0,0|1,0,1]=4 1388 B7R0.6 CC(CCC(=O)Cl)Cl TS10541 [0,2,0,0,0,0|1,0,1]=4 1389 B7R0.6 CC(CCC(C)Br)Br TS61928 [0,2,0,0,0,0|1,0,0]=3 1390 B7R0.6 CC(CCC(C)O)O TS04747 [0,2,0,0,0,0|1,0,0]=3 1391 B7R0.8 C(CC(F)(F)Br)CO TS16110 [0,2,0,0,0,0|2,0,0]=4 1392 B7R0.8 C(CC(F)(F)F)CBr TS17205 [0,2,0,0,0,0|2,0,0]=4 1393 B7R0.8 C(CC(F)(F)F)CI TS57018 [0,2,0,0,0,0|2,0,0]=4 1394 B7R0.8 C(CC(F)(F)F)CN TS05256 [0,2,0,0,0,0|1,0,0]=3 1395 B7R0.8 C(CC(F)(F)F)CO TS36263 [0,2,0,0,0,0|2,0,0]=4 1396 B7R0.8 C(CN)CP(=O)(O)O TS02668 [0,2,0,0,0,0|2,0,0]=4 1397 B7R0.8 C(CN)CS(=O)(=O)O TS37300 [0,2,0,0,0,0|2,0,0]=4 1398 B7R0.8 C(CN)C[Si](O)(O)O TS06205 [0,2,0,0,0,0|1,1,0]=4 1399 B7R0.8 C(COC(F)(F)F)N TS12100 [0,2,0,0,0,0|2,0,0]=4 1400 B7R0.8 CC(C)(C)CCCBr TS14344 [0,2,0,0,0,0|1,0,0]=3 1401 B7R0.8 CC(C)(C)CCCN TS94288 [0,2,0,0,0,0|0,0,0]=2 1402 B7R0.8 CC(C)(C)NCCO TS32299 [0,2,0,0,0,0|2,0,0]=4 1403 B7R0.8 CC(C)(C)OCCN TS41324 [0,2,0,0,0,0|1,0,0]=3 1404 B7R0.8 CC(C)(C)OCCO TS04746 [0,2,0,0,0,0|2,0,0]=4 1405 B7R0.8 CC(C)(C)SCCN TS45064 [0,2,0,0,0,0|1,0,0]=3 1406 B7R0.8 CC(C)(CCC#N)Cl TS05683 [0,2,0,0,0,0|0,0,2]=4 1407 B7R0.8 CC(C)(CCC=C)O TS32097 [0,2,0,0,0,0|1,0,1]=4 1408 B7R0.8 CCCCC(C)(Br)Br TS61925 [0,2,0,0,0,0|1,0,0]=3 1409 B7R0.8 CCCCC(C)(C)C TS04510 [0,2,0,0,0,0|1,0,0]=3 1410 B7R0.8 CCCCC(C)(C)Cl TS36888 [0,2,0,0,0,0|1,0,0]=3 1411 B7R0.8 CCCCC(C)(C)O TS04619 [0,2,0,0,0,0|1,0,0]=3 1412 B7R0.8 CCCCP(=O)(O)O TS06222 [0,2,0,0,0,0|2,0,0]=4 1413 B7R0.8 CCCCS(=O)(=O)Cl TS33236 [0,2,0,0,0,0|2,0,0]=4 1414 B7R0.8 CCCCS(=O)(=O)[O-] TS11213 [0,2,0,0,0,0|2,0,0]=4 1415 B7R0.8 CCCC[Ge](Cl)(Cl)Cl TS56741 [0,2,0,0,0,0|1,1,0]=4 1416 B7R0.8 CCCC[N+](C)(C)C TS10100 [0,2,0,0,0,0|2,0,0]=4 1417 B7R0.8 CCCC[Si](C)(C)Cl TS09983 [0,2,0,0,0,0|1,1,0]=4 1418 B7R0.8 CCCC[Si](C)(Cl)Cl TS12960 [0,2,0,0,0,0|1,1,0]=4 1419 B7R0.8 CCCC[Si](Cl)(Cl)Cl TS17371 [0,2,0,0,0,0|1,1,0]=4 1420 B7R0.8 CCCC[Sn](C)(C)Cl TS57579 [0,2,0,0,0,0|2,0,0]=4 1421 B7R0.8 CCCC[Sn](Cl)(Cl)Cl TS34394 [0,2,0,0,0,0|2,0,0]=4 1422 B7R0.8 CCCC[Sn](O)(O)Cl TS62173 [0,2,0,0,0,0|2,0,0]=4 1423 B7R0.8 CP(=O)(CCCN)O TS13406 [0,2,0,0,0,0|1,0,0]=3 1424 B7R0.8 CP(=O)(CCCN)O TS37084 [0,2,0,0,0,0|1,0,0]=3 1425 B7R0.8 C[N+](C)(C)CCCBr TS29609 [0,2,0,0,0,0|2,0,0]=4 1426 B7R0.8 C[Si](C)(C)CCCCl TS40949 [0,2,0,0,0,0|1,1,0]=4 1427 B7R0.8 C[Si](C)(C)CCCN TS36631 [0,2,0,0,0,0|0,1,0]=3 1428 B7R0.8 C[Si](C)(C)CCON TS45066 [0,2,0,0,0,0|1,1,0]=4 1429 B7R0.8 C[Si](C)(C)OCCN TS36789 [0,2,0,0,0,0|1,1,0]=4 1430 B7R0.8 C[Si](C)(CCCCl)Cl TS12961 [0,2,0,0,0,0|1,1,0]=4 1431 B7R0.8 C[Si](CCCCl)(Cl)Cl TS17370 [0,2,0,0,0,0|1,1,0]=4 1432 B7R0.8 [B-](CCCC)(F)(F)F TS94648 [0,2,0,0,0,0|2,0,0]=4 1433 B7R0.1 C#CCCCCC#C TS04098 [0,2,0,0,0,0|1,0,1]=4 1434 B7R0.1 C#CCCCCCO TS01237 [0,2,0,0,0,0|1,0,0]=3 1435 B7R0.1 C(CCC#N)CCBr TS39357 [0,2,0,0,0,0|0,0,1]=3 1436 B7R0.1 C(CCC#N)CCCl TS05684 [0,2,0,0,0,0|0,0,1]=3 1437 B7R0.1 C(CCC#N)CCN TS04328 [0,2,0,0,0,0|0,0,0]=2 1438 B7R0.1 C(CCC=O)CC=O TS29478 [0,2,0,0,0,0|1,0,1]=4 1439 B7R0.1 C(CCCBr)CCBr TS07890 [0,2,0,0,0,0|1,0,0]=3 1440 B7R0.1 C(CCCBr)CCCl TS00416 [0,2,0,0,0,0|1,0,0]=3 1441 B7R0.1 C(CCCBr)CCO TS59727 [0,2,0,0,0,0|1,0,0]=3 1442 B7R0.1 C(CCCCl)CCCl TS10546 [0,2,0,0,0,0|1,0,0]=3 1443 B7R0.1 C(CCCCl)CCO TS06143 [0,2,0,0,0,0|1,0,0]=3 1444 B7R0.1 C(CCCI)CCCl TS27509 [0,2,0,0,0,0|1,0,0]=3 1445 B7R0.1 C(CCCN)CCN TS04632 [0,2,0,0,0,0|0,0,0]=2 1446 B7R0.1 C(CCCN)CCN TS41228 [0,2,0,0,0,0|0,0,0]=2 1447 B7R0.1 C(CCCN)CCN TS41960 [0,2,0,0,0,0|0,0,0]=2 1448 B7R0.1 C(CCCN)CCN TS42181 [0,2,0,0,0,0|0,0,0]=2 1449 B7R0.1 C(CCCO)CCN TS39356 [0,2,0,0,0,0|0,0,0]=2 1450 B7R0.1 C(CCCO)CCO TS46825 [0,2,0,0,0,0|1,0,0]=3 1451 B7R0.1 C(CCCS)CCO TS36872 [0,2,0,0,0,0|1,0,0]=3 1452 B7R0.1 C(CCCS)CCS TS40940 [0,2,0,0,0,0|1,0,0]=3 1453 B7R0.1 C(CCC[Zn+])CCCl TS68903 [0,2,0,0,0,0|1,0,0]=3 1454 B7R0.1 C(CCO)CC=NO TS04658 [0,2,0,0,0,0|0,0,2]=4 1455 B7R0.1 C(CN)CNCCBr TS56331 [0,2,0,0,0,0|0,0,0]=2 1456 B7R0.1 C(CN)CNCCN TS32302 [0,2,0,0,0,0|0,0,0]=2 1457 B7R0.1 C(CN)CNCCO TS56334 [0,2,0,0,0,0|0,0,0]=2 1458 B7R0.1 C(CNCCN)C#N TS32023 [0,2,0,0,0,0|0,0,1]=3 1459 B7R0.1 C(CNCCN)CO TS32350 [0,2,0,0,0,0|0,0,0]=2 1460 B7R0.1 C(CNCCO)CO TS04790 [0,2,0,0,0,0|1,0,0]=3 1461 B7R0.1 C(CO)C#CCCO TS32070 [0,2,0,0,0,0|1,0,1]=4 1462 B7R0.1 C(CSCCO)C#N TS05678 [0,2,0,0,0,0|0,0,2]=4 1463 B7R0.1 C(CSSCCN)N TS34567 [0,2,0,0,0,0|1,0,0]=3 1464 B7R0.1 C(CSSCCN)N TS63168 [0,2,0,0,0,0|1,0,0]=3 