0 B7R0.1 C#CCCCCCO TS01237 [0,0,0,0,0,0|3,0,1]=4 1 B7R0.1 C(CCC#N)CCBr TS39357 [0,0,0,0,0,0|3,0,1]=4 2 B7R0.1 C(CCC#N)CCCl TS05684 [0,0,0,0,0,0|3,0,1]=4 3 B7R0.1 C(CCC#N)CCN TS04328 [0,0,0,0,0,0|3,0,1]=4 4 B7R0.1 C(CCCBr)CCBr TS07890 [0,0,0,0,0,0|3,0,1]=4 5 B7R0.1 C(CCCBr)CCCl TS00416 [0,0,0,0,0,0|3,0,1]=4 6 B7R0.1 C(CCCBr)CCO TS59727 [0,0,0,0,0,0|2,1,1]=4 7 B7R0.1 C(CCCCl)CCCl TS10546 [0,0,0,0,0,0|3,0,1]=4 8 B7R0.1 C(CCCCl)CCO TS06143 [0,0,0,0,0,0|2,1,1]=4 9 B7R0.1 C(CCCI)CCCl TS27509 [0,0,0,0,0,0|3,0,1]=4 10 B7R0.1 C(CCCN)CCN TS04632 [0,0,0,0,0,0|3,0,1]=4 11 B7R0.1 C(CCCN)CCN TS41228 [0,0,0,0,0,0|3,0,1]=4 12 B7R0.1 C(CCCN)CCN TS41960 [0,0,0,0,0,0|3,0,1]=4 13 B7R0.1 C(CCCN)CCN TS42181 [0,0,0,0,0,0|3,0,1]=4 14 B7R0.1 C(CCCO)CCN TS39356 [0,0,0,0,0,0|2,1,1]=4 15 B7R0.1 C(CCCO)CCO TS46825 [0,0,0,0,0,0|2,1,1]=4 16 B7R0.1 C(CCCS)CCO TS36872 [0,0,0,0,0,0|2,0,2]=4 17 B7R0.1 C(CCCS)CCS TS40940 [0,0,0,0,0,0|2,0,2]=4 18 B7R0.1 C(CCC[Zn+])CCCl TS68903 [0,0,0,0,0,0|3,0,1]=4 19 B7R0.1 C(CCO)CC=NO TS04658 [0,0,0,0,0,0|3,1,0]=4 20 B7R0.1 C=CCCCCCBr TS59625 [0,0,0,0,0,0|3,0,1]=4 21 B7R0.1 C=CCCCCCCl TS36738 [0,0,0,0,0,0|3,0,1]=4 22 B7R0.1 C=CCCCCCO TS04461 [0,0,0,0,0,0|3,0,1]=4 23 B7R0.1 C=CCCCN=C=S TS36244 [0,0,0,0,0,0|0,0,2]=2 24 B7R0.1 C=COCCCCO TS32203 [0,0,0,0,0,0|3,0,1]=4 25 B7R0.1 CCCCC#CC=C TS31785 [0,0,0,0,0,0|2,0,2]=4 26 B7R0.1 CCCCC#CCC TS31859 [0,0,0,0,0,0|2,0,2]=4 27 B7R0.1 CCCCC#CCO TS31930 [0,0,0,0,0,0|1,1,2]=4 28 B7R0.1 CCCCC=CC=C TS31850 [0,0,0,0,0,0|2,0,2]=4 29 B7R0.1 CCCCC=CC=O TS04311 [0,0,0,0,0,0|1,1,2]=4 30 B7R0.1 CCCCC=CCC TS04348 [0,0,0,0,0,0|2,0,2]=4 31 B7R0.1 CCCCC=CCC TS31974 [0,0,0,0,0,0|2,0,2]=4 32 B7R0.1 CCCCC=CCO TS32112 [0,0,0,0,0,0|1,1,2]=4 33 B7R0.1 CCCCCC#CC TS31856 [0,0,0,0,0,0|2,0,1]=3 34 B7R0.1 CCCCCC=CC TS31964 [0,0,0,0,0,0|2,0,1]=3 35 B7R0.1 CCCCCCC#C TS31852 [0,0,0,0,0,0|2,0,1]=3 36 B7R0.1 CCCCCCC#N TS31893 [0,0,0,0,0,0|2,0,1]=3 37 B7R0.1 CCCCCCC=O TS32096 [0,0,0,0,0,0|1,1,1]=3 38 B7R0.1 CCCCCCCBr TS00035 [0,0,0,0,0,0|2,0,1]=3 39 B7R0.1 CCCCCCCCl TS36887 [0,0,0,0,0,0|2,0,1]=3 40 B7R0.1 CCCCCCCF TS32353 [0,0,0,0,0,0|2,0,1]=3 41 B7R0.1 CCCCCCCI TS52275 [0,0,0,0,0,0|2,0,1]=3 42 B7R0.1 CCCCCCCN TS04552 [0,0,0,0,0,0|2,0,1]=3 43 B7R0.1 CCCCCCCO TS32232 [0,0,0,0,0,0|1,1,1]=3 44 B7R0.1 CCCCCCCS TS05788 [0,0,0,0,0,0|1,0,2]=3 45 B7R0.1 CCCCCCNC TS04559 [0,0,0,0,0,0|3,0,0]=3 46 B7R0.1 CCCCCCOC TS32254 [0,0,0,0,0,0|3,0,0]=3 47 B7R0.1 CCCCCCSC TS05792 [0,0,0,0,0,0|3,0,0]=3 48 B7R0.1 CCCCCN=C=O TS04390 [0,0,0,0,0,0|0,1,0]=1 49 B7R0.1 CCCCCN=C=S TS36444 [0,0,0,0,0,0|0,0,0]=0 50 B7R0.1 CCCCCNCC TS04550 [0,0,0,0,0,0|1,0,2]=3 51 B7R0.1 CCCCCOCC TS32236 [0,0,0,0,0,0|2,0,1]=3 52 B7R0.1 CCCCCON=O TS04662 [0,0,0,0,0,0|2,1,0]=3 53 B7R0.1 CCCCCSCC TS36717 [0,0,0,0,0,0|2,0,1]=3 54 B7R0.1 CCCCNCC#C TS31888 [0,0,0,0,0,0|3,0,1]=4 55 B7R0.1 CCCCNCCC TS04557 [0,0,0,0,0,0|3,0,1]=4 56 B7R0.1 CCCCNCCN TS04633 [0,0,0,0,0,0|3,0,1]=4 57 B7R0.1 CCCCNCCO TS32289 [0,0,0,0,0,0|2,1,1]=4 58 B7R0.1 CCCCNCCS TS36787 [0,0,0,0,0,0|2,0,2]=4 59 B7R0.1 CCCCOCC=C TS32094 [0,0,0,0,0,0|3,0,1]=4 60 B7R0.1 CCCCOCCBr TS48031 [0,0,0,0,0,0|3,0,1]=4 61 B7R0.1 CCCCOCCCl TS06142 [0,0,0,0,0,0|3,0,1]=4 62 B7R0.1 CCCCOCCO TS04738 [0,0,0,0,0,0|2,1,1]=4 63 B7R0.1 CCCCSCC#N TS36442 [0,0,0,0,0,0|3,0,1]=4 64 B7R0.1 CCCCSCCC TS05790 [0,0,0,0,0,0|3,0,1]=4 65 B7R0.1 CCCCSCCO TS36874 [0,0,0,0,0,0|2,1,1]=4 66 B7R0.1 CCCCSSCC TS40937 [0,0,0,0,0,0|3,0,1]=4 67 B7R0.1 CCCNCCC#N TS04329 [0,0,0,0,0,0|3,0,1]=4 68 B7R0.1 CCCNCCCN TS32259 [0,0,0,0,0,0|3,0,1]=4 69 B7R0.1 CCCNCCN=O TS04604 [0,0,0,0,0,0|3,1,0]=4 70 B7R0.1 CCCOCCCN TS32295 [0,0,0,0,0,0|3,0,1]=4 71 B7R0.1 CCNCCCCN TS36623 [0,0,0,0,0,0|2,0,2]=4 72 B7R0.1 CCNCCCCO TS32294 [0,0,0,0,0,0|2,0,2]=4 73 B7R0.1 CCNCCNCC TS32258 [0,0,0,0,0,0|2,0,2]=4 74 B7R0.1 CCOCCCCCl TS06141 [0,0,0,0,0,0|3,0,1]=4 75 B7R0.1 CCOCCOCC TS32341 [0,0,0,0,0,0|3,0,1]=4 76 B7R0.1 CNCCCCC=C TS93899 [0,0,0,0,0,0|3,0,1]=4 77 B7R0.1 CNCCCCNC TS04634 [0,0,0,0,0,0|4,0,0]=4 78 B7R0.1 COCCCN=C=S TS05679 [0,0,0,0,0,0|1,0,0]=1 79 B7R0.1 CSCCCCSC TS40938 [0,0,0,0,0,0|4,0,0]=4 80 B7R0.1 CSCCCN=C=S TS07376 [0,0,0,0,0,0|1,0,0]=1 81 B6R0.6 C#CCCCCCl TS04652 [1,0,0,0,0,0|2,0,1]=4 82 B6R0.6 C#CCCCCO TS31426 [1,0,0,0,0,0|2,0,1]=4 83 B6R0.6 C(CCBr)CC#N TS11479 [1,0,0,0,0,0|2,0,1]=4 84 B6R0.6 C(CCBr)CCBr TS07888 [1,0,0,0,0,0|2,0,1]=4 85 B6R0.6 C(CCCl)CC#N TS08706 [1,0,0,0,0,0|2,0,1]=4 86 B6R0.6 C(CCCl)CC=O TS32450 [1,0,0,0,0,0|1,1,1]=4 87 B6R0.6 C(CCCl)CCBr TS48788 [1,0,0,0,0,0|2,0,1]=4 88 B6R0.6 C(CCCl)CCCl TS06550 [1,0,0,0,0,0|2,0,1]=4 89 B6R0.6 C(CCCl)CCI TS53384 [1,0,0,0,0,0|2,0,1]=4 90 B6R0.6 C(CCCl)CC[Zn+] TS28126 [1,0,0,0,0,0|2,0,1]=4 91 B6R0.6 C(CCI)CCI TS77462 [1,0,0,0,0,0|2,0,1]=4 92 B6R0.6 C(CCN)CCN TS03978 [1,0,0,0,0,0|2,0,1]=4 93 B6R0.6 C(CCN)CCN TS45899 [1,0,0,0,0,0|2,0,1]=4 94 B6R0.6 C(CCN)CCO TS04006 [1,0,0,0,0,0|1,1,1]=4 95 B6R0.6 C(CCO)CC=O TS03340 [1,0,0,0,0,0|1,1,1]=4 96 B6R0.6 C(CCO)CCBr TS09812 [1,0,0,0,0,0|1,1,1]=4 97 B6R0.6 C(CCO)CCCl TS71520 [1,0,0,0,0,0|1,1,1]=4 98 B6R0.6 C(CCO)CCO TS46820 [1,0,0,0,0,0|1,1,1]=4 99 B6R0.6 C(CCS)CCS TS37065 [1,0,0,0,0,0|1,0,2]=4 100 B6R0.6 C(CC[Zn+])CC#N TS24406 [1,0,0,0,0,0|2,0,1]=4 101 B6R0.6 C(CN=C=O)CCl TS04799 [1,0,0,0,0,0|1,1,0]=3 102 B6R0.6 C(CN=C=S)CBr TS14498 [1,0,0,0,0,0|1,0,0]=2 103 B6R0.6 C(CN=C=S)CCl TS06025 [1,0,0,0,0,0|1,0,0]=2 104 B6R0.6 C=CCCCCBr TS33003 [1,0,0,0,0,0|2,0,1]=4 105 B6R0.6 C=CCCCCCl TS04773 [1,0,0,0,0,0|2,0,1]=4 106 B6R0.6 C=CCCCCN TS03830 [1,0,0,0,0,0|2,0,1]=4 107 B6R0.6 C=CCCCCO TS71562 [1,0,0,0,0,0|2,0,1]=4 108 B6R0.6 CCCCC#CC TS03724 [1,0,0,0,0,0|1,0,2]=4 109 B6R0.6 CCCCC=CBr TS11653 [1,0,0,0,0,0|1,0,2]=4 110 B6R0.6 CCCCC=CC TS03803 [1,0,0,0,0,0|1,0,2]=4 111 B6R0.6 CCCCCC#C TS03726 [1,0,0,0,0,0|1,0,1]=3 112 B6R0.6 CCCCCC#N TS31405 [1,0,0,0,0,0|1,0,1]=3 113 B6R0.6 CCCCCC=C TS31453 [1,0,0,0,0,0|1,0,1]=3 114 B6R0.6 CCCCCC=O TS39877 [1,0,0,0,0,0|0,1,1]=3 115 B6R0.6 CCCCCCBr TS00036 [1,0,0,0,0,0|1,0,1]=3 116 B6R0.6 CCCCCCC TS03885 [1,0,0,0,0,0|1,0,1]=3 117 B6R0.6 CCCCCCCl TS04842 [1,0,0,0,0,0|1,0,1]=3 118 B6R0.6 CCCCCCF TS31676 [1,0,0,0,0,0|1,0,1]=3 119 B6R0.6 CCCCCCI TS93973 [1,0,0,0,0,0|1,0,1]=3 120 B6R0.6 CCCCCCN TS31561 [1,0,0,0,0,0|1,0,1]=3 121 B6R0.6 CCCCCCN TS37145 [1,0,0,0,0,0|1,0,1]=3 122 B6R0.6 CCCCCCO TS39881 [1,0,0,0,0,0|0,1,1]=3 123 B6R0.6 CCCCCCS TS04753 [1,0,0,0,0,0|0,0,2]=3 124 B6R0.6 CCCCCC[SiH3] TS04643 [1,0,0,0,0,0|1,0,1]=3 125 B6R0.6 CCCCCC[Zn+] TS24970 [1,0,0,0,0,0|1,0,1]=3 126 B6R0.6 CCCCCNC TS03916 [1,0,0,0,0,0|0,0,2]=3 127 B6R0.6 CCCCCNN TS06331 [1,0,0,0,0,0|1,0,1]=3 128 B6R0.6 CCCCCSC TS04750 [1,0,0,0,0,0|1,0,1]=3 129 B6R0.6 CCCCC[Mg]Cl TS36578 [1,0,0,0,0,0|2,0,0]=3 130 B6R0.6 CCCCN=C=O TS93082 [1,0,0,0,0,0|0,1,0]=2 131 B6R0.6 CCCCN=C=S TS04546 [1,0,0,0,0,0|0,0,0]=1 132 B6R0.6 CCCCNC=O TS03902 [1,0,0,0,0,0|0,1,2]=4 133 B6R0.6 CCCCNCC TS03925 [1,0,0,0,0,0|1,0,2]=4 134 B6R0.6 CCCCOC=C TS33237 [1,0,0,0,0,0|2,0,1]=4 135 B6R0.6 CCCCOC=O TS03954 [1,0,0,0,0,0|1,1,1]=4 136 B6R0.6 CCCCOCC TS03964 [1,0,0,0,0,0|2,0,1]=4 137 B6R0.6 CCCCOCCl TS04949 [1,0,0,0,0,0|2,0,1]=4 138 B6R0.6 CCCCON=O TS31645 [1,0,0,0,0,0|1,1,0]=3 139 B6R0.6 CCCCSC#N TS04545 [1,0,0,0,0,0|2,0,1]=4 140 B6R0.6 CCCCSCC TS04749 [1,0,0,0,0,0|2,0,1]=4 141 B6R0.6 CCCCS[SnH]=O TS23939 [1,0,0,0,0,0|2,1,0]=4 142 B6R0.6 CCCNCCC TS39857 [1,0,0,0,0,0|2,0,1]=4 143 B6R0.6 CCCNCCN TS03973 [1,0,0,0,0,0|2,0,1]=4 144 B6R0.6 CCCNCCO TS04001 [1,0,0,0,0,0|1,1,1]=4 145 B6R0.6 CCCOCCC TS03967 [1,0,0,0,0,0|2,0,1]=4 146 B6R0.6 CCCOCCC TS49356 [1,0,0,0,0,0|2,0,1]=4 147 B6R0.6 CCCOCCCl TS04951 [1,0,0,0,0,0|2,0,1]=4 148 B6R0.6 CCCOCCN TS04012 [1,0,0,0,0,0|2,0,1]=4 149 B6R0.6 CCCSCC=C TS04636 [1,0,0,0,0,0|2,0,1]=4 150 B6R0.6 CCCSCCC TS04756 [1,0,0,0,0,0|2,0,1]=4 