0 B3R0.2 B(C)(C)O CHEBI:38276 [0,0,0,0,0,0|2,0,0]=2 1 B3R0.2 B(F)(F)F CHEBI:33093 [0,0,0,0,0,0|4,0,0]=4 2 B3R0.2 B(O)(O)O CHEBI:33118 [0,0,0,0,0,0|2,0,1]=3 3 B3R0.2 B(O)(O)[O-] CHEBI:29254 [0,0,0,0,0,0|2,0,1]=3 4 B3R0.2 B(O)([O-])[O-] CHEBI:29255 [0,0,0,0,0,0|2,0,1]=3 5 B3R0.2 B([O-])([O-])[O-] CHEBI:22908 [0,0,0,0,0,0|2,0,2]=4 6 B3R0.2 B([O-])([O-])[O-] CHEBI:38909 [0,0,0,0,0,0|2,0,2]=4 7 B3R0.2 B([O-])([O-])[O-] CHEBI:38910 [0,0,0,0,0,0|2,0,2]=4 8 B3R0.2 B([O-])([O-])[O-] CHEBI:38911 [0,0,0,0,0,0|2,0,2]=4 9 B3R0.2 BB(B)B CHEBI:33600 [0,0,0,0,0,0|4,0,0]=4 10 B3R0.2 Br[Ag-2](Br)Br CHEBI:30533 [0,0,0,0,0,0|4,0,0]=4 11 B3R0.2 Br[Au](Br)Br CHEBI:30079 [0,0,0,0,0,0|4,0,0]=4 12 B3R0.2 C(=N)(N)N CHEBI:42820 [0,0,0,0,0,0|3,0,0]=3 13 B3R0.2 C(=N)(N)O CHEBI:48376 [0,0,0,0,0,0|2,0,0]=2 14 B3R0.2 C(=O)(Cl)Cl CHEBI:29365 [0,0,0,0,0,0|2,0,0]=2 15 B3R0.2 C(=O)(N)N CHEBI:16199 [0,0,0,0,0,0|2,0,0]=2 16 B3R0.2 C(=O)(N)N CHEBI:75178 [0,0,0,0,0,0|2,0,0]=2 17 B3R0.2 C(=O)(N)O CHEBI:28616 [0,0,0,0,0,0|1,0,0]=1 18 B3R0.2 C(=O)(N)[O-] CHEBI:13941 [0,0,0,0,0,0|1,0,1]=2 19 B3R0.2 C(=O)(O)O CHEBI:28976 [0,0,0,0,0,0|1,0,0]=1 20 B3R0.2 C(=O)(O)S CHEBI:36959 [0,0,0,0,0,0|1,0,0]=1 21 B3R0.2 C(=O)(O)[O-] CHEBI:17544 [0,0,0,0,0,0|1,0,0]=1 22 B3R0.2 C(=O)(O)[O-] CHEBI:32139 [0,0,0,0,0,0|1,0,0]=1 23 B3R0.2 C(=O)(O)[O-] CHEBI:81862 [0,0,0,0,0,0|1,0,0]=1 24 B3R0.2 C(=O)(O)[O] CHEBI:29789 [0,0,0,0,0,0|1,0,0]=1 25 B3R0.2 C(=O)(S)S CHEBI:36966 [0,0,0,0,0,0|1,1,0]=2 26 B3R0.2 C(=O)([O-])[O-] CHEBI:131526 [0,0,0,0,0,0|1,0,1]=2 27 B3R0.2 C(=O)([O-])[O-] CHEBI:29377 [0,0,0,0,0,0|1,0,1]=2 28 B3R0.2 C(=O)([O-])[O-] CHEBI:31793 [0,0,0,0,0,0|1,0,1]=2 29 B3R0.2 C(=O)([O-])[O-] CHEBI:3311 [0,0,0,0,0,0|1,0,1]=2 30 B3R0.2 C(=O)([O-])[O-] CHEBI:41609 [0,0,0,0,0,0|1,0,1]=2 31 B3R0.2 C(=O)([O-])[O-] CHEBI:6504 [0,0,0,0,0,0|1,0,1]=2 32 B3R0.2 C(=O)([O-])[O-] CHEBI:86235 [0,0,0,0,0,0|1,0,1]=2 33 B3R0.2 C(=O)([O-])[O] CHEBI:29376 [0,0,0,0,0,0|1,0,1]=2 34 B3R0.2 C(=S)(Cl)Cl CHEBI:29366 [0,0,0,0,0,0|2,1,0]=3 35 B3R0.2 C(=S)(N)N CHEBI:36946 [0,0,0,0,0,0|2,1,0]=3 36 B3R0.2 C(=S)(O)O CHEBI:36958 [0,0,0,0,0,0|1,0,1]=2 37 B3R0.2 C(=S)(O)S CHEBI:36965 [0,0,0,0,0,0|1,1,0]=2 38 B3R0.2 C(=S)(S)S CHEBI:36967 [0,0,0,0,0,0|1,2,0]=3 39 B3R0.2 C(=S)(S)[S-] CHEBI:50556 [0,0,0,0,0,0|1,2,0]=3 40 B3R0.2 C(=S)([S-])[S-] CHEBI:30258 [0,0,0,0,0,0|1,2,0]=3 41 B3R0.2 C(=[NH2+])(N)N CHEBI:30087 [0,0,0,0,0,0|3,0,0]=3 42 B3R0.2 C(=[NH2+])(N)N CHEBI:32735 [0,0,0,0,0,0|3,0,0]=3 43 B3R0.2 C(=[Se])(N)N CHEBI:36957 [0,0,0,0,0,0|2,1,0]=3 44 B3R0.2 C(=[Se])([SeH])[SeH] CHEBI:36968 [0,0,0,0,0,0|1,2,0]=3 45 B3R0.2 C(Br)(Br)Br CHEBI:38682 [0,0,0,0,0,0|3,0,1]=4 46 B3R0.2 C(Cl)(Cl)Br CHEBI:34591 [0,0,0,0,0,0|3,0,1]=4 47 B3R0.2 C(Cl)(Cl)Cl CHEBI:35255 [0,0,0,0,0,0|3,0,1]=4 48 B3R0.2 C(F)(F)F CHEBI:41550 [0,0,0,0,0,0|3,0,1]=4 49 B3R0.2 C(I)(I)I CHEBI:37758 [0,0,0,0,0,0|3,0,1]=4 50 B3R0.2 C=C(Cl)Cl CHEBI:34031 [0,0,0,0,0,0|2,0,1]=3 51 B3R0.2 CC(=C)C CHEBI:43907 [0,0,0,0,0,0|2,0,0]=2 52 B3R0.2 CC(=N)N CHEBI:38478 [0,0,0,0,0,0|2,0,0]=2 53 B3R0.2 CC(=N)O CHEBI:49028 [0,0,0,0,0,0|1,0,0]=1 54 B3R0.2 CC(=O)C CHEBI:15347 [0,0,0,0,0,0|1,0,0]=1 55 B3R0.2 CC(=O)Cl CHEBI:37580 [0,0,0,0,0,0|1,0,0]=1 56 B3R0.2 CC(=O)N CHEBI:27856 [0,0,0,0,0,0|1,0,0]=1 57 B3R0.2 CC(=O)O CHEBI:132481 [0,0,0,0,0,0|0,0,0]=0 58 B3R0.2 CC(=O)O CHEBI:15366 [0,0,0,0,0,0|0,0,0]=0 59 B3R0.2 CC(=O)S CHEBI:16555 [0,0,0,0,0,0|0,1,0]=1 60 B3R0.2 CC(=O)[O-] CHEBI:30089 [0,0,0,0,0,0|0,0,1]=1 61 B3R0.2 