1465 B7R0.1 C(CSSCCO)O TS41445 [0,2,0,0,0,0|2,0,0]=4 1466 B7R0.1 C(C[Se][Se]CCN)N TS77027 [0,2,0,0,0,0|1,0,0]=3 1467 B7R0.1 C=CCCCCC#N TS31810 [0,2,0,0,0,0|0,0,2]=4 1468 B7R0.1 C=CCCCCC=C TS04214 [0,2,0,0,0,0|1,0,1]=4 1469 B7R0.1 C=CCCCCCBr TS59625 [0,2,0,0,0,0|1,0,0]=3 1470 B7R0.1 C=CCCCCCCl TS36738 [0,2,0,0,0,0|1,0,0]=3 1471 B7R0.1 C=CCCCCCO TS04461 [0,2,0,0,0,0|1,0,0]=3 1472 B7R0.1 C=CCOCCCO TS04587 [0,2,0,0,0,0|1,0,1]=4 1473 B7R0.1 C=COCCCCO TS32203 [0,2,0,0,0,0|1,0,1]=4 1474 B7R0.1 CCC#CCCCCl TS36574 [0,2,0,0,0,0|1,0,0]=3 1475 B7R0.1 CCC=CCCC=O TS04313 [0,2,0,0,0,0|1,0,1]=4 1476 B7R0.1 CCC=CCCCO TS04463 [0,2,0,0,0,0|1,0,0]=3 1477 B7R0.1 CCCC#CCC=C TS04139 [0,2,0,0,0,0|1,0,1]=4 1478 B7R0.1 CCCC#CCCC TS31857 [0,2,0,0,0,0|1,0,0]=3 1479 B7R0.1 CCCC#CCCO TS31945 [0,2,0,0,0,0|1,0,0]=3 1480 B7R0.1 CCCC=CCC=C TS31855 [0,2,0,0,0,0|1,0,1]=4 1481 B7R0.1 CCCC=CCCC TS31958 [0,2,0,0,0,0|1,0,0]=3 1482 B7R0.1 CCCC=CCCO TS04459 [0,2,0,0,0,0|1,0,0]=3 1483 B7R0.1 CCCC=COCC TS04469 [0,2,0,0,0,0|1,0,1]=4 1484 B7R0.1 CCCCC#CC=C TS31785 [0,2,0,0,0,0|1,0,1]=4 1485 B7R0.1 CCCCC#CCC TS31859 [0,2,0,0,0,0|1,0,0]=3 1486 B7R0.1 CCCCC#CCO TS31930 [0,2,0,0,0,0|1,0,0]=3 1487 B7R0.1 CCCCC=CC=C TS31850 [0,2,0,0,0,0|1,0,1]=4 1488 B7R0.1 CCCCC=CC=O TS04311 [0,2,0,0,0,0|1,0,1]=4 1489 B7R0.1 CCCCC=CCC TS04348 [0,2,0,0,0,0|1,0,0]=3 1490 B7R0.1 CCCCC=CCC TS31974 [0,2,0,0,0,0|1,0,0]=3 1491 B7R0.1 CCCCC=CCO TS32112 [0,2,0,0,0,0|1,0,0]=3 1492 B7R0.1 CCCCCC#CC TS31856 [0,2,0,0,0,0|1,0,0]=3 1493 B7R0.1 CCCCCC=CC TS31964 [0,2,0,0,0,0|1,0,0]=3 1494 B7R0.1 CCCCCCC#C TS31852 [0,2,0,0,0,0|1,0,0]=3 1495 B7R0.1 CCCCCCC#N TS31893 [0,2,0,0,0,0|0,0,1]=3 1496 B7R0.1 CCCCCCC=O TS32096 [0,2,0,0,0,0|1,0,0]=3 1497 B7R0.1 CCCCCCCBr TS00035 [0,2,0,0,0,0|1,0,0]=3 1498 B7R0.1 CCCCCCCCl TS36887 [0,2,0,0,0,0|1,0,0]=3 1499 B7R0.1 CCCCCCCF TS32353 [0,2,0,0,0,0|1,0,0]=3 1500 B7R0.1 CCCCCCCI TS52275 [0,2,0,0,0,0|1,0,0]=3 1501 B7R0.1 CCCCCCCN TS04552 [0,2,0,0,0,0|0,0,0]=2 1502 B7R0.1 CCCCCCCO TS32232 [0,2,0,0,0,0|1,0,0]=3 1503 B7R0.1 CCCCCCCS TS05788 [0,2,0,0,0,0|1,0,0]=3 1504 B7R0.1 CCCCCCNC TS04559 [0,2,0,0,0,0|0,0,0]=2 1505 B7R0.1 CCCCCCOC TS32254 [0,2,0,0,0,0|1,0,0]=3 1506 B7R0.1 CCCCCCSC TS05792 [0,2,0,0,0,0|1,0,0]=3 1507 B7R0.1 CCCCCN=C=O TS04390 [0,2,0,0,0,0|0,0,1]=3 1508 B7R0.1 CCCCCN=C=S TS36444 [0,2,0,0,0,0|0,0,1]=3 1509 B7R0.1 CCCCCNCC TS04550 [0,2,0,0,0,0|0,0,0]=2 1510 B7R0.1 CCCCCOCC TS32236 [0,2,0,0,0,0|1,0,0]=3 1511 B7R0.1 CCCCCON=O TS04662 [0,2,0,0,0,0|0,0,1]=3 1512 B7R0.1 CCCCCSCC TS36717 [0,2,0,0,0,0|1,0,0]=3 1513 B7R0.1 CCCCNCC#C TS31888 [0,2,0,0,0,0|1,0,0]=3 1514 B7R0.1 CCCCNCCC TS04557 [0,2,0,0,0,0|1,0,0]=3 1515 B7R0.1 CCCCNCCN TS04633 [0,2,0,0,0,0|0,0,0]=2 1516 B7R0.1 CCCCNCCO TS32289 [0,2,0,0,0,0|1,0,0]=3 1517 B7R0.1 CCCCNCCS TS36787 [0,2,0,0,0,0|1,0,0]=3 1518 B7R0.1 CCCCOCC=C TS32094 [0,2,0,0,0,0|1,0,0]=3 1519 B7R0.1 CCCCOCCBr TS48031 [0,2,0,0,0,0|1,0,0]=3 1520 B7R0.1 CCCCOCCCl TS06142 [0,2,0,0,0,0|1,0,0]=3 1521 B7R0.1 CCCCOCCO TS04738 [0,2,0,0,0,0|1,0,0]=3 1522 B7R0.1 CCCCSCC#N TS36442 [0,2,0,0,0,0|0,0,1]=3 1523 B7R0.1 CCCCSCCC TS05790 [0,2,0,0,0,0|1,0,0]=3 1524 B7R0.1 CCCCSCCO TS36874 [0,2,0,0,0,0|1,0,0]=3 1525 B7R0.1 CCCCSSCC TS40937 [0,2,0,0,0,0|1,0,0]=3 1526 B7R0.1 CCCNCCC#N TS04329 [0,2,0,0,0,0|0,0,1]=3 1527 B7R0.1 CCCNCCCN TS32259 [0,2,0,0,0,0|0,0,0]=2 1528 B7R0.1 CCCNCCN=O TS04604 [0,2,0,0,0,0|0,0,1]=3 1529 B7R0.1 CCCOCCCN TS32295 [0,2,0,0,0,0|0,0,0]=2 1530 B7R0.1 CCCSSCC=C TS40693 [0,2,0,0,0,0|1,0,1]=4 1531 B7R0.1 CCCSSCCC TS40941 [0,2,0,0,0,0|1,0,0]=3 1532 B7R0.1 CCNCCCCN TS36623 [0,2,0,0,0,0|0,0,0]=2 1533 B7R0.1 CCNCCCCO TS32294 [0,2,0,0,0,0|1,0,0]=3 1534 B7R0.1 CCNCCNCC TS32258 [0,2,0,0,0,0|1,0,0]=3 1535 B7R0.1 CCOCCCCCl TS06141 [0,2,0,0,0,0|1,0,0]=3 1536 B7R0.1 CCOCCOCC TS32341 [0,2,0,0,0,0|1,0,0]=3 1537 B7R0.1 CNCCCCC=C TS93899 [0,2,0,0,0,0|0,0,1]=3 1538 B7R0.1 CNCCCCNC TS04634 [0,2,0,0,0,0|0,0,0]=2 1539 B7R0.1 CNCCNCCN TS32303 [0,2,0,0,0,0|0,0,0]=2 1540 B7R0.1 COCCCN=C=S TS05679 [0,2,0,0,0,0|1,0,1]=4 1541 B7R0.1 COCCOCCBr TS48373 [0,2,0,0,0,0|1,0,0]=3 1542 B7R0.1 COCCOCCCl TS37251 [0,2,0,0,0,0|1,0,0]=3 1543 B7R0.1 CSCCCCSC TS40938 [0,2,0,0,0,0|1,0,0]=3 1544 B7R0.1 CSCCCN=C=S TS07376 [0,2,0,0,0,0|1,0,1]=4 1545 B5R1.1 C1C=CCN1 TS03158 [1,0,0,1,0,0|0,0,2]=4 1546 B5R1.1 C1CC=CC1 TS70869 [1,0,0,1,0,0|0,0,2]=4 1547 B5R1.1 C1CCCC1 TS79215 [1,0,0,1,0,0|0,0,0]=2 1548 B5R1.1 C1CCCC1 TS83096 [1,0,0,1,0,0|0,0,0]=2 1549 B5R1.1 C1CCNC1 TS59825 [1,0,0,1,0,0|0,0,0]=2 1550 B5R1.1 C1CCOC1 TS24765 [1,0,0,1,0,0|1,0,0]=3 1551 B5R1.1 C1CCOC1 TS39373 [1,0,0,1,0,0|1,0,0]=3 1552 B5R1.1 C1CCOC1 TS44432 [1,0,0,1,0,0|1,0,0]=3 1553 B5R1.1 C1CCOC1 TS48211 [1,0,0,1,0,0|1,0,0]=3 1554 B5R1.1 C1CCOC1 TS60631 [1,0,0,1,0,0|1,0,0]=3 1555 B5R1.1 C1CCOC1 TS63866 [1,0,0,1,0,0|1,0,0]=3 1556 B5R1.1 C1CCOC1 TS71600 [1,0,0,1,0,0|1,0,0]=3 1557 B5R1.1 C1CCOC1 TS80255 [1,0,0,1,0,0|1,0,0]=3 1558 B5R1.1 C1CCSC1 TS71810 [1,0,0,1,0,0|1,0,0]=3 1559 B5R1.1 C1CNN=C1 TS03359 [1,0,0,1,0,0|1,0,1]=4 1560 B5R1.1 C1COCO1 TS03392 [1,0,0,1,0,0|2,0,0]=4 1561 B5R1.2 C1C(CN1)N TS88575 [1,0,0,1,0,0|1,0,0]=3 1562 B5R1.2 C1C(CN1)N TS92985 [1,0,0,1,0,0|1,0,0]=3 1563 B5R1.2 C1C(CN1)O TS00225 [1,0,0,1,0,0|2,0,0]=4 1564 B5R1.2 C1C(CN1)O TS65705 [1,0,0,1,0,0|2,0,0]=4 1565 B5R1.2 C1C(CN1)S TS87598 [1,0,0,1,0,0|2,0,0]=4 1566 B5R1.2 C1C(CO1)Br TS65955 [1,0,0,1,0,0|2,0,0]=4 1567 B5R1.2 C1C(CO1)Cl TS91374 [1,0,0,1,0,0|2,0,0]=4 1568 B5R1.2 C1C(CO1)I TS70631 [1,0,0,1,0,0|2,0,0]=4 1569 B5R1.2 C1C(CO1)N TS90822 [1,0,0,1,0,0|1,0,0]=3 1570 B5R1.2 C1C(CO1)O TS02791 [1,0,0,1,0,0|2,0,0]=4 1571 B5R1.2 C1C(CO1)S TS90997 [1,0,0,1,0,0|2,0,0]=4 1572 B5R1.2 C1C(CS1)N TS85859 [1,0,0,1,0,0|1,0,0]=3 1573 B5R1.2 C1CC(=O)C1 TS01399 [1,0,0,1,0,0|1,0,1]=4 1574 B5R1.2 C1CC(C1)Br TS36910 [1,0,0,1,0,0|1,0,0]=3 1575 B5R1.2 C1CC(C1)Cl TS03632 [1,0,0,1,0,0|1,0,0]=3 1576 B5R1.2 C1CC(C1)N TS03375 [1,0,0,1,0,0|0,0,0]=2 1577 B5R1.2 C1CC(C1)N TS04122 [1,0,0,1,0,0|0,0,0]=2 1578 B5R1.2 C1CC(C1)O TS59758 [1,0,0,1,0,0|1,0,0]=3 1579 B5R1.2 C1CNC1=O TS55052 [1,0,0,1,0,0|1,0,1]=4 1580 B5R1.2 CC1CCN1 TS71588 [1,0,0,1,0,0|0,0,0]=2 1581 B5R1.3 C#CC1CC1 TS02742 [1,0,0,1,0,0|0,0,2]=4 1582 B5R1.3 C1C(O1)CBr TS06154 [1,0,0,1,0,0|2,0,0]=4 1583 B5R1.3 C1C(O1)CCl TS08941 [1,0,0,1,0,0|2,0,0]=4 1584 B5R1.3 C1C(O1)CCl TS94501 [1,0,0,1,0,0|2,0,0]=4 1585 B5R1.3 C1C(O1)CCl TS94502 [1,0,0,1,0,0|2,0,0]=4 1586 B5R1.3 C1C(O1)CF TS71640 [1,0,0,1,0,0|2,0,0]=4 1587 B5R1.3 C1C(O1)CO TS03389 [1,0,0,1,0,0|2,0,0]=4 1588 B5R1.3 C1CC1C#N TS16796 [1,0,0,1,0,0|0,0,2]=4 1589 B5R1.3 C1CC1C=O TS55830 [1,0,0,1,0,0|1,0,1]=4 1590 B5R1.3 C1CC1CBr TS46573 [1,0,0,1,0,0|1,0,0]=3 1591 B5R1.3 C1CC1CCl TS46576 [1,0,0,1,0,0|1,0,0]=3 1592 B5R1.3 C1CC1CN TS03376 [1,0,0,1,0,0|0,0,0]=2 1593 B5R1.3 C1CC1CN TS04123 [1,0,0,1,0,0|0,0,0]=2 1594 B5R1.3 C1CC1CO TS34565 [1,0,0,1,0,0|1,0,0]=3 1595 B5R1.3 C1CC1ON TS94064 [1,0,0,1,0,0|1,0,0]=3 1596 B5R1.3 C1CC1[Mg]Br TS59761 [1,0,0,1,0,0|2,0,0]=4 1597 B5R1.3 C1[C@@H](O1)CCl TS00305 [1,0,0,1,0,0|2,0,0]=4 1598 B5R1.3 C1[C@@H](O1)CO TS00321 [1,0,0,1,0,0|2,0,0]=4 1599 B5R1.3 C1[C@H](O1)CCl TS46636 [1,0,0,1,0,0|2,0,0]=4 1600 B5R1.3 C1[C@H](O1)CO TS01969 [1,0,0,1,0,0|2,0,0]=4 1601 B5R1.3 C=CC1CC1 TS02996 [1,0,0,1,0,0|0,0,2]=4 1602 B5R1.3 CCC1CC1 TS03362 [1,0,0,1,0,0|0,0,0]=2 1603 B5R1.3 CCC1CO1 TS71603 [1,0,0,1,0,0|1,0,0]=3 1604 B5R1.3 CC[C@@H]1CO1 TS71607 [1,0,0,1,0,0|1,0,0]=3 1605 B5R1.3 CC[C@H]1CO1 TS71606 [1,0,0,1,0,0|1,0,0]=3 1606 B5R1.3 CNC1CC1 TS87062 [1,0,0,1,0,0|1,0,0]=3 1607 B5R1.3 [C-]#[N+]C1CC1 TS02923 [1,0,0,1,0,0|1,0,1]=4 1608 B5R1.4 CC1C(O1)C TS71602 [1,0,0,1,0,0|1,0,0]=3 1609 B5R1.4 C[C@@H]1C[C@@H]1C TS03365 [1,0,0,1,0,0|0,0,0]=2 1610 B5R1.4 C[C@@H]1C[C@H]1C TS03366 [1,0,0,1,0,0|0,0,0]=2 1611 B5R1.4 C[C@@H]1[C@@H](O1)C TS71599 [1,0,0,1,0,0|1,0,0]=3 1612 B5R1.4 C[C@H]1[C@@H](O1)C TS71605 [1,0,0,1,0,0|1,0,0]=3 1613 B7R1.1 C#CC1CCCC1 TS03680 [0,1,0,1,0,0|1,0,0]=3 1614 B7R1.1 C#CC1CCCC1 TS43724 [0,1,0,1,0,0|1,0,0]=3 1615 B7R1.1 C#CC1CCOC1 TS90205 [0,1,0,1,0,0|1,0,1]=4 1616 B7R1.1 C1C(OCO1)CO TS31671 [0,1,0,1,0,0|2,0,0]=4 1617 B7R1.1 C1C=CCC1CI TS43382 [0,1,0,1,0,0|1,0,1]=4 1618 B7R1.1 C1C=CCC1CO TS03780 [0,1,0,1,0,0|1,0,1]=4 1619 B7R1.1 C1CC(=NO)NC1 TS03851 [0,1,0,1,0,0|1,0,1]=4 1620 B7R1.1 C1CC(NC1)C#N TS31381 [0,1,0,1,0,0|0,0,1]=3 1621 B7R1.1 C1CC(NC1)CN TS08246 [0,1,0,1,0,0|0,0,0]=2 1622 B7R1.1 C1CC(OC1)C=O TS16819 [0,1,0,1,0,0|1,0,1]=4 1623 B7R1.1 C1CC(OC1)CBr TS42845 [0,1,0,1,0,0|1,0,0]=3 1624 B7R1.1 C1CC(OC1)CCl TS32449 [0,1,0,1,0,0|1,0,0]=3 1625 B7R1.1 C1CC(OC1)CN TS39685 [0,1,0,1,0,0|0,0,0]=2 1626 B7R1.1 C1CC(OC1)CO TS59435 [0,1,0,1,0,0|1,0,0]=3 1627 B7R1.1 C1CC=C(C1)CBr TS90531 [0,1,0,1,0,0|1,0,1]=4 1628 B7R1.1 C1CCC(C1)C#N TS03699 [0,1,0,1,0,0|0,0,1]=3 1629 B7R1.1 C1CCC(C1)C=O TS55823 [0,1,0,1,0,0|1,0,0]=3 1630 B7R1.1 C1CCC(C1)CBr