151 B6R0.6 CCCSCCO TS32433 [1,0,0,0,0,0|1,1,1]=4 152 B6R0.6 CCC[Hg]CCC TS35002 [1,0,0,0,0,0|2,0,1]=4 153 B6R0.6 CCNCCC#N TS03784 [1,0,0,0,0,0|2,0,1]=4 154 B6R0.6 CCNCCCN TS03975 [1,0,0,0,0,0|2,0,1]=4 155 B6R0.6 CCNCCNC TS03972 [1,0,0,0,0,0|1,0,2]=4 156 B6R0.6 CCOCCC#N TS03822 [1,0,0,0,0,0|2,0,1]=4 157 B6R0.6 CCOCCCBr TS12340 [1,0,0,0,0,0|2,0,1]=4 158 B6R0.6 CCOCCCCl TS04950 [1,0,0,0,0,0|2,0,1]=4 159 B6R0.6 CCOCCCN TS04010 [1,0,0,0,0,0|2,0,1]=4 160 B6R0.6 CCOCCCO TS04028 [1,0,0,0,0,0|1,1,1]=4 161 B6R0.6 CCOCCOC TS04027 [1,0,0,0,0,0|2,0,1]=4 162 B6R0.6 CCSCCCO TS32432 [1,0,0,0,0,0|1,1,1]=4 163 B6R0.6 CNCCCNC TS56351 [1,0,0,0,0,0|1,0,2]=4 164 B6R0.6 COCCCCBr TS03145 [1,0,0,0,0,0|2,0,1]=4 165 B6R0.6 COCCCCCl TS39592 [1,0,0,0,0,0|2,0,1]=4 166 B6R0.6 COCCCCO TS07977 [1,0,0,0,0,0|1,1,1]=4 167 B6R0.6 CSCCCCO TS32429 [1,0,0,0,0,0|1,1,1]=4 168 B6R0.6 CSCCCSC TS37067 [1,0,0,0,0,0|2,0,1]=4 169 B6R0.6 [Li]CCCCCC TS03654 [1,0,0,0,0,0|1,0,1]=3 170 B8R0.1 CCCC(C)CCCO TS36530 [0,1,0,0,0,0|1,1,1]=4 171 B8R0.1 CCCC(C)COC=O TS36501 [0,1,0,0,0,0|1,1,1]=4 172 B8R0.1 CCCCC(C)CCC TS05416 [0,1,0,0,0,0|2,0,1]=4 173 B8R0.1 CCCCC(C)CCO TS05597 [0,1,0,0,0,0|1,1,1]=4 174 B8R0.1 CCCCC(C)N=C=S TS06883 [0,1,0,0,0,0|0,0,0]=1 175 B8R0.1 CCCCC(C=CC)O TS05375 [0,1,0,0,0,0|2,0,1]=4 176 B8R0.1 CCCCC(CC=C)O TS36339 [0,1,0,0,0,0|2,0,1]=4 177 B8R0.1 CCCCC(CCC)Br TS51606 [0,1,0,0,0,0|2,0,1]=4 178 B8R0.1 CCCCC(CCC)Cl TS07522 [0,1,0,0,0,0|2,0,1]=4 179 B8R0.1 CCCCC(CCC)I TS26461 [0,1,0,0,0,0|2,0,1]=4 180 B8R0.1 CCCCC(CCC)O TS36547 [0,1,0,0,0,0|2,0,1]=4 181 B8R0.1 CCCC[C@@H](C)CCO TS36538 [0,1,0,0,0,0|1,1,1]=4 182 B8R0.1 CCOC(=O)CN=C=O TS05435 [0,1,0,0,0,0|1,1,1]=4 183 B8R0.1 CCOC(=O)CN=C=S TS40312 [0,1,0,0,0,0|1,0,1]=3 184 B8R0.4 C#CCCCCCCO TS05177 [0,1,0,0,0,0|2,0,1]=4 185 B8R0.4 C(CCCBr)CCC#N TS51024 [0,1,0,0,0,0|2,0,1]=4 186 B8R0.4 C(CCCBr)CCCBr TS68070 [0,1,0,0,0,0|2,0,1]=4 187 B8R0.4 C(CCCCl)CCC#N TS07151 [0,1,0,0,0,0|2,0,1]=4 188 B8R0.4 C(CCCCl)CCCCl TS44969 [0,1,0,0,0,0|2,0,1]=4 189 B8R0.4 C(CCCN)CCCN TS05605 [0,1,0,0,0,0|2,0,1]=4 190 B8R0.4 C(CCCN)CCCO TS36619 [0,1,0,0,0,0|1,1,1]=4 191 B8R0.4 C(CCCO)CCCBr TS55654 [0,1,0,0,0,0|1,1,1]=4 192 B8R0.4 C(CCCO)CCCO TS36690 [0,1,0,0,0,0|1,1,1]=4 193 B8R0.4 C(CCC[Zn+])CCC#N TS67764 [0,1,0,0,0,0|2,0,1]=4 194 B8R0.4 C(CN=C=S)CN=C=S TS11044 [0,1,0,0,0,0|1,0,1]=3 195 B8R0.4 C=CCCCCCCBr TS01315 [0,1,0,0,0,0|2,0,1]=4 196 B8R0.4 C=CCCCCCCO TS05382 [0,1,0,0,0,0|2,0,1]=4 197 B8R0.4 CCCCCC#CC=C TS32531 [0,1,0,0,0,0|2,0,1]=4 198 B8R0.4 CCCCCC#CCBr TS50858 [0,1,0,0,0,0|2,0,1]=4 199 B8R0.4 CCCCCC#CCC TS05059 [0,1,0,0,0,0|2,0,1]=4 200 B8R0.4 CCCCCC#CCCl TS07054 [0,1,0,0,0,0|2,0,1]=4 201 B8R0.4 CCCCCC#CCO TS05190 [0,1,0,0,0,0|1,1,1]=4 202 B8R0.4 CCCCCC=CC=O TS36157 [0,1,0,0,0,0|1,1,1]=4 203 B8R0.4 CCCCCC=CCC TS36181 [0,1,0,0,0,0|2,0,1]=4 204 B8R0.4 CCCCCC=CCO TS05393 [0,1,0,0,0,0|1,1,1]=4 205 B8R0.4 CCCCCCC#CC TS05062 [0,1,0,0,0,0|2,0,1]=4 206 B8R0.4 CCCCCCC=CC TS05227 [0,1,0,0,0,0|2,0,1]=4 207 B8R0.4 CCCCCCC=NO TS36429 [0,1,0,0,0,0|1,1,1]=4 208 B8R0.4 CCCCCCCC#C TS05045 [0,1,0,0,0,0|2,0,1]=4 209 B8R0.4 CCCCCCCC#N TS05112 [0,1,0,0,0,0|2,0,1]=4 210 B8R0.4 CCCCCCCC=C TS05208 [0,1,0,0,0,0|2,0,1]=4 211 B8R0.4 CCCCCCCC=O TS05399 [0,1,0,0,0,0|1,1,1]=4 212 B8R0.4 CCCCCCCCBr TS00038 [0,1,0,0,0,0|2,0,1]=4 213 B8R0.4 CCCCCCCCC TS05427 [0,1,0,0,0,0|2,0,1]=4 214 B8R0.4 CCCCCCCCCl TS07517 [0,1,0,0,0,0|2,0,1]=4 215 B8R0.4 CCCCCCCCF TS05771 [0,1,0,0,0,0|2,0,1]=4 216 B8R0.4 CCCCCCCCN TS05489 [0,1,0,0,0,0|2,0,1]=4 217 B8R0.4 CCCCCCCCN TS12120 [0,1,0,0,0,0|2,0,1]=4 218 B8R0.4 CCCCCCCCN TS20855 [0,1,0,0,0,0|2,0,1]=4 219 B8R0.4 CCCCCCCCO TS36550 [0,1,0,0,0,0|1,1,1]=4 220 B8R0.4 CCCCCCCCS TS40481 [0,1,0,0,0,0|1,0,2]=4 221 B8R0.4 CCCCCCCC[Si] TS07042 [0,1,0,0,0,0|2,0,1]=4 222 B8R0.4 CCCCCCCNC TS05499 [0,1,0,0,0,0|2,0,1]=4 223 B8R0.4 CCCCCCN=C=O TS36237 [0,1,0,0,0,0|0,1,0]=2 224 B8R0.4 CCCCCCN=C=S TS06881 [0,1,0,0,0,0|0,0,0]=1 225 B8R0.4 CCCCCCNCC TS05500 [0,1,0,0,0,0|1,0,2]=4 226 B8R0.4 CCCCCCOC=O TS36508 [0,1,0,0,0,0|1,1,1]=4 227 B8R0.4 CCCCCCSCC TS40479 [0,1,0,0,0,0|2,0,1]=4 228 B8R0.4 CCCCCNCCO TS36622 [0,1,0,0,0,0|0,1,2]=4 229 B8R0.4 CCCCCOCC=C TS05379 [0,1,0,0,0,0|2,0,1]=4 230 B8R0.4 CCCCCOCCO TS36691 [0,1,0,0,0,0|1,1,1]=4 231 B8R0.4 CCCCNCCC#N TS36164 [0,1,0,0,0,0|2,0,1]=4 232 B8R0.4 CCCCNCCCC TS55846 [0,1,0,0,0,0|2,0,1]=4 233 B8R0.4 CCCCOCCC#N TS36235 [0,1,0,0,0,0|2,0,1]=4 234 B8R0.4 CCCCOCCCC TS05599 [0,1,0,0,0,0|2,0,1]=4 235 B8R0.4 CCCCOCCCN TS36614 [0,1,0,0,0,0|2,0,1]=4 236 B8R0.4 CCCCPCCCC TS40455 [0,1,0,0,0,0|2,0,1]=4 237 B8R0.4 CCCCSCCCC TS40480 [0,1,0,0,0,0|2,0,1]=4 238 B8R0.4 CCCC[GeH2]CCCC TS16104 [0,1,0,0,0,0|2,0,1]=4 239 B8R0.4 CCCC[Hg]CCCC TS76737 [0,1,0,0,0,0|2,0,1]=4 240 B8R0.4 CCCC[NH2+]CCCC TS49201 [0,1,0,0,0,0|2,0,1]=4 241 B8R0.4 CCCC[Sn+2]CCCC TS64754 [0,1,0,0,0,0|2,0,1]=4 242 B8R0.4 CCCC[Sn+2]CCCC TS78833 [0,1,0,0,0,0|2,0,1]=4 243 B8R0.4 CCCC[Sn+2]CCCC TS79757 [0,1,0,0,0,0|2,0,1]=4 244 B8R0.4 CCCC[Te]CCCC TS57621 [0,1,0,0,0,0|2,0,1]=4 245 B8R0.4 CCCC[Zn]CCCC TS14479 [0,1,0,0,0,0|2,0,1]=4 246 B8R0.4 CCNCCCNCC TS05606 [0,1,0,0,0,0|1,0,2]=4 247 B8R0.4 CNCCCCCCO TS36615 [0,1,0,0,0,0|1,1,1]=4 248 B8R0.4 COCCCCCOC TS36689 [0,1,0,0,0,0|3,0,0]=4 249 B8R0.4 CSCCCCN=C=S TS11448 [0,1,0,0,0,0|0,0,0]=1 250 B8R0.4 [B+](CCCC)CCCC TS33566 [0,1,0,0,0,0|2,0,1]=4 251 B8R0.6 CCC(C)CCCCO TS36535 [0,1,0,0,0,0|1,1,1]=4 252 B8R0.6 CCCCCC(=O)C=C TS05201 [0,1,0,0,0,0|2,0,1]=4 253 B8R0.6 CCCCCC(=O)CC TS36343 [0,1,0,0,0,0|2,0,1]=4 254 B8R0.6 CCCCCC(=O)NO TS05662 [0,1,0,0,0,0|2,1,0]=4 255 B8R0.6 CCCCCC(=O)OC TS36499 [0,1,0,0,0,0|3,0,0]=4 256 B8R0.6 CCCCCC(C#C)O TS05191 [0,1,0,0,0,0|2,0,1]=4 257 B8R0.6 CCCCCC(C)CC TS05415 [0,1,0,0,0,0|2,0,1]=4 258 B8R0.6 CCCCCC(C)CO TS36542 [0,1,0,0,0,0|1,1,1]=4 259 B8R0.6 CCCCCC(C=C)O TS36349 [0,1,0,0,0,0|2,0,1]=4 260 B8R0.6 CCCCCC(CC)Br TS51604 [0,1,0,0,0,0|2,0,1]=4 261 B8R0.6 CCCCCC(CC)Cl TS07523 [0,1,0,0,0,0|2,0,1]=4 262 B8R0.6 CCCCCC(CC)O TS36536 [0,1,0,0,0,0|2,0,1]=4 263 B8R0.6 CCCCCC(CO)O TS05756 [0,1,0,0,0,0|1,1,1]=4 264 B8R0.6 CCCCCN(C)N=O TS36525 [0,1,0,0,0,0|1,1,1]=4 265 B8R0.6 CCCCC[C@@H](C#C)O TS36148 [0,1,0,0,0,0|2,0,1]=4 266 B8R0.6 CCCCC[C@@H](C=C)O TS36348 [0,1,0,0,0,0|2,0,1]=4 267 B8R0.6 CC[C@H](C)CCCCO TS05594 [0,1,0,0,0,0|1,1,1]=4 268 B8R0.7 B(CCCCCC)(O)O TS32717 [0,1,0,0,0,0|2,1,0]=4 269 B8R0.7 CC(C)CCCCCBr TS51602 [0,1,0,0,0,0|2,0,1]=4 270 B8R0.7 CC(C)CCCCCN TS05491 [0,1,0,0,0,0|2,0,1]=4 271 B8R0.7 CCCCCCC(=O)C TS36325 [0,1,0,0,0,0|1,1,1]=4 272 B8R0.7 CCCCCCC(=O)Cl TS07515 [0,1,0,0,0,0|1,1,1]=4 273 B8R0.7 CCCCCCC(=O)N TS36432 [0,1,0,0,0,0|1,1,1]=4 274 B8R0.7 CCCCCCC(=O)O TS05558 [0,1,0,0,0,0|1,1,1]=4 275 B8R0.7 CCCCCCC(=O)[O-] TS10169 [0,1,0,0,0,0|1,1,1]=4 276 B8R0.7 CCCCCCC(C)Br TS51603 [0,1,0,0,0,0|2,0,1]=4 277 B8R0.7 CCCCCCC(C)C TS05423 [0,1,0,0,0,0|2,0,1]=4 278 B8R0.7 CCCCCCC(C)Cl TS07520 [0,1,0,0,0,0|2,0,1]=4 279 B8R0.7 CCCCCCC(C)I TS26460 [0,1,0,0,0,0|2,0,1]=4 280 B8R0.7 CCCCCCC(C)N TS05493 [0,1,0,0,0,0|2,0,1]=4 281 B8R0.7 CCCCCCC(C)O TS05590 [0,1,0,0,0,0|1,1,1]=4 282 B8R0.7 CCCCCCC(C)S TS40477 [0,1,0,0,0,0|1,0,2]=4 283 B8R0.7 CCCCCC[C@@H](C)N TS05497 [0,1,0,0,0,0|2,0,1]=4 284 B8R0.7 CCCCCC[C@@H](C)O TS05598 [0,1,0,0,0,0|1,1,1]=4 285 B8R0.7 CCCCCC[C@H](C)N TS05488 [0,1,0,0,0,0|2,0,1]=4 286 B8R0.7 CCCCCC[C@H](C)O TS46634 [0,1,0,0,0,0|1,1,1]=4 287 B8R0.7 CCCCCC[N+](=O)[O-] TS36590 [0,1,0,0,0,0|2,1,0]=4 288 B8R0.7 CCCCCC[SiH](Cl)Cl TS48718 [0,1,0,0,0,0|2,1,0]=4 289 B8R0.7 CCCCCOC(=O)C TS05568 [0,1,0,0,0,0|1,1,1]=4 290 B8R0.7 CCCCCOC(=O)Cl TS59753 [0,1,0,0,0,0|1,1,1]=4 291 B8R0.7 CCCCCON(=O)=O TS05817 [0,1,0,0,0,0|2,1,0]=4 292 B8R0.7 CS(=O)CCCN=C=S TS42639 [0,1,0,0,0,0|1,0,0]=2 293 B8R1.2 C1CCC(=NO)CC1 TS04394 [0,0,0,1,0,0|2,1,0]=4 