CC(=O)[O-] CHEBI:32029 [0,0,0,0,0,0|0,0,1]=1 62 B3R0.2 CC(=O)[O-] CHEBI:32138 [0,0,0,0,0,0|0,0,1]=1 63 B3R0.2 CC(=O)[O-] CHEBI:32954 [0,0,0,0,0,0|0,0,1]=1 64 B3R0.2 CC(=O)[O-] CHEBI:3310 [0,0,0,0,0,0|0,0,1]=1 65 B3R0.2 CC(=O)[O-] CHEBI:59199 [0,0,0,0,0,0|0,0,1]=1 66 B3R0.2 CC(=O)[O-] CHEBI:62947 [0,0,0,0,0,0|0,0,1]=1 67 B3R0.2 CC(=O)[O-] CHEBI:62964 [0,0,0,0,0,0|0,0,1]=1 68 B3R0.2 CC(=O)[O-] CHEBI:62984 [0,0,0,0,0,0|0,0,1]=1 69 B3R0.2 CC(=O)[O-] CHEBI:63045 [0,0,0,0,0,0|0,0,1]=1 70 B3R0.2 CC(=O)[O-] CHEBI:63078 [0,0,0,0,0,0|0,0,1]=1 71 B3R0.2 CC(=O)[O-] CHEBI:63879 [0,0,0,0,0,0|0,0,1]=1 72 B3R0.2 CC(=O)[O-] CHEBI:75192 [0,0,0,0,0,0|0,0,1]=1 73 B3R0.2 CC(=O)[O-] CHEBI:85138 [0,0,0,0,0,0|0,0,1]=1 74 B3R0.2 CC(=O)[S-] CHEBI:30320 [0,0,0,0,0,0|0,1,0]=1 75 B3R0.2 CC(=S)C CHEBI:36580 [0,0,0,0,0,0|1,1,0]=2 76 B3R0.2 CC(=S)N CHEBI:32497 [0,0,0,0,0,0|1,1,0]=2 77 B3R0.2 CC(=S)O CHEBI:46800 [0,0,0,0,0,0|0,1,0]=1 78 B3R0.2 CC(C)C CHEBI:30363 [0,0,0,0,0,0|2,0,1]=3 79 B3R0.2 CC(C)N CHEBI:15739 [0,0,0,0,0,0|2,0,1]=3 80 B3R0.2 CC(C)O CHEBI:17824 [0,0,0,0,0,0|1,0,1]=2 81 B3R0.2 CC(C)S CHEBI:8474 [0,0,0,0,0,0|1,1,1]=3 82 B3R0.2 CC(C)[NH3+] CHEBI:57492 [0,0,0,0,0,0|2,0,1]=3 83 B3R0.2 CN(C)C CHEBI:18139 [0,0,0,0,0,0|3,0,0]=3 84 B3R0.2 CN(C)C CHEBI:64700 [0,0,0,0,0,0|3,0,0]=3 85 B3R0.2 CN(C)N CHEBI:18853 [0,0,0,0,0,0|3,0,0]=3 86 B3R0.2 CP(C)C CHEBI:35890 [0,0,0,0,0,0|3,0,0]=3 87 B3R0.2 CS(=O)C CHEBI:28262 [0,0,0,0,0,0|2,0,0]=2 88 B3R0.2 CS(=O)O CHEBI:133897 [0,0,0,0,0,0|1,0,0]=1 89 B3R0.2 CS(=O)[O-] CHEBI:133603 [0,0,0,0,0,0|1,0,1]=2 90 B3R0.2 C[As](C)C CHEBI:27130 [0,0,0,0,0,0|3,0,0]=3 91 B3R0.2 C[As](C)O CHEBI:23808 [0,0,0,0,0,0|2,0,0]=2 92 B3R0.2 C[As](O)O CHEBI:17826 [0,0,0,0,0,0|1,0,1]=2 93 B3R0.2 C[As]([O-])[O-] CHEBI:14597 [0,0,0,0,0,0|1,0,2]=3 94 B3R0.2 C[N+](=O)[O-] CHEBI:77701 [0,0,0,0,0,0|1,0,1]=2 95 B3R0.2 C[NH+](C)C CHEBI:58389 [0,0,0,0,0,0|3,0,0]=3 96 B3R0.2 C[S+](C)C CHEBI:17434 [0,0,0,0,0,0|3,0,0]=3 97 B3R0.2 C[Se+](C)C CHEBI:77058 [0,0,0,0,0,0|3,0,0]=3 98 B3R0.2 C[Se](=O)O CHEBI:77012 [0,0,0,0,0,0|1,0,0]=1 99 B3R0.2 C[SnH](C)C CHEBI:63948 [0,0,0,0,0,0|3,0,0]=3 100 B3R0.2 Cl[As](Cl)Cl CHEBI:63952 [0,0,0,0,0,0|4,0,0]=4 101 B3R0.2 Cl[Au](Cl)Cl CHEBI:30076 [0,0,0,0,0,0|4,0,0]=4 102 B3R0.2 Cl[Ce](Cl)Cl CHEBI:35458 [0,0,0,0,0,0|4,0,0]=4 103 B3R0.2 Cl[Fe-](Cl)Cl CHEBI:30810 [0,0,0,0,0,0|4,0,0]=4 104 B3R0.2 Cl[Fe](Cl)Cl CHEBI:30808 [0,0,0,0,0,0|4,0,0]=4 105 B3R0.2 Cl[Fe](Cl)Cl CHEBI:86254 [0,0,0,0,0,0|4,0,0]=4 106 B3R0.2 Cl[Gd](Cl)Cl CHEBI:37288 [0,0,0,0,0,0|4,0,0]=4 107 B3R0.2 Cl[Mo](Cl)Cl CHEBI:30626 [0,0,0,0,0,0|4,0,0]=4 108 B3R0.2 Cl[Ni-](Cl)Cl CHEBI:30388 [0,0,0,0,0,0|4,0,0]=4 109 B3R0.2 Cl[Sb](Cl)Cl CHEBI:74856 [0,0,0,0,0,0|4,0,0]=4 110 B3R0.2 Cl[Sn-](Cl)Cl CHEBI:30474 [0,0,0,0,0,0|4,0,0]=4 111 B3R0.2 FCl(F)F CHEBI:30123 [0,0,0,0,0,0|4,0,0]=4 112 B3R0.2 FP(F)F CHEBI:30205 [0,0,0,0,0,0|4,0,0]=4 113 B3R0.2 F[Ag](F)F CHEBI:30338 [0,0,0,0,0,0|4,0,0]=4 114 B3R0.2 F[Al](F)F CHEBI:49464 [0,0,0,0,0,0|4,0,0]=4 115 B3R0.2 F[Au](F)F CHEBI:30077 [0,0,0,0,0,0|4,0,0]=4 116 B3R0.2 F[Mg-](F)F CHEBI:49739 [0,0,0,0,0,0|4,0,0]=4 117 B3R0.2 F[Mo](F)F CHEBI:30625 [0,0,0,0,0,0|4,0,0]=4 118 B3R0.2 F[Ni-](F)F CHEBI:30389 [0,0,0,0,0,0|4,0,0]=4 119 B3R0.2 I[Hg-](I)I CHEBI:36569 [0,0,0,0,0,0|4,0,0]=4 120 B3R0.2 I[Hg-](I)I CHEBI:51567 [0,0,0,0,0,0|4,0,0]=4 121 B3R0.2 N(=O)(=O)[O-] CHEBI:32130 [0,0,0,0,0,0|2,0,1]=3 122 B3R0.2 N(Cl)(Cl)Cl CHEBI:37382 [0,0,0,0,0,0|4,0,0]=4 123 B3R0.2 N(F)(F)Cl CHEBI:37383 [0,0,0,0,0,0|4,0,0]=4 124 B3R0.2 N(F)(F)F CHEBI:30231 [0,0,0,0,0,0|4,0,0]=4 125 B3R0.2 N([O-])([O-])[O] CHEBI:29795 [0,0,0,0,0,0|2,0,2]=4 126 B3R0.2 NP(O)O CHEBI:59748 [0,0,0,0,0,0|2,0,1]=3 127 B3R0.2 NS(=N)O CHEBI:51964 [0,0,0,0,0,0|3,0,0]=3 128 B3R0.2 N[N+](=O)[O-] CHEBI:29273 [0,0,0,0,0,0|2,0,1]=3 129 B3R0.2 O=Br(=O)[O] CHEBI:29887 [0,0,0,0,0,0|2,0,1]=3 130 B3R0.2 O=Cl(=O)[O] CHEBI:29416 [0,0,0,0,0,0|2,0,1]=3 131 B3R0.2 O=I(=O)[O] CHEBI:29906 [0,0,0,0,0,0|2,0,1]=3 132 B3R0.2 O=S(=O)=O CHEBI:29384 [0,0,0,0,0,0|2,0,1]=3 133 B3R0.2 O=S(Cl)Cl CHEBI:29290 [0,0,0,0,0,0|3,0,0]=3 134 B3R0.2 O=[Br+](=O)=O CHEBI:29886 [0,0,0,0,0,0|2,0,1]=3 135 B3R0.2 O=[Cl+](=O)=O CHEBI:29417 [0,0,0,0,0,0|2,0,1]=3 136 B3R0.2 O=[Cr](=O)=O CHEBI:48240 [0,0,0,0,0,0|2,0,1]=3 137 B3R0.2 O=[I+](=O)=O CHEBI:29907 [0,0,0,0,0,0|2,0,1]=3 138 B3R0.2 O=[Mo](=O)=O CHEBI:30627 [0,0,0,0,0,0|2,0,1]=3 139 B3R0.2 O=[Mo](=O)S CHEBI:47566 [0,0,0,0,0,0|2,0,1]=3 140 B3R0.2 O=[Zr](Cl)Cl CHEBI:53479 [0,0,0,0,0,0|3,0,0]=3 141 B3R0.2 OBr(=O)=O CHEBI:49382 [0,0,0,0,0,0|2,0,0]=2 142 B3R0.2 OCl(=O)=O CHEBI:17322 [0,0,0,0,0,0|2,0,0]=2 143 B3R0.2 OI(=O)=O CHEBI:24857 [0,0,0,0,0,0|2,0,0]=2 144 B3R0.2 OP(=O)O CHEBI:44976 [0,0,0,0,0,0|2,0,0]=2 145 B3R0.2 OP(=O)[O-] CHEBI:33462 [0,0,0,0,0,0|2,0,0]=2 146 B3R0.2 OP(=S)O CHEBI:50151 [0,0,0,0,0,0|2,0,1]=3 147 B3R0.2 OP(O)O CHEBI:36361 [0,0,0,0,0,0|2,0,1]=3 148 B3R0.2 OP(O)[O-] CHEBI:29258 [0,0,0,0,0,0|2,0,1]=3 149 B3R0.2 OP([O-])[O-] CHEBI:29259 [0,0,0,0,0,0|2,0,1]=3 150 B3R0.2 OP([O-])[O] CHEBI:29927 [0,0,0,0,0,0|2,0,1]=3 151 B3R0.2 OS(=O)=O CHEBI:29214 [0,0,0,0,0,0|2,0,0]=2 152 B3R0.2 OS(=O)O CHEBI:48854 [0,0,0,0,0,0|2,0,0]=2 153 B3R0.2 OS(=O)S CHEBI:35926 [0,0,0,0,0,0|2,0,0]=2 154 B3R0.2 OS(=O)[O-] CHEBI:17