TS16535 [0,1,0,1,0,0|1,0,0]=3 1631 B7R1.1 C1CCC(C1)CO TS31527 [0,1,0,1,0,0|1,0,0]=3 1632 B7R1.1 C1CCC(C1)CO TS44787 [0,1,0,1,0,0|1,0,0]=3 1633 B7R1.1 C1CCC(C1)NN TS55828 [0,1,0,1,0,0|0,0,0]=2 1634 B7R1.1 C1CCC(C1)[Mg]Br TS45683 [0,1,0,1,0,0|1,0,0]=3 1635 B7R1.1 C1CCN(C1)C#N TS31374 [0,1,0,1,0,0|0,0,2]=4 1636 B7R1.1 C1CCN(C1)C=O TS03825 [0,1,0,1,0,0|1,0,1]=4 1637 B7R1.1 C1CCN(C1)CI TS43938 [0,1,0,1,0,0|1,0,0]=3 1638 B7R1.1 C1CCN(C1)N=O TS03853 [0,1,0,1,0,0|1,0,1]=4 1639 B7R1.1 C1CN=C(N1)CCl TS08710 [0,1,0,1,0,0|1,0,1]=4 1640 B7R1.1 C1CNCC1C#N TS22733 [0,1,0,1,0,0|0,0,2]=4 1641 B7R1.1 C1CNCC1C#N TS86150 [0,1,0,1,0,0|0,0,2]=4 1642 B7R1.1 C1CNCC1CO TS01674 [0,1,0,1,0,0|1,0,0]=3 1643 B7R1.1 C1CNCC1CO TS90843 [0,1,0,1,0,0|1,0,0]=3 1644 B7R1.1 C1CNC[C@@H]1C#N TS89338 [0,1,0,1,0,0|0,0,2]=4 1645 B7R1.1 C1CNC[C@@H]1CO TS86165 [0,1,0,1,0,0|1,0,0]=3 1646 B7R1.1 C1CNC[C@@H]1CO TS87755 [0,1,0,1,0,0|1,0,0]=3 1647 B7R1.1 C1CNC[C@H]1C#N TS85734 [0,1,0,1,0,0|0,0,2]=4 1648 B7R1.1 C1CNC[C@H]1CO TS90835 [0,1,0,1,0,0|1,0,0]=3 1649 B7R1.1 C1CNC[C@H]1CO TS91204 [0,1,0,1,0,0|1,0,0]=3 1650 B7R1.1 C1COC(O1)CBr TS12331 [0,1,0,1,0,0|2,0,0]=4 1651 B7R1.1 C1COC(O1)CCl TS04942 [0,1,0,1,0,0|2,0,0]=4 1652 B7R1.1 C1COCC1C#N TS31394 [0,1,0,1,0,0|0,0,2]=4 1653 B7R1.1 C1COCC1C=O TS85084 [0,1,0,1,0,0|1,0,1]=4 1654 B7R1.1 C1COCC1CBr TS42850 [0,1,0,1,0,0|1,0,0]=3 1655 B7R1.1 C1COCC1CCl TS32453 [0,1,0,1,0,0|1,0,0]=3 1656 B7R1.1 C1COCC1CI TS21229 [0,1,0,1,0,0|1,0,0]=3 1657 B7R1.1 C1COCC1CN TS37140 [0,1,0,1,0,0|0,0,0]=2 1658 B7R1.1 C1COCC1CO TS90635 [0,1,0,1,0,0|1,0,0]=3 1659 B7R1.1 C1COCC1NN TS13628 [0,1,0,1,0,0|1,0,0]=3 1660 B7R1.1 C1COC[C@@H]1C#N TS87940 [0,1,0,1,0,0|0,0,2]=4 1661 B7R1.1 C1COC[C@@H]1CN TS86866 [0,1,0,1,0,0|0,0,0]=2 1662 B7R1.1 C1COC[C@@H]1CO TS90533 [0,1,0,1,0,0|1,0,0]=3 1663 B7R1.1 C1COC[C@H]1C#N TS85881 [0,1,0,1,0,0|0,0,2]=4 1664 B7R1.1 C1COC[C@H]1CN TS87555 [0,1,0,1,0,0|0,0,0]=2 1665 B7R1.1 C1COC[C@H]1CO TS91740 [0,1,0,1,0,0|1,0,0]=3 1666 B7R1.1 C1C[C@@H](NC1)C#N TS36734 [0,1,0,1,0,0|0,0,1]=3 1667 B7R1.1 C1C[C@@H](NC1)C#N TS90491 [0,1,0,1,0,0|0,0,1]=3 1668 B7R1.1 C1C[C@@H](NC1)CO TS55885 [0,1,0,1,0,0|0,0,0]=2 1669 B7R1.1 C1C[C@@H](OC1)CN TS08645 [0,1,0,1,0,0|0,0,0]=2 1670 B7R1.1 C1C[C@H](NC1)C#N TS46676 [0,1,0,1,0,0|0,0,1]=3 1671 B7R1.1 C1C[C@H](NC1)C#N TS90329 [0,1,0,1,0,0|0,0,1]=3 1672 B7R1.1 C1C[C@H](NC1)CF TS37317 [0,1,0,1,0,0|0,0,0]=2 1673 B7R1.1 C1C[C@H](NC1)CF TS86985 [0,1,0,1,0,0|0,0,0]=2 1674 B7R1.1 C1C[C@H](NC1)CN TS03869 [0,1,0,1,0,0|0,0,0]=2 1675 B7R1.1 C1C[C@H](NC1)CN TS86369 [0,1,0,1,0,0|0,0,0]=2 1676 B7R1.1 C1C[C@H](NC1)CO TS46675 [0,1,0,1,0,0|0,0,0]=2 1677 B7R1.1 C1C[C@H](NC1)CO TS90617 [0,1,0,1,0,0|0,0,0]=2 1678 B7R1.1 C1C[C@H](OC1)CN TS07684 [0,1,0,1,0,0|0,0,0]=2 1679 B7R1.1 C1C[C@H](OC1)CO TS03948 [0,1,0,1,0,0|1,0,0]=3 1680 B7R1.1 C1[C@H](NCS1)C#N TS09979 [0,1,0,1,0,0|1,0,1]=4 1681 B7R1.1 C=CC1CCCC1 TS44110 [0,1,0,1,0,0|1,0,0]=3 1682 B7R1.1 CC=C1CCCC1 TS03729 [0,1,0,1,0,0|1,0,1]=4 1683 B7R1.1 CCC1=CCCC1 TS03731 [0,1,0,1,0,0|1,0,0]=3 1684 B7R1.1 CCC1=NCCO1 TS03816 [0,1,0,1,0,0|0,0,2]=4 1685 B7R1.1 CCC1CCC=C1 TS03720 [0,1,0,1,0,0|1,0,0]=3 1686 B7R1.1 CCC1CCCC1 TS21020 [0,1,0,1,0,0|1,0,0]=3 1687 B7R1.1 CCC1CCCC1 TS21612 [0,1,0,1,0,0|1,0,0]=3 1688 B7R1.1 CCC1CCCC1 TS35071 [0,1,0,1,0,0|1,0,0]=3 1689 B7R1.1 CCC1CCCC1 TS57108 [0,1,0,1,0,0|1,0,0]=3 1690 B7R1.1 CCC1CCCC1 TS57519 [0,1,0,1,0,0|1,0,0]=3 1691 B7R1.1 CCC1CCCC1 TS62096 [0,1,0,1,0,0|1,0,0]=3 1692 B7R1.1 CCC1CCCC1 TS70230 [0,1,0,1,0,0|1,0,0]=3 1693 B7R1.1 CCC1CCCC1 TS70344 [0,1,0,1,0,0|1,0,0]=3 1694 B7R1.1 CCC1CCCC1 TS75798 [0,1,0,1,0,0|1,0,0]=3 1695 B7R1.1 CCC1CCCC1 TS78923 [0,1,0,1,0,0|1,0,0]=3 1696 B7R1.1 CCC1CCCC1 TS80049 [0,1,0,1,0,0|1,0,0]=3 1697 B7R1.1 CCC1OCCO1 TS03937 [0,1,0,1,0,0|1,0,0]=3 1698 B7R1.1 CCN1CCCC1 TS03828 [0,1,0,1,0,0|1,0,0]=3 1699 B7R1.1 CNC1CCNC1 TS03875 [0,1,0,1,0,0|1,0,0]=3 1700 B7R1.1 CNC1CCOC1 TS87367 [0,1,0,1,0,0|1,0,0]=3 1701 B7R1.1 CN[C@@H]1CCNC1 TS03876 [0,1,0,1,0,0|1,0,0]=3 1702 B7R1.1 CN[C@@H]1CCOC1 TS90607 [0,1,0,1,0,0|1,0,0]=3 1703 B7R1.1 CN[C@H]1CCOC1 TS85956 [0,1,0,1,0,0|1,0,0]=3 1704 B7R1.1 COC1=NCCC1 TS03819 [0,1,0,1,0,0|0,0,2]=4 1705 B7R1.1 COC1=NCCN1 TS02909 [0,1,0,1,0,0|1,0,1]=4 1706 B7R1.1 COC1CCCC1 TS03863 [0,1,0,1,0,0|1,0,0]=3 1707 B7R1.1 COC1CCNC1 TS02829 [0,1,0,1,0,0|1,0,0]=3 1708 B7R1.1 COC1CCNC1 TS90836 [0,1,0,1,0,0|1,0,0]=3 1709 B7R1.1 COC1OCCO1 TS31667 [0,1,0,1,0,0|2,0,0]=4 1710 B7R1.1 CO[C@@H]1CCNC1 TS88166 [0,1,0,1,0,0|1,0,0]=3 1711 B7R1.1 CO[C@@H]1CCNC1 TS89625 [0,1,0,1,0,0|1,0,0]=3 1712 B7R1.1 CO[C@H]1CCNC1 TS85697 [0,1,0,1,0,0|1,0,0]=3 1713 B7R1.1 CSC1=NCCN1 TS04613 [0,1,0,1,0,0|1,0,1]=4 1714 B7R1.1 CSC1=NCCN1 TS61969 [0,1,0,1,0,0|1,0,1]=4 1715 B7R1.1 CSC1CCCC1 TS04638 [0,1,0,1,0,0|1,0,0]=3 1716 B7R1.1 [C-]#[N+]C1CCCC1 TS03697 [0,1,0,1,0,0|0,0,1]=3 1717 B7R1.2 C1C(CNC1=O)N TS87465 [0,1,0,1,0,0|1,0,1]=4 1718 B7R1.2 C1CC(CC1N)N TS03878 [0,1,0,1,0,0|0,0,0]=2 1719 B7R1.2 C1CC(CC1N)O TS86416 [0,1,0,1,0,0|0,0,0]=2 1720 B7R1.2 C1C[C@@H](C[C@@H]1N)O TS85957 [0,1,0,1,0,0|0,0,0]=2 1721 B7R1.2 C1C[C@@H](C[C@H]1N)O TS87237 [0,1,0,1,0,0|0,0,0]=2 1722 B7R1.2 C1[C@@H](CNC1=O)O TS00313 [0,1,0,1,0,0|1,0,1]=4 1723 B7R1.2 C1[C@@H](CNC1=O)S TS04685 [0,1,0,1,0,0|1,0,1]=4 1724 B7R1.2 C1[C@@H](COC1=O)N TS37130 [0,1,0,1,0,0|1,0,1]=4 1725 B7R1.2 C1[C@H](CNC1=O)O TS01973 [0,1,0,1,0,0|1,0,1]=4 1726 B7R1.2 C1[C@H](CNC1=O)S TS04686 [0,1,0,1,0,0|1,0,1]=4 1727 B7R1.2 CC1CCC(N1)C TS94712 [0,1,0,1,0,0|0,0,0]=2 1728 B7R1.2 CC1CCC(O1)C TS47281 [0,1,0,1,0,0|1,0,0]=3 1729 B7R1.2 CC1CNC(=S)N1 TS04617 [0,1,0,1,0,0|1,0,1]=4 1730 B7R1.2 CC1COC(O1)C TS03942 [0,1,0,1,0,0|2,0,0]=4 1731 B7R1.2 CN1CCC(C1)N TS03871 [0,1,0,1,0,0|1,0,0]=3 1732 B7R1.2 CN1CCC(C1)O TS31556 [0,1,0,1,0,0|2,0,0]=4 1733 B7R1.2 CN1CC[C@@H](C1)N TS86663 [0,1,0,1,0,0|1,0,0]=3 1734 B7R1.2 CN1CC[C@@H](C1)O TS03901 [0,1,0,1,0,0|2,0,0]=4 1735 B7R1.2 CN1CC[C@H](C1)O TS03903 [0,1,0,1,0,0|2,0,0]=4 1736 B7R1.2 C[C@@H]1CCC(=O)O1 TS31495 [0,1,0,1,0,0|1,0,1]=4 1737 B7R1.2 C[C@@H]1CC[C@@H](C1)C TS03800 [0,1,0,1,0,0|1,0,0]=3 1738 B7R1.2 C[C@@H]1COC(=O)N1 TS31548 [0,1,0,1,0,0|1,0,1]=4 1739 B7R1.2 C[C@H]1CC[C@@H](C1)C TS31449 [0,1,0,1,0,0|1,0,0]=3 1740 B7R1.2 C[C@H]1COC(=O)N1 TS31534 [0,1,0,1,0,0|1,0,1]=4 1741 B7R1.3 B=[O+2]1CCSCC1 TS32312 [0,1,0,1,0,0|2,0,0]=4 1742 B7R1.3 C1C(COCO1)O TS31668 [0,1,0,1,0,0|2,0,0]=4 1743 B7R1.3 C1CC(=O)CNC1 TS02886 [0,1,0,1,0,0|0,0,1]=3 1744 B7R1.3 C1CC(=O)CNC1 TS59353 [0,1,0,1,0,0|0,0,1]=3 1745 B7R1.3 C1CC(=O)COC1 TS22954 [0,1,0,1,0,0|1,0,1]=4 1746 B7R1.3 C1CC(=O)COC1 TS89862 [0,1,0,1,0,0|1,0,1]=4 1747 B7R1.3 C1CC(=O)CSC1 TS90226 [0,1,0,1,0,0|1,0,1]=4 1748 B7R1.3 C1CC(CC=C1)Br TS11358 [0,1,0,1,0,0|1,0,1]=4 1749 B7R1.3 C1CC(CC=C1)Cl TS04655 [0,1,0,1,0,0|1,0,1]=4 1750 B7R1.3 C1CC(CC=C1)O TS31422 [0,1,0,1,0,0|1,0,1]=4 1751 B7R1.3 C1CC(CNC1)Br TS09491 [0,1,0,1,0,0|0,0,0]=2 1752 B7R1.3 C1CC(CNC1)Br TS42661 [0,1,0,1,0,0|0,0,0]=2 1753 B7R1.3 C1CC(CNC1)Cl TS41570 [0,1,0,1,0,0|0,0,0]=2 1754 B7R1.3 C1CC(CNC1)F TS37316 [0,1,0,1,0,0|0,0,0]=2 1755 B7R1.3 C1CC(CNC1)N TS02666 [0,1,0,1,0,0|0,0,0]=2 1756 B7R1.3 C1CC(CNC1)O TS02796 [0,1,0,1,0,0|0,0,0]=2 1757 B7R1.3 C1CC(CNC1)O TS16254 [0,1,0,1,0,0|0,0,0]=2 1758 B7R1.3 C1CC(CNC1)O TS28091 [0,1,0,1,0,0|0,0,0]=2 1759 B7R1.3 C1CC(CNC1)S TS91720 [0,1,0,1,0,0|0,0,0]=2 1760 B7R1.3 C1CC(COC1)Br TS42847 [0,1,0,1,0,0|1,0,0]=3 1761 B7R1.3 C1CC(COC1)I TS44102 [0,1,0,1,0,0|1,0,0]=3 1762 B7R1.3 C1CC(COC1)N TS39962 [0,1,0,1,0,0|0,0,0]=2 1763 B7R1.3 C1CC(COC1)N TS90719 [0,1,0,1,0,0|0,0,0]=2 1764 B7R1.3 C1CC(COC1)O TS59831 [0,1,0,1,0,0|1,0,0]=3 1765 B7R1.3 C1CC=CC(C1)Br TS11359 [0,1,0,1,0,0|1,0,1]=4 1766 B7R1.3 C1CC=CC(C1)Cl TS04653 [0,1,0,1,0,0|1,0,1]=4 1767 B7R1.3 C1CC=CC(C1)O TS59964 [0,1,0,1,0,0|1,0,1]=4 1768 B7R1.3 C1CCC(=CC1)Cl TS04654 [0,1,0,1,0,0|1,0,1]=4 1769 B7R1.3 C1CCC(=O)CC1 TS31441 [0,1,0,1,0,0|1,0,0]=3 1770 B7R1.3 C1CCC(CC1)Br TS33231 [0,1,0,1,0,0|1,0,0]=3 1771 B7R1.3 C1CCC(CC1)Cl TS39830 [0,1,0,1,0,0|1,0,0]=3 1772 B7R1.3 C1CCC(CC1)F TS31606 [0,1,0,1,0,0|1,0,0]=3 1773 B7R1.3 C1CCC(CC1)I TS43723 [0,1,0,1,0,0|1,0,0]=3 1774 B7R1.3 C1CCC(CC1)N TS03833 [0,1,0,1,0,0|0,0,0]=2 1775 B7R1.3 C1CCC(CC1)N TS06026 [0,1,0,1,0,0|0,0,0]=2 1776 B7R1.3 C1CCC(CC1)N TS14508 [0,1,0,1,0,0|0,0,0]=2 1777 B7R1.3 C1CCC(CC1)N TS18426 [0,1,0,1,0,0|0,0,0]=2 1778 B7R1.3 C1CCC(CC1)O TS31506 [0,1,0,1,0,0|1,0,0]=3 1779 B7R1.3 C1CCC(CC1)P TS04576 [0,1,0,1,0,0|0,1,0]=3 1780 B7R1.3 C1CCC(CC1)[NH3+] TS60878 [0,1,0,1,0,0|0,0,1]=3 1781 B7R1.3 C1CCC(CC1)[Zn+] TS24609 [0,1,0,1,0,0|1,0,0]=3 1782 B7R1.3 C1CCN(CC1)N TS03873 [0,1,0,1,0,0|0,0,0]=2 1783 B7R1.3 C1CCN(CC1)N TS06144 [0,1,0,1,0,0|0,0,0]=2 1784 B7R1.3 C1CCN(CC1)O TS31559 [0,1,0,1,0,0|0,0,0]=2 1785 B7R1.3 C1CCNC(=N)C1 TS05957 [0,1,0,1,0,0|0,0,1]=3 1786 B7R1.3 C1CCNC(=O)C1 TS01420 [0,1,0,1,0,0|0,0,1]=3 1787 