294 B8R1.2 C1CCC(CC1)C#N TS31808 [0,0,0,1,0,0|2,0,1]=4 295 B8R1.2 C1CCC(CC1)C#N TS40668 [0,0,0,1,0,0|2,0,1]=4 296 B8R1.2 C1CCC(CC1)C=O TS01404 [0,0,0,1,0,0|1,1,1]=4 297 B8R1.2 C1CCC(CC1)CBr TS46572 [0,0,0,1,0,0|2,0,1]=4 298 B8R1.2 C1CCC(CC1)CCl TS36740 [0,0,0,1,0,0|2,0,1]=4 299 B8R1.2 C1CCC(CC1)CN TS04402 [0,0,0,1,0,0|2,0,1]=4 300 B8R1.2 C1CCC(CC1)CO TS04473 [0,0,0,1,0,0|1,1,1]=4 301 B8R1.2 C1CCC(CC1)CS TS05617 [0,0,0,1,0,0|1,0,2]=4 302 B8R1.2 C1CCC(CC1)NO TS10098 [0,0,0,1,0,0|2,1,0]=4 303 B8R1.2 C1CCC(CC1)[Mg]Br TS50598 [0,0,0,1,0,0|3,0,0]=4 304 B8R1.2 C1CCC(CC1)[Mg]Cl TS06810 [0,0,0,1,0,0|3,0,0]=4 305 B8R1.2 C1CCN(CC1)C#N TS04210 [0,0,0,1,0,0|1,0,2]=4 306 B8R1.2 C1CCN(CC1)C=O TS56398 [0,0,0,1,0,0|0,1,2]=4 307 B8R1.2 C1CCN(CC1)CCl TS05849 [0,0,0,1,0,0|1,0,2]=4 308 B8R1.2 C1CCN(CC1)CO TS32161 [0,0,0,1,0,0|0,1,2]=4 309 B8R1.2 C1CCN(CC1)N=O TS01612 [0,0,0,1,0,0|1,1,1]=4 310 B8R1.2 CCC1CCCCC1 TS04342 [0,0,0,1,0,0|2,0,1]=4 311 B8R1.2 CCC1CCCCN1 TS04398 [0,0,0,1,0,0|2,0,1]=4 312 B8R1.2 CCN1CCCCC1 TS00439 [0,0,0,1,0,0|1,0,2]=4 313 B8R1.2 CCN1CCCCC1 TS32031 [0,0,0,1,0,0|1,0,2]=4 314 B8R1.2 CNC1CCCCC1 TS08095 [0,0,0,1,0,0|3,0,0]=4 315 B8R1.2 COC1CCCCC1 TS32092 [0,0,0,1,0,0|3,0,0]=4 316 B8R1.2 CSC1CCCCC1 TS05616 [0,0,0,1,0,0|3,0,0]=4 317 B8R1.2 [C-]#[N+]C1CCCCC1 TS34562 [0,0,0,1,0,0|3,0,0]=4 318 B8R1.5 CC1=NCCCN1C TS04326 [0,0,0,1,0,0|2,0,1]=4 319 B8R1.5 CC1CCCC=C1C TS31849 [0,0,0,1,0,0|2,0,1]=4 320 B8R1.5 CC1CCCCC1=C TS31851 [0,0,0,1,0,0|2,0,1]=4 321 B8R1.5 CC1CCCCC1=O TS01136 [0,0,0,1,0,0|1,1,1]=4 322 B8R1.5 CC1CCCCC1C TS31973 [0,0,0,1,0,0|2,0,1]=4 323 B8R1.5 CC1CCCCC1N TS32030 [0,0,0,1,0,0|2,0,1]=4 324 B8R1.5 CC1CCCCC1O TS32109 [0,0,0,1,0,0|1,1,1]=4 325 B8R1.5 CC1CCCNC1C TS22984 [0,0,0,1,0,0|1,0,2]=4 326 B8R1.5 C[C@@H]1CCCC[C@@H]1C TS31965 [0,0,0,1,0,0|2,0,1]=4 327 B8R1.5 C[C@@H]1CCCC[C@H]1N TS04400 [0,0,0,1,0,0|2,0,1]=4 328 B8R1.5 C[C@@H]1CCCC[C@H]1O TS32106 [0,0,0,1,0,0|1,1,1]=4 329 B8R1.5 C[C@H]1CCCC[C@H]1O TS32115 [0,0,0,1,0,0|1,1,1]=4 330 B8R1.8 C#CCC1CCCC1 TS04146 [0,0,0,1,0,0|2,0,1]=4 331 B8R1.8 C1CCC(C1)CCN TS00978 [0,0,0,1,0,0|2,0,1]=4 332 B8R1.8 C1CCC(C1)CCO TS04478 [0,0,0,1,0,0|1,1,1]=4 333 B8R1.8 C1CCC(C1)N=C=O TS59760 [0,0,0,1,0,0|0,1,0]=2 334 B8R1.8 C1CCC(C1)N=C=S TS36250 [0,0,0,1,0,0|0,0,0]=1 335 B8R1.8 CCCC1CCCC1 TS31955 [0,0,0,1,0,0|2,0,1]=4 336 B8R1.8 CCCC1CCCC1 TS57165 [0,0,0,1,0,0|2,0,1]=4 337 B8R1.8 CCCC1CCCC1 TS67057 [0,0,0,1,0,0|2,0,1]=4 338 B8R1.8 CCCC1CCCC1 TS69588 [0,0,0,1,0,0|2,0,1]=4 339 B8R1.8 CCCC1CCCC1 TS69915 [0,0,0,1,0,0|2,0,1]=4 340 B8R1.8 CCCC1CCCC1 TS72093 [0,0,0,1,0,0|2,0,1]=4 341 B8R1.8 CCCC1CCCC1 TS72534 [0,0,0,1,0,0|2,0,1]=4 342 B8R1.8 CCCC1CCCC1 TS81524 [0,0,0,1,0,0|2,0,1]=4 343 B8R1.8 CCCC1CCCC1 TS82572 [0,0,0,1,0,0|2,0,1]=4 344 B8R1.8 CCCC1CCCC1 TS82652 [0,0,0,1,0,0|2,0,1]=4 345 B8R1.11 CCC1CCCC1=O TS31928 [0,0,0,1,0,0|1,1,1]=4 346 B8R1.11 CCC1CCCC1C TS67055 [0,0,0,1,0,0|2,0,1]=4 347 B8R1.22 C1CCC(=O)NCC1 TS04386 [0,0,0,1,0,0|0,1,2]=4 348 B8R1.22 C1CCC(=O)NCC1 TS49157 [0,0,0,1,0,0|0,1,2]=4 349 B8R1.22 C1CCC(=O)OCC1 TS59735 [0,0,0,1,0,0|1,1,1]=4 350 B8R1.22 C1CCC(=S)NCC1 TS05487 [0,0,0,1,0,0|0,0,2]=3 351 B8R1.22 C1CCCC(=O)CC1 TS31926 [0,0,0,1,0,0|1,1,1]=4 352 B8R1.22 C1CCCC(CC1)Br TS46223 [0,0,0,1,0,0|2,0,1]=4 353 B8R1.22 C1CCCC(CC1)Cl TS36739 [0,0,0,1,0,0|2,0,1]=4 354 B8R1.22 C1CCCC(CC1)N TS04399 [0,0,0,1,0,0|2,0,1]=4 355 B8R1.22 C1CCCC(CC1)O TS04470 [0,0,0,1,0,0|1,1,1]=4 356 B8R1.22 C1CCCN(CC1)N TS04497 [0,0,0,1,0,0|3,0,0]=4 357 B8R1.22 C1CCNC(=S)NC1 TS05580 [0,0,0,1,0,0|1,0,2]=4 358 B8R1.22 CC1=CCCCCC1 TS04216 [0,0,0,1,0,0|2,0,1]=4 359 B8R1.22 CC1CCCCCC1 TS04339 [0,0,0,1,0,0|2,0,1]=4 360 B8R1.22 CN1CCCCCC1 TS32032 [0,0,0,1,0,0|3,0,0]=4 361 B8R1.36 CCCCCC1CO1 TS04480 [0,0,0,1,0,0|1,1,1]=4 362 B8R1.36 CCCCC[C@@H]1CO1 TS32099 [0,0,0,1,0,0|1,1,1]=4 363 B8R1.49 C1CCCCCCC1 TS04358 [0,0,0,1,0,0|2,0,1]=4 364 B8R1.49 C1CCCNCCC1 TS32033 [0,0,0,1,0,0|1,0,2]=4 365 B5R0.2 C#CCN=C=S TS31403 [2,0,0,0,0,0|0,0,2]=4 366 B5R0.2 C(CBr)N=C=O TS40811 [2,0,0,0,0,0|1,1,0]=4 367 B5R0.2 C(CBr)N=C=S TS42990 [2,0,0,0,0,0|1,0,0]=3 368 B5R0.2 C(CCBr)CBr TS07886 [2,0,0,0,0,0|2,0,0]=4 369 B5R0.2 C(CCBr)CCl TS45376 [2,0,0,0,0,0|2,0,0]=4 370 B5R0.2 C(CCBr)CF TS10539 [2,0,0,0,0,0|2,0,0]=4 371 B5R0.2 C(CCBr)CO TS39737 [2,0,0,0,0,0|1,1,0]=4 372 B5R0.2 C(CCCl)CCl TS36204 [2,0,0,0,0,0|2,0,0]=4 373 B5R0.2 C(CCCl)CO TS33155 [2,0,0,0,0,0|1,1,0]=4 374 B5R0.2 C(CCF)CF TS03666 [2,0,0,0,0,0|2,0,0]=4 375 B5R0.2 C(CCF)CO TS03655 [2,0,0,0,0,0|1,1,0]=4 376 B5R0.2 C(CCI)CCl TS49510 [2,0,0,0,0,0|2,0,0]=4 377 B5R0.2 C(CCI)CI TS76368 [2,0,0,0,0,0|2,0,0]=4 378 B5R0.2 C(CCO)CN TS03609 [2,0,0,0,0,0|1,0,1]=4 379 B5R0.2 C(CCO)CO TS00383 [2,0,0,0,0,0|1,1,0]=4 380 B5R0.2 C(CCS)CO TS04107 [2,0,0,0,0,0|1,0,1]=4 381 B5R0.2 C(CCS)CS TS04933 [2,0,0,0,0,0|1,0,1]=4 382 B5R0.2 C(CC[Zn+])CCl TS25983 [2,0,0,0,0,0|2,0,0]=4 383 B5R0.2 C(CCl)N=C=O TS31715 [2,0,0,0,0,0|1,1,0]=4 384 B5R0.2 C=CCN=C=S TS03827 [2,0,0,0,0,0|0,0,2]=4 385 B5R0.2 CCCC=NO TS03560 [2,0,0,0,0,0|0,1,1]=4 386 B5R0.2 CCCCC#C TS71687 [2,0,0,0,0,0|0,0,2]=4 387 B5R0.2 CCCCC#N TS71704 [2,0,0,0,0,0|0,0,2]=4 388 B5R0.2 CCCCC=C TS71713 [2,0,0,0,0,0|0,0,2]=4 389 B5R0.2 CCCCC=O TS71764 [2,0,0,0,0,0|0,1,1]=4 390 B5R0.2 CCCCCBr TS00039 [2,0,0,0,0,0|1,0,0]=3 391 B5R0.2 CCCCCCl TS31742 [2,0,0,0,0,0|1,0,0]=3 392 B5R0.2 CCCCCF TS71848 [2,0,0,0,0,0|1,0,0]=3 393 B5R0.2 CCCCCI TS18547 [2,0,0,0,0,0|1,0,0]=3 394 B5R0.2 CCCCCN TS71782 [2,0,0,0,0,0|0,0,1]=3 395 B5R0.2 CCCCCO TS46186 [2,0,0,0,0,0|0,1,0]=3 396 B5R0.2 CCCCCO TS71798 [2,0,0,0,0,0|0,1,0]=3 397 B5R0.2 CCCCCS TS31699 [2,0,0,0,0,0|0,0,1]=3 398 B5R0.2 CCCCC[Si] TS03986 [2,0,0,0,0,0|0,1,0]=3 399 B5R0.2 CCCCC[Zn+] TS49168 [2,0,0,0,0,0|1,0,0]=3 400 B5R0.2 CCCCNC TS71774 [2,0,0,0,0,0|0,0,2]=4 401 B5R0.2 CCCCNN TS14187 [2,0,0,0,0,0|1,0,1]=4 402 B5R0.2 CCCCNN TS36035 [2,0,0,0,0,0|1,0,1]=4 403 B5R0.2 CCCCON TS36085 [2,0,0,0,0,0|1,0,1]=4 404 B5R0.2 CCCCON TS93805 [2,0,0,0,0,0|1,0,1]=4 405 B5R0.2 CCCCSC TS31691 [2,0,0,0,0,0|1,0,1]=4 406 B5R0.2 CCCC[Mg]Br TS11455 [2,0,0,0,0,0|2,0,0]=4 407 B5R0.2 CCCC[Mg]Cl TS32260 [2,0,0,0,0,0|2,0,0]=4 408 B5R0.2 CCCC[N+]#[C-] TS71702 [2,0,0,0,0,0|0,0,2]=4 409 B5R0.2 CCCC[Sn]=O TS17583 [2,0,0,0,0,0|1,1,0]=4 410 B5R0.2 CCCN=C=O TS03505 [2,0,0,0,0,0|0,1,0]=3 411 B5R0.2 CCCN=C=S TS03915 [2,0,0,0,0,0|0,0,0]=2 412 B5R0.2 CCCNCC TS71783 [2,0,0,0,0,0|1,0,1]=4 413 B5R0.2 CCCOCC TS71799 [2,0,0,0,0,0|1,0,1]=4 414 B5R0.2 CCCOCCl TS04165 [2,0,0,0,0,0|2,0,0]=4 415 B5R0.2 CCCON=O TS71824 [2,0,0,0,0,0|1,1,0]=4 416 B5R0.2 CCCSCC TS31700 [2,0,0,0,0,0|1,0,1]=4 417 B5R0.2 CCNCCN TS71809 [2,0,0,0,0,0|1,0,1]=4 418 B5R0.2 CCNCCO TS00085 [2,0,0,0,0,0|1,1,0]=4 419 B5R0.2 CCOCCBr TS10269 [2,0,0,0,0,0|2,0,0]=4 420 B5R0.2 CCOCCCl TS04162 [2,0,0,0,0,0|2,0,0]=4 421 B5R0.2 CCOCCO TS71837 [2,0,0,0,0,0|1,1,0]=4 422 B5R0.2 CCSCCBr TS44968 [2,0,0,0,0,0|2,0,0]=4 423 B5R0.2 CCSCCCl TS36036 [2,0,0,0,0,0|2,0,0]=4 424 B5R0.2 CCSCCN TS31712 [2,0,0,0,0,0|1,0,1]=4 425 B5R0.2 CCSCCN TS37539 [2,0,0,0,0,0|1,0,1]=4 426 B5R0.2 CCSCCO TS59769 [2,0,0,0,0,0|1,1,0]=4 427 B5R0.2 CNCCCCl TS40140 [2,0,0,0,0,0|2,0,0]=4 428 B5R0.2 CNCCCN TS71808 [2,0,0,0,0,0|1,0,1]=4 429 B5R0.2 COCCCBr TS10272 [2,0,0,0,0,0|2,0,0]=4 430 B5R0.2 COCCCCl TS04163 [2,0,0,0,0,0|2,0,0]=4 431 B5R0.2 COCCCN TS03603 [2,0,0,0,0,0|1,0,1]=4 432 B5R0.2 COCCCO TS70643 [2,0,0,0,0,0|1,1,0]=4 433 B5R0.2 COCN=C=S TS03997 [2,0,0,0,0,0|1,0,0]=3 434 B5R0.2 CSCCCN TS65714 [2,0,0,0,0,0|1,0,1]=4 435 B5R0.2 CSCCCO TS04105 [2,0,0,0,0,0|1,1,0]=4 436 B7R0.3 C(C(CBr)Br)N=C=S TS68217 [1,1,0,0,0,0|1,0,0]=3 437 B7R0.3 CCC(C)CN=C=S TS36443 [1,1,0,0,0,0|0,0,0]=2 438 B7R0.3 CCC(CCC=C)O TS32091 [1,1,0,0,0,0|1,0,1]=4 439 B7R0.3 CCCCC(=NO)C TS04540 [1,1,0,0,0,0|0,1,1]=4 440 B7R0.3 CCCCC(C#C)O TS31937 [1,1,0,0,0,0|1,0,1]=4 441 B7R0.3 CCCCC(C)CBr TS14345 [1,1,0,0,0,0|1,0,1]=4 442 B7R0.3 CCCCC(C)CC TS32121 [1,1,0,0,0,0|1,0,1]=4 443 B7R0.3 CCCCC(C)CO TS32251 [1,1,0,0,0,0|0,1,1]=4 444 B7R0.3 CCCCC(C=C)O TS04474 [1,1,0,0,0,0|1,0,1]=4 445 B7R0.3 CCCCC(CBr)Br TS85274 [1,1,0,0,0,0|1,0,1]=4 446 B7R0.3 CCCCC(CC)Br TS14340 [1,1,0,0,0,0|1,0,1]=4 447 B7R0.3 CCCCC(CC)N TS04554 [1,1,0,0,0,0|1,0,1]=4 448 B7R0.3 CCCCC(CC)O TS04628 [1,1,0,0,0,0|1,0,1]=4 449 B7R0.3 CCCCC(CCl)Cl TS10545 [1,1,0,0,0,0|1,0,1]=4 450 B7R0.3 CCCCC(CO)N TS32290 [1,1,0,0,0,0|0,1,1]=4 451 B7R0.3 CCCCC(CO)O TS32342 [1,1,0,0,0,0|0,1,1]=4 452 B7R0.3 CCCCN(C)N=O TS04602 [1,1,0,0,0,0|1,1,0]=4 453 B7R0.3 CCCC[C@@H](CO)N TS32293 [1,1,0,0,0,0|0,1,1]=4 454 B7R0.3 CCCC[C@H](CO)N TS32292 [1,1,0,0,0,0|0,1,1]=4 455 B7R0.3 CC[C@H](C)CCCO TS04624 [1,1,0,0,0,0|0,1,1]=4 456 B7R0.4 B(CCCCC)(O)O TS01615 [1,1,0,0,0,0|1,1,0]=4 457 B7R0.4 CC(C)CCCC=C TS31960 [1,1,0,0,0,0|1,0,1]=4 458 B7R0.4 CC(C)CCCCBr TS14341 [1,1,0,0,0,0|1,0,1]=4 459 B7R0.4 CC(C)CCCCCl TS36890 [1,1,0,0,0,0|1,0,1]=4 460 B7R0.4 CC(C)CCN=C=S TS05485 [1,1,0,0,0,0|0,0,0]=2 461 B7R0.4 CC(C)CCON=O TS01922 [1,1,0,0,0,0|1,1,0]=4 462 B7R0.4 CC(CCCCO)O TS04744 [1,1,0,0,0,0|0,1,1]=4 463 B7R0.4 CCCCCC(=C)C TS04340 [1,1,0,0,0,0|1,0,1]=4 464 B7R0.4 CCCCCC(=O)C TS32098 [1,1,0,0,0,0|0,1,1]=4 465 B7R0.4 CCCCCC(=O)Cl TS05948 [1,1,0,0,0,0|0,1,1]=4 466 B7R0.4 CCCCCC(=O)N TS32152 [1,1,0,0,0,0|0,1,1]=4 467 B7R0.4 CCCCCC(=O)O TS32204 [1,1,0,0,0,0|0,1,1]=4 468 B7R0.4 CCCCCC(=O)[O-] TS37174 [1,1,0,0,0,0|0,1,1]=4 469 B7R0.4 CCCCCC(=O)[O-] TS58596 [1,1,0,0,0,0|0,1,1]=4 470 B7R0.4 CCCCCC(C)Br TS14342 [1,1,0,0,0,0|1,0,1]=4 471 B7R0.4 CCCCCC(C)C TS32120 [1,1,0,0,0,0|1,0,1]=4 472 B7R0.4 CCCCCC(C)Cl TS05959 [1,1,0,0,0,0|1,0,1]=4 473 B7R0.4 CCCCCC(C)N TS04560 [1,1,0,0,0,0|1,0,1]=4 474 B7R0.4 CCCCCC(C)O TS32255 [1,1,0,0,0,0|0,1,1]=4 475 B7R0.4 CCCCC[C@@H](C)N TS04556 [1,1,0,0,0,0|1,0,1]=4 476 B7R0.4 CCCCC[C@@H](C)O TS04622 [1,1,0,0,0,0|0,1,1]=4 477 B7R0.4 CCCCC[C@H](C)N TS04553 [1,1,0,0,0,0|1,0,1]=4 478 B7R0.4 CCCCC[C@H](C)O TS32248 [1,1,0,0,0,0|0,1,1]=4 479 B7R0.4 CCCCC[N+](=O)[O-] TS04659 [1,1,0,0,0,0|0,1,1]=4 480 B7R0.4 CCCCNC(=S)N TS05781 [1,1,0,0,0,0|0,0,2]=4 481 B7R0.4 CCCCOC(=S)C TS05777 [1,1,0,0,0,0|1,0,1]=4 482 B7R0.4 C[C@H](CCCCO)O TS04737 [1,1,0,0,0,0|0,1,1]=4 483 B7R0.7 CC(COC)N=C=S TS05680 [1,1,0,0,0,0|1,0,0]=3 484 B7R0.7 CCCC(C)C=NO TS32167 [1,1,0,0,0,0|0,1,1]=4 485 B7R0.7 CCCC(C)CC=C TS31971 [1,1,0,0,0,0|1,0,1]=4 486 B7R0.7 CCCC(C)CCC TS04512 [1,1,0,0,0,0|1,0,1]=4 487 B7R0.7 CCCC(C)CCO TS32249 [1,1,0,0,0,0|0,1,1]=4 488 B7R0.7 CCCC(C)N=C=S TS36445 [1,1,0,0,0,0|0,0,0]=2 489 B7R0.7 CCCC(CC=C)O TS04466 [1,1,0,0,0,0|1,0,1]=4 490 B7R0.7 CCCC(CCC)Br TS14339 [1,1,0,0,0,0|1,0,1]=4 491 B7R0.7 CCCC(CCC)Cl TS36889 [1,1,0,0,0,0|1,0,1]=4 492 B7R0.7 CCCC(CCC)N TS02992 [1,1,0,0,0,0|1,0,1]=4 493 B7R0.7 CCCC(CCC)O TS04625 [1,1,0,0,0,0|1,0,1]=4 494 B7R0.7 CCCC(CCC)[Zn+] TS62077 [1,1,0,0,0,0|1,0,1]=4 495 B7R0.7 CCCC(CCO)S TS36876 [1,1,0,0,0,0|0,1,1]=4 496 B7R0.7 CCC[C@@H](C)CCO TS32231 [1,1,0,0,0,0|0,1,1]=4 497 B7R0.7 CCOC(=O)N=C=S TS08471 [1,1,0,0,0,0|1,0,1]=4 498 B9R0.5 CCCCCC(C)N=C=S TS41811 [0,2,0,0,0,0|0,0,0]=2 499 B9R0.5 CCOC(=O)CCN=C=O TS06833 [0,2,0,0,0,0|0,1,1]=4 500 B9R0.35 CCOC(=O)C(C)N=C=S TS42067 [0,2,0,0,0,0|1,0,1]=4 501 B9R0.2 CCCCCCNC(=S)N TS11310 [0,2,0,0,0,0|0,0,2]=4 502 B9R0.2 CCCCCCOC(=S)[S-] TS49163 [0,2,0,0,0,0|1,0,1]=4 503 B9R0.2 CS(=O)C=CCCN=C=S TS94535 [0,2,0,0,0,0|0,0,2]=4 504 B9R0.45 C(CCCN=[N+]=[N-])CCN TS37623 [0,2,0,0,0,0|2,0,0]=4 505 B9R0.45 C(CCN=C=O)CN=C=O TS37353 [0,2,0,0,0,0|0,1,1]=4 506 B9R0.45 C(CCN=C=S)CN=C=S TS45528 [0,2,0,0,0,0|0,0,1]=3 507 B9R0.45 CCCCCCCN=C=O TS37514 [0,2,0,0,0,0|0,1,0]=3 508 B9R0.45 CCCCCCCN=C=S TS10905 [0,2,0,0,0,0|0,0,0]=2 509 B9R0.45 CSCCCCCN=C=S TS13742 [0,2,0,0,0,0|0,0,0]=2 510 B9R0.45 [CH2]CCCCCN=CC#N TS37226 [0,2,0,0,0,0|1,0,1]=4 511 B9R0.46 CCCCCOC(=S)S[K] TS19469 [0,2,0,0,0,0|1,0,1]=4 512 B9R0.38 CS(=O)(=O)CCCN=C=S TS47777 [0,2,0,0,0,0|1,0,0]=3 513 B9R0.38 C[Si](C)(CCCN=C=O)Cl TS14118 [0,2,0,0,0,0|0,2,0]=4 514 B9R0.38 C[Si](CCCN=C=O)(Cl)Cl TS53963 [0,2,0,0,0,0|0,2,0]=4 515 B7R1.1 C#CC1CCCC1 TS03680 [1,0,0,1,0,0|1,0,1]=4 516 B7R1.1 C#CC1CCCC1 TS43724 [1,0,0,1,0,0|1,0,1]=4 517 B7R1.1 C1CCC(C1)C#N TS03699 [1,0,0,1,0,0|1,0,1]=4 518 B7R1.1 C1CCC(C1)C=O TS55823 [1,0,0,1,0,0|0,1,1]=4 519 B7R1.1 C1CCC(C1)CBr TS16535 [1,0,0,1,0,0|1,0,1]=4 520 B7R1.1 C1CCC(C1)CO TS31527 [1,0,0,1,0,0|0,1,1]=4 521 B7R1.1 C1CCC(C1)CO TS44787 [1,0,0,1,0,0|0,1,1]=4 522 B7R1.1 C1CCC(C1)NN TS55828 [1,0,0,1,0,0|1,0,1]=4 523 B7R1.1 C1CCC(C1)[Mg]Br TS45683 [1,0,0,1,0,0|2,0,0]=4 524 B7R1.1 C1CCN(C1)N=O TS03853 [1,0,0,1,0,0|1,1,0]=4 525 B7R1.1 C=CC1CCCC1 TS44110 [1,0,0,1,0,0|1,0,1]=4 526 B7R1.1 CCC1CCC=C1 TS03720 [1,0,0,1,0,0|1,0,1]=4 527 B7R1.1 CCC1CCCC1 TS21020 [1,0,0,1,0,0|1,0,1]=4 528 B7R1.1 CCC1CCCC1 TS21612 [1,0,0,1,0,0|1,0,1]=4 529 B7R1.1 CCC1CCCC1 TS35071 [1,0,0,1,0,0|1,0,1]=4 530 B7R1.1 CCC1CCCC1 TS57108 [1,0,0,1,0,0|1,0,1]=4 531 B7R1.1 CCC1CCCC1 TS57519 [1,0,0,1,0,0|1,0,1]=4 532 B7R1.1 CCC1CCCC1 TS62096 [1,0,0,1,0,0|1,0,1]=4 533 B7R1.1 CCC1CCCC1 TS70230 [1,0,0,1,0,0|1,0,1]=4 534 B7R1.1 CCC1CCCC1 TS70344 [1,0,0,1,0,0|1,0,1]=4 535 B7R1.1 CCC1CCCC1 TS75798 [1,0,0,1,0,0|1,0,1]=4 536 B7R1.1 CCC1CCCC1 TS78923 [1,0,0,1,0,0|1,0,1]=4 537 B7R1.1 CCC1CCCC1 TS80049 [1,0,0,1,0,0|1,0,1]=4 538 B7R1.1 COC1CCCC1 TS03863 [1,0,0,1,0,0|1,0,1]=4 539 B7R1.1 CSC1CCCC1 TS04638 [1,0,0,1,0,0|1,0,1]=4 540 B7R1.1 [C-]#[N+]C1CCCC1 TS03697 [1,0,0,1,0,0|0,0,2]=4 541 B7R1.3 C1CCC(=O)CC1 TS31441 [1,0,0,1,0,0|0,1,1]=4 542 B7R1.3 C1CCC(CC1)Br TS33231 [1,0,0,1,0,0|1,0,1]=4 543 B7R1.3 C1CCC(CC1)Cl TS39830 [1,0,0,1,0,0|1,0,1]=4 544 B7R1.3 C1CCC(CC1)F TS31606 [1,0,0,1,0,0|1,0,1]=4 545 B7R1.3 C1CCC(CC1)I TS43723 [1,0,0,1,0,0|1,0,1]=4 546 B7R1.3 C1CCC(CC1)N TS03833 [1,0,0,1,0,0|1,0,1]=4 547 B7R1.3 C1CCC(CC1)N TS06026 [1,0,0,1,0,0|1,0,1]=4 548 B7R1.3 C1CCC(CC1)N TS14508 [1,0,0,1,0,0|1,0,1]=4 549 B7R1.3 C1CCC(CC1)N TS18426 [1,0,0,1,0,0|1,0,1]=4 550 B7R1.3 C1CCC(CC1)O TS31506 [1,0,0,1,0,0|0,1,1]=4 551 B7R1.3 C1CCC(CC1)P TS04576 [1,0,0,1,0,0|1,0,1]=4 552 B7R1.3 C1CCC(CC1)[NH3+] TS60878 [1,0,0,1,0,0|1,0,1]=4 553 B7R1.3 C1CCC(CC1)[Zn+] TS24609 [1,0,0,1,0,0|1,0,1]=4 554 B7R1.3 C1CCN(CC1)N TS03873 [1,0,0,1,0,0|1,0,1]=4 555 B7R1.3 C1CCN(CC1)N TS06144 [1,0,0,1,0,0|1,0,1]=4 556 B7R1.3 C1CCN(CC1)O TS31559 [1,0,0,1,0,0|0,1,1]=4 557 B7R1.3 CC1CCCCC1 TS02317 [1,0,0,1,0,0|1,0,1]=4 558 B7R1.3 CC1CCCCO1 TS31512 [1,0,0,1,0,0|0,1,1]=4 559 B7R1.3 CC1CCCNC1 TS70672 [1,0,0,1,0,0|0,0,2]=4 560 B7R1.3 CN1CCCCC1 TS03834 [1,0,0,1,0,0|0,0,2]=4 561 B7R1.3 C[C@@H]1CCCCN1 TS03835 [1,0,0,1,0,0|1,0,1]=4 562 B7R1.4 C[C@@H]1CCC[C@@H]1C TS03788 [1,0,0,1,0,0|1,0,1]=4 563 B7R1.4 C[C@@H]1CCC[C@H]1C TS03797 [1,0,0,1,0,0|1,0,1]=4 564 B7R1.6 C1CC(C1)CCN TS88922 [1,0,0,1,0,0|1,0,1]=4 565 B7R1.7 C1CC1CN=C=S TS32024 [1,0,0,1,0,0|0,0,0]=2 566 B7R1.7 CCCCC1CO1 TS31525 [1,0,0,1,0,0|0,1,1]=4 567 B7R1.7 CCCC[C@@H]1CO1 TS31508 [1,0,0,1,0,0|0,1,1]=4 568 B7R1.24 C1CCC=CCC1 TS31384 [1,0,0,1,0,0|1,0,1]=4 569 B7R1.24 C1CCCCCC1 TS03793 [1,0,0,1,0,0|1,0,1]=4 570 B7R1.24 C1CCCNCC1 TS39804 [1,0,0,1,0,0|0,0,2]=4 571 B7R1.24 C1CCCOCC1 TS31519 [1,0,0,1,0,0|0,1,1]=4 572 B7R1.24 C1CCCSCC1 TS04639 [1,0,0,1,0,0|0,0,2]=4 573 B9R1.8 C1CCC(CC1)N=C=O TS22947 [0,1,0,1,0,0|0,1,0]=3 574 B9R1.8 C1CCC(CC1)N=C=S TS06615 [0,1,0,1,0,0|0,0,0]=2 575 B9R1.8 C=C=CC1CCCCC1 TS32530 [0,1,0,1,0,0|2,0,0]=4 576 B9R1.12 C1CC(OC1)CN=C=S TS02181 [0,1,0,1,0,0|0,0,0]=2 577 B9R1.33 C1COC(=O)C1N=C=S TS40072 [0,1,0,1,0,0|1,0,1]=4 578 B9R1.89 COC1=NCCCCC1 TS36236 [0,1,0,1,0,0|0,1,1]=4 579 B9R1.6 C1CCN(CC1)C(=S)S TS62348 [0,1,0,1,0,0|0,0,2]=4