B7R1.3 C1CCNC(C1)Br TS42662 [0,1,0,1,0,0|0,0,0]=2 1788 B7R1.3 C1CCNC(C1)Cl TS04802 [0,1,0,1,0,0|0,0,0]=2 1789 B7R1.3 C1CCNC(C1)N TS03877 [0,1,0,1,0,0|0,0,0]=2 1790 B7R1.3 C1CCNC(C1)O TS03900 [0,1,0,1,0,0|0,0,0]=2 1791 B7R1.3 C1CCOC(=O)C1 TS01892 [0,1,0,1,0,0|1,0,1]=4 1792 B7R1.3 C1CCOC(C1)O TS31590 [0,1,0,1,0,0|1,0,0]=3 1793 B7R1.3 C1CN(CCN1)N TS03908 [0,1,0,1,0,0|1,0,0]=3 1794 B7R1.3 C1CNC(=NC1)S TS04615 [0,1,0,1,0,0|1,0,1]=4 1795 B7R1.3 C1CNC(=O)CN1 TS59349 [0,1,0,1,0,0|1,0,1]=4 1796 B7R1.3 C1CNC(=O)NC1 TS59429 [0,1,0,1,0,0|1,0,1]=4 1797 B7R1.3 C1CNCCC1=O TS02248 [0,1,0,1,0,0|0,0,1]=3 1798 B7R1.3 C1CNCCC1=O TS71284 [0,1,0,1,0,0|0,0,1]=3 1799 B7R1.3 C1CNCCC1Br TS71009 [0,1,0,1,0,0|0,0,0]=2 1800 B7R1.3 C1CNCCC1Cl TS09688 [0,1,0,1,0,0|0,0,0]=2 1801 B7R1.3 C1CNCCC1F TS03995 [0,1,0,1,0,0|0,0,0]=2 1802 B7R1.3 C1CNCCC1F TS09127 [0,1,0,1,0,0|0,0,0]=2 1803 B7R1.3 C1CNCCC1N TS08873 [0,1,0,1,0,0|0,0,0]=2 1804 B7R1.3 C1CNCCC1N TS70915 [0,1,0,1,0,0|0,0,0]=2 1805 B7R1.3 C1CNCCC1O TS37141 [0,1,0,1,0,0|0,0,0]=2 1806 B7R1.3 C1CNCCC1O TS71282 [0,1,0,1,0,0|0,0,0]=2 1807 B7R1.3 C1CNCCC1S TS89665 [0,1,0,1,0,0|0,0,0]=2 1808 B7R1.3 C1COCC(=O)N1 TS01573 [0,1,0,1,0,0|1,0,1]=4 1809 B7R1.3 C1COCCC1=O TS59431 [0,1,0,1,0,0|1,0,1]=4 1810 B7R1.3 C1COCCC1Br TS09616 [0,1,0,1,0,0|1,0,0]=3 1811 B7R1.3 C1COCCC1Cl TS32447 [0,1,0,1,0,0|1,0,0]=3 1812 B7R1.3 C1COCCC1I TS09723 [0,1,0,1,0,0|1,0,0]=3 1813 B7R1.3 C1COCCC1N TS11397 [0,1,0,1,0,0|0,0,0]=2 1814 B7R1.3 C1COCCC1N TS70925 [0,1,0,1,0,0|0,0,0]=2 1815 B7R1.3 C1COCCC1N TS70926 [0,1,0,1,0,0|0,0,0]=2 1816 B7R1.3 C1COCCC1O TS59433 [0,1,0,1,0,0|1,0,0]=3 1817 B7R1.3 C1COCCC1O TS85905 [0,1,0,1,0,0|1,0,0]=3 1818 B7R1.3 C1COCCN1N TS31603 [0,1,0,1,0,0|1,0,0]=3 1819 B7R1.3 C1COCCN1N TS37255 [0,1,0,1,0,0|1,0,0]=3 1820 B7R1.3 C1CSCCC1=O TS59432 [0,1,0,1,0,0|1,0,1]=4 1821 B7R1.3 C1CSCCC1N TS59442 [0,1,0,1,0,0|0,0,0]=2 1822 B7R1.3 C1CSCCC1O TS59441 [0,1,0,1,0,0|1,0,0]=3 1823 B7R1.3 C1C[C@@H](CNC1)F TS89045 [0,1,0,1,0,0|0,0,0]=2 1824 B7R1.3 C1C[C@@H](CNC1)N TS03872 [0,1,0,1,0,0|0,0,0]=2 1825 B7R1.3 C1C[C@@H](CNC1)O TS46664 [0,1,0,1,0,0|0,0,0]=2 1826 B7R1.3 C1C[C@H](CNC1)F TS92720 [0,1,0,1,0,0|0,0,0]=2 1827 B7R1.3 C1C[C@H](CNC1)N TS93699 [0,1,0,1,0,0|0,0,0]=2 1828 B7R1.3 C1C[C@H](CNC1)O TS88232 [0,1,0,1,0,0|0,0,0]=2 1829 B7R1.3 C1C[C@H](CNC1)O TS89282 [0,1,0,1,0,0|0,0,0]=2 1830 B7R1.3 CC1CCCCC1 TS02317 [0,1,0,1,0,0|1,0,0]=3 1831 B7R1.3 CC1CCCCO1 TS31512 [0,1,0,1,0,0|1,0,0]=3 1832 B7R1.3 CC1CCCNC1 TS70672 [0,1,0,1,0,0|0,0,0]=2 1833 B7R1.3 CC1CCNCC1 TS03831 [0,1,0,1,0,0|0,0,0]=2 1834 B7R1.3 CC1CCOCO1 TS03947 [0,1,0,1,0,0|1,0,0]=3 1835 B7R1.3 CC1CNCCO1 TS02170 [0,1,0,1,0,0|1,0,0]=3 1836 B7R1.3 CC1SCCCS1 TS16705 [0,1,0,1,0,0|1,0,0]=3 1837 B7R1.3 CN1CCCCC1 TS03834 [0,1,0,1,0,0|0,0,0]=2 1838 B7R1.3 CN1CCNCC1 TS00495 [0,1,0,1,0,0|1,0,0]=3 1839 B7R1.3 CN1CCNCC1 TS45581 [0,1,0,1,0,0|1,0,0]=3 1840 B7R1.3 CN1CCOCC1 TS37142 [0,1,0,1,0,0|1,0,0]=3 1841 B7R1.3 CN1CCOCC1 TS39917 [0,1,0,1,0,0|1,0,0]=3 1842 B7R1.3 C[C@@H]1CCCCN1 TS03835 [0,1,0,1,0,0|0,0,0]=2 1843 B7R1.3 C[C@@H]1CNCCN1 TS08073 [0,1,0,1,0,0|0,0,0]=2 1844 B7R1.3 C[C@@H]1CNCCO1 TS03899 [0,1,0,1,0,0|1,0,0]=3 1845 B7R1.3 C[C@@H]1CNCCO1 TS08072 [0,1,0,1,0,0|1,0,0]=3 1846 B7R1.3 C[C@@H]1COCCN1 TS01972 [0,1,0,1,0,0|0,0,0]=2 1847 B7R1.3 C[C@H]1CNCCN1 TS06145 [0,1,0,1,0,0|0,0,0]=2 1848 B7R1.3 C[C@H]1CNCCN1 TS22969 [0,1,0,1,0,0|0,0,0]=2 1849 B7R1.3 C[C@H]1CNCCN1 TS45580 [0,1,0,1,0,0|0,0,0]=2 1850 B7R1.3 C[C@H]1CNCCO1 TS89643 [0,1,0,1,0,0|1,0,0]=3 1851 B7R1.3 C[C@H]1COCCN1 TS46666 [0,1,0,1,0,0|0,0,0]=2 1852 B7R1.4 C1CC(C(=O)C1)Br TS55161 [0,1,0,1,0,0|1,0,1]=4 1853 B7R1.4 C1CC(C(=O)C1)Cl TS04768 [0,1,0,1,0,0|1,0,1]=4 1854 B7R1.4 C1CC(C(C1)Cl)Cl TS06337 [0,1,0,1,0,0|1,0,0]=3 1855 B7R1.4 C1CC(C(C1)O)N TS03905 [0,1,0,1,0,0|0,0,0]=2 1856 B7R1.4 C1CNC(=O)C1N TS94857 [0,1,0,1,0,0|1,0,1]=4 1857 B7R1.4 C1CNC(=O)C1O TS02803 [0,1,0,1,0,0|1,0,1]=4 1858 B7R1.4 C1CNC(=O)[C@H]1O TS31546 [0,1,0,1,0,0|1,0,1]=4 1859 B7R1.4 C1COC(=O)[C@@H]1N TS06210 [0,1,0,1,0,0|1,0,1]=4 1860 B7R1.4 C1COC(=O)[C@H]1N TS37131 [0,1,0,1,0,0|1,0,1]=4 1861 B7R1.4 C1COC(C1Br)Br TS52914 [0,1,0,1,0,0|2,0,0]=4 1862 B7R1.4 C1COC(C1Cl)Cl TS37466 [0,1,0,1,0,0|2,0,0]=4 1863 B7R1.4 C1CSC(=O)C1N TS41321 [0,1,0,1,0,0|1,0,1]=4 1864 B7R1.4 C1CSC(=O)[C@H]1N TS41320 [0,1,0,1,0,0|1,0,1]=4 1865 B7R1.4 C1C[C@@H]([C@H](C1)O)N TS59451 [0,1,0,1,0,0|0,0,0]=2 1866 B7R1.4 C1C[C@@H]([C@H](C1)O)O TS03951 [0,1,0,1,0,0|1,0,0]=3 1867 B7R1.4 C1C[C@H]([C@@H](C1)Cl)Cl TS06338 [0,1,0,1,0,0|1,0,0]=3 1868 B7R1.4 C1C[C@H]([C@@H](C1)O)N TS94575 [0,1,0,1,0,0|0,0,0]=2 1869 B7R1.4 C1C[C@H]([C@@H](C1)O)O TS03935 [0,1,0,1,0,0|1,0,0]=3 1870 B7R1.4 C1C[C@H]([C@H](C1)O)N TS55819 [0,1,0,1,0,0|0,0,0]=2 1871 B7R1.4 C1C[C@H]([C@H](C1)O)O TS03956 [0,1,0,1,0,0|1,0,0]=3 1872 B7R1.4 C1[C@@H]([C@H](CN1)F)F TS92386 [0,1,0,1,0,0|2,0,0]=4 1873 B7R1.4 C1[C@@H]([C@H](CN1)O)O TS87014 [0,1,0,1,0,0|2,0,0]=4 1874 B7R1.4 C1[C@@H]([C@H](CO1)N)N TS92585 [0,1,0,1,0,0|1,0,0]=3 1875 B7R1.4 C1[C@@H]([C@H](CO1)N)N TS92586 [0,1,0,1,0,0|1,0,0]=3 1876 B7R1.4 C1[C@@H]([C@H](CO1)O)O TS31674 [0,1,0,1,0,0|2,0,0]=4 1877 B7R1.4 C1[C@H]([C@@H](CN1)F)O TS92108 [0,1,0,1,0,0|2,0,0]=4 1878 B7R1.4 C1[C@H]([C@@H](CN1)O)O TS89590 [0,1,0,1,0,0|2,0,0]=4 1879 B7R1.4 C1[C@H]([C@@H](CO1)N)N TS87919 [0,1,0,1,0,0|1,0,0]=3 1880 B7R1.4 C1[C@H]([C@H](CN1)F)F TS92089 [0,1,0,1,0,0|2,0,0]=4 1881 B7R1.4 C1[C@H]([C@H](CN1)O)O TS91803 [0,1,0,1,0,0|2,0,0]=4 1882 B7R1.4 C1[C@H]([C@H](CO1)N)N TS87566 [0,1,0,1,0,0|1,0,0]=3 1883 B7R1.4 CC1=C(CCC1)C TS03727 [0,1,0,1,0,0|1,0,1]=4 1884 B7R1.4 CC1C(=O)CCO1 TS31501 [0,1,0,1,0,0|1,0,1]=4 1885 B7R1.4 CC1C(=O)CCS1 TS04612 [0,1,0,1,0,0|1,0,1]=4 1886 B7R1.4 CC1C(CCO1)S TS32361 [0,1,0,1,0,0|1,0,0]=3 1887 B7R1.4 CC1CCC=C1C TS31386 [0,1,0,1,0,0|1,0,1]=4 1888 B7R1.4 CC1CCNC1=O TS70662 [0,1,0,1,0,0|1,0,1]=4 1889 B7R1.4 CC1CCOC1=O TS59696 [0,1,0,1,0,0|1,0,1]=4 1890 B7R1.4 CN1CCCC1=O TS46986 [0,1,0,1,0,0|1,0,1]=4 1891 B7R1.4 C[C@@H]1CCC[C@@H]1C TS03788 [0,1,0,1,0,0|1,0,0]=3 1892 B7R1.4 C[C@@H]1CCC[C@H]1C TS03797 [0,1,0,1,0,0|1,0,0]=3 1893 B7R1.5 CC1C(O1)CC#N TS31392 [0,1,0,1,0,0|0,0,2]=4 1894 B7R1.6 C1C(CO1)CC=O TS86511 [0,1,0,1,0,0|1,0,1]=4 1895 B7R1.6 C1C(CO1)CCO TS86834 [0,1,0,1,0,0|1,0,0]=3 1896 B7R1.6 C1CC(C1)CCN TS88922 [0,1,0,1,0,0|0,0,0]=2 1897 B7R1.6 C1CN(C1)CCCl TS92407 [0,1,0,1,0,0|1,0,0]=3 1898 B7R1.6 CCNC1COC1 TS86473 [0,1,0,1,0,0|2,0,0]=4 1899 B7R1.6 CCOC1CNC1 TS37143 [0,1,0,1,0,0|1,0,0]=3 1900 B7R1.6 CNCC1COC1 TS92157 [0,1,0,1,0,0|1,0,0]=3 1901 B7R1.6 COCC1CCN1 TS92247 [0,1,0,1,0,0|0,0,0]=2 1902 B7R1.6 COCC1CNC1 TS37139 [0,1,0,1,0,0|1,0,0]=3 1903 B7R1.6 COC[C@@H]1CCN1 TS92216 [0,1,0,1,0,0|0,0,0]=2 1904 B7R1.6 COC[C@H]1CCN1 TS90071 [0,1,0,1,0,0|0,0,0]=2 1905 B7R1.8 C1CC(=O)C1CO TS92430 [0,1,0,1,0,0|1,0,1]=4 1906 B7R1.8 CN1CCC1CN TS92300 [0,1,0,1,0,0|0,0,0]=2 1907 B7R1.8 CN1CC[C@@H]1CN TS91985 [0,1,0,1,0,0|0,0,0]=2 1908 B7R1.8 CN1CC[C@H]1CN TS92777 [0,1,0,1,0,0|0,0,0]=2 1909 B7R1.10 C1C(CC1=O)CBr TS89769 [0,1,0,1,0,0|1,0,1]=4 1910 B7R1.10 C1C(CC1=O)CCl TS90066 [0,1,0,1,0,0|1,0,1]=4 1911 B7R1.10 C1C(CC1=O)CN TS88367 [0,1,0,1,0,0|0,0,1]=3 1912 B7R1.10 C1C(CC1=O)CO TS87456 [0,1,0,1,0,0|1,0,1]=4 1913 B7R1.10 C1C(CC1Cl)CO TS91726 [0,1,0,1,0,0|1,0,0]=3 1914 B7R1.10 C1C(CC1F)CN TS91869 [0,1,0,1,0,0|0,0,0]=2 1915 B7R1.10 C1C(CC1F)CN TS92167 [0,1,0,1,0,0|0,0,0]=2 1916 B7R1.10 C1C(CC1F)CN TS92721 [0,1,0,1,0,0|0,0,0]=2 1917 B7R1.10 C1C(CC1N)CO TS87423 [0,1,0,1,0,0|1,0,0]=3 1918 B7R1.10 C1C(CC1N)CO TS88341 [0,1,0,1,0,0|1,0,0]=3 1919 B7R1.10 C1C(CC1O)CN TS86399 [0,1,0,1,0,0|0,0,0]=2 1920 B7R1.10 C1[C@@H](C[C@@H]1CN)O TS89746 [0,1,0,1,0,0|0,0,0]=2 1921 B7R1.10 C1[C@@H](C[C@@H]1CN)O TS91914 [0,1,0,1,0,0|0,0,0]=2 1922 B7R1.10 C1[C@@H](C[C@@H]1CO)N TS87875 [0,1,0,1,0,0|1,0,0]=3 1923 B7R1.10 C1[C@@H](C[C@@H]1CO)N TS89745 [0,1,0,1,0,0|1,0,0]=3 1924 B7R1.10 C1[C@@H](C[C@H]1CN)O TS85823 [0,1,0,1,0,0|0,0,0]=2 1925 B7R1.10 C1[C@@H](C[C@H]1CN)O TS92762 [0,1,0,1,0,0|0,0,0]=2 1926 B7R1.10 C1[C@@H](C[C@H]1CO)N TS87600 [0,1,0,1,0,0|1,0,0]=3 1927 B7R1.10 C1[C@@H](C[C@H]1CO)N TS91749 [0,1,0,1,0,0|1,0,0]=3 1928 B7R1.10 CCN1CC(C1)N TS90570 [0,1,0,1,0,0|1,0,0]=3 1929 B7R1.10 CCN1CC(C1)O TS89760 [0,1,0,1,0,0|2,0,0]=4 1930 B7R1.10 CNC1CC(C1)O TS92151 [0,1,0,1,0,0|2,0,0]=4 1931 B7R1.10 CN[C@H]1C[C@@H](C1)O TS89410 [0,1,0,1,0,0|2,0,0]=4 1932 B7R1.10 CN[C@H]1C[C@H](C1)O TS91820 [0,1,0,1,0,0|2,0,0]=4 1933 B7R1.10 COC1CC(C1)N TS85808 [0,1,0,1,0,0|1,0,0]=3 1934 B7R1.10 CO[C@H]1C[C@@H](C1)N TS86883 [0,1,0,1,0,0|1,0,0]=3 1935 B7R1.10 CO[C@H]1C[C@@H](C1)N TS92050 [0,1,0,1,0,0|1,0,0]=3 1936 B7R1.10 CO[C@H]1C[C@H](C1)N TS87191 [0,1,0,1,0,0|1,0,0]=3 1937 B7R1.10 CO[C@H]1C[C@H](C1)N TS92401 [0,1,0,1,0,0|1,0,0]=3 1938 B7R1.21 CCCC1(CO1)C TS03866 [0,1,0,1,0,0|1,0,0]=3 1939 B7R1.21 CCOC1(CC1)Br TS42848 [0,1,0,1,0,0|2,0,0]=4 1940 B7R1.22 C1CC1C(=O)CBr TS55070 [0,1,0,1,0,0|1,0,1]=4 1941 B7R1.22 C1CC1C(=O)NN TS55829 [0,1,0,1,0,0|1,0,1]=4 1942 B7R1.22 CCC(C)C1CC1 TS03799 [0,1,0,1,0,0|1,0,0]=3 1943 B7R1.22 COC(=O)C1CN1 TS31541 [0,1,0,1,0,0|1,0,1]=4 1944 B7R1.22 COC(=O)[C@@H]1CN1 TS31535 [0,1,0,1,0,0|1,0,1]=4 1945 B7R1.22 COC(=O)[C@H]1CN1 TS31537 [0,1,0,1,0,0|1,0,1]=4 1946 B7R1.25 C1C(CN1)(CO)F TS86463 [0,1,0,1,0,0|2,0,0]=4 1947 B7R1.25 C1C(CO1)(CBr)F TS90174 [0,1,0,1,0,0|2,0,0]=4 1948 B7R1.25 C1C(CO1)(CI)F TS88760 [0,1,0,1,0,0|2,0,0]=4 1949 B7R1.25 C1C(CO1)(CN)F TS89061 [0,1,0,1,0,0|1,0,0]=3 1950 B7R1.25 C1C(CO1)(CN)O TS89803 [0,1,0,1,0,0|1,0,0]=3 1951 B7R1.25 C1C(CO1)(CO)F TS87143 [0,1,0,1,0,0|2,0,0]=4 1952 B7R1.25 C1C(CO1)(CO)N TS87221 [0,1,0,1,0,0|2,0,0]=4 1953 B7R1.25 C1CC(C1)(CO)N TS87105 [0,1,0,1,0,0|1,0,0]=3 1954 B7R1.25 CC1(CCC1)CN TS85798 [0,1,0,1,0,0|0,0,0]=2 1955 B7R1.25 CC1(CNC1)CN TS89603 [0,1,0,1,0,0|1,0,0]=3 1956 B7R1.25 CC1(COC1)CBr TS42849 [0,1,0,1,0,0|2,0,0]=4 1957 B7R1.25 CC1(COC1)CCl TS89884 [0,1,0,1,0,0|2,0,0]=4 1958 B7R1.25 CC1(COC1)CI TS91677 [0,1,0,1,0,0|2,0,0]=4 1959 B7R1.25 CC1(COC1)CN TS91181 [0,1,0,1,0,0|1,0,0]=3 1960 B7R1.25 CC1(COC1)CO TS70664 [0,1,0,1,0,0|2,0,0]=4 1961 B7R1.25 CC1(COC1)CS TS88281 [0,1,0,1,0,0|2,0,0]=4 1962 B7R1.25 CCC1(CNC1)N TS88165 [0,1,0,1,0,0|2,0,0]=4 1963 B7R1.25 CCC1(CNC1)O TS86360 [0,1,0,1,0,0|2,0,0]=4 1964 B7R1.25 CCC1(COC1)N TS87209 [0,1,0,1,0,0|2,0,0]=4 1965 B7R1.25 CCC1(COC1)N TS92547 [0,1,0,1,0,0|2,0,0]=4 1966 B7R1.7 C1CC1CN=C=S TS32024 [0,1,0,1,0,0|1,0,1]=4 1967 B7R1.7 C1CC1OCCCl TS46506 [0,1,0,1,0,0|1,0,0]=3 1968 B7R1.7 CCCCC1CO1 TS31525 [0,1,0,1,0,0|1,0,0]=3 1969 B7R1.7 CCCC[C@@H]1CO1 TS31508 [0,1,0,1,0,0|1,0,0]=3 1970 B7R1.7 CCOCC1CO1 TS03943 [0,1,0,1,0,0|1,0,0]=3 1971 B7R1.14 C1CCC(C1)(F)F TS04079 [0,1,0,1,0,0|1,0,0]=3 1972 B7R1.14 C1CCS(=O)(=O)C1 TS00274 [0,1,0,1,0,0|2,0,0]=4 1973 B7R1.14 C1CC[Si](C1)(Cl)Cl TS10548 [0,1,0,1,0,0|1,1,0]=4 1974 B7R1.14 C1CNCC1(F)F TS06901 [0,1,0,1,0,0|2,0,0]=4 1975 B7R1.14 C1CNS(=O)(=O)C1 TS89279 [0,1,0,1,0,0|2,0,0]=4 1976 B7R1.14 CC1(CCCC1)C TS31456 [0,1,0,1,0,0|1,0,0]=3 1977 B7R1.14 CC1(CCCN1)C TS89244 [0,1,0,1,0,0|0,0,0]=2 1978 B7R1.14 CC1(CCNC1)C TS86689 [0,1,0,1,0,0|2,0,0]=4 1979 B7R1.14 CC1(CCNC1)O TS87844 [0,1,0,1,0,0|2,0,0]=4 1980 B7R1.14 CC1(CCOC1)N TS86382 [0,1,0,1,0,0|1,0,0]=3 1981 B7R1.14 CC1(COCN1)C TS31558 [0,1,0,1,0,0|1,0,0]=3 1982 B7R1.14 CC1(NCCS1)C TS47123 [0,1,0,1,0,0|1,0,0]=3 1983 B7R1.14 CC1(OCCO1)C TS03946 [0,1,0,1,0,0|2,0,0]=4 1984 B7R1.14 C[N+]1(CCCC1)C TS52453 [0,1,0,1,0,0|2,0,0]=4 1985 B7R1.14 C[Si]1(CCCC1)C TS32125 [0,1,0,1,0,0|1,1,0]=4 1986 B7R1.18 C1C(CN1)C(=O)N TS86704 [0,1,0,1,0,0|1,0,1]=4 1987 B7R1.18 C1C(CN1)C(=O)N TS88630 [0,1,0,1,0,0|1,0,1]=4 1988 B7R1.18 C1CC(C1)C(=N)N TS88293 [0,1,0,1,0,0|0,0,1]=3 1989 B7R1.18 C1CC(C1)C(=O)Cl TS22945 [0,1,0,1,0,0|1,0,1]=4 1990 B7R1.18 C1CC(C1)C(=O)N TS03818 [0,1,0,1,0,0|0,0,1]=3 1991 B7R1.18 C1CC(C1)C(=O)O TS22946 [0,1,0,1,0,0|1,0,1]=4 1992 B7R1.18 C1CC(C1)C(=O)[O-] TS39115 [0,1,0,1,0,0|1,0,1]=4 1993 B7R1.18 C1CNC1C(=O)N TS03852 [0,1,0,1,0,0|1,0,1]=4 1994 B7R1.18 C1CNC1C(=O)O TS31540 [0,1,0,1,0,0|1,0,1]=4 1995 B7R1.18 C1CNC1C(=O)O TS86021 [0,1,0,1,0,0|1,0,1]=4 1996 B7R1.18 C1CN[C@@H]1C(=O)O TS08096 [0,1,0,1,0,0|1,0,1]=4 1997 B7R1.18 C1CN[C@@H]1C(=O)O TS37132 [0,1,0,1,0,0|1,0,1]=4 1998 B7R1.18 C1CN[C@H]1C(=O)O TS01418 [0,1,0,1,0,0|1,0,1]=4 1999 B7R1.20 C1CC1CC(=O)O TS55836 [0,1,0,1,0,0|1,0,1]=4 2000 B7R1.23 C1C(C1(Cl)Cl)CO TS06548 [0,1,0,1,0,0|2,0,0]=4 2001 B7R1.23 C1C(C1(F)F)CBr TS12950 [0,1,0,1,0,0|2,0,0]=4 2002 B7R1.23 CC1(CC1C#N)C TS03696 [0,1,0,1,0,0|0,0,2]=4 2003 B7R1.24 C1CCC=CCC1 TS31384 [0,1,0,1,0,0|1,0,0]=3 2004 B7R1.24 C1CCCCCC1 TS03793 [0,1,0,1,0,0|1,0,0]=3 2005 B7R1.24 C1CCCNCC1 TS39804 [0,1,0,1,0,0|0,0,0]=2 2006 B7R1.24 C1CCCOCC1 TS31519 [0,1,0,1,0,0|1,0,0]=3 2007 B7R1.24 C1CCCSCC1 TS04639 [0,1,0,1,0,0|1,0,0]=3 2008 B7R1.24 C1CCOCOC1 TS03952 [0,1,0,1,0,0|1,0,0]=3 2009 B7R1.24 C1CCSCSC1 TS36881 [0,1,0,1,0,0|1,0,0]=3 2010 B7R1.24 C1CNCCNC1 TS08536 [0,1,0,1,0,0|0,0,0]=2 2011 B7R1.24 C1CNCCOC1 TS02067 [0,1,0,1,0,0|0,0,0]=2 2012 B7R2.13 C1C2C(O2)CO1 TS65746 [0,0,0,2,0,0|2,0,0]=4 2013 B7R2.13 C1C2C1CNC2 TS86763 [0,0,0,2,0,0|0,0,0]=2 2014 B7R2.13 C1CC2C(C1)O2 TS55825 [0,0,0,2,0,0|1,0,0]=3 2015 B7R2.13 C1CNC2C1C2 TS90381 [0,0,0,2,0,0|0,0,0]=2 2016 B7R2.1 C1C(O1)C2CO2 TS71738 [0,0,0,2,0,0|2,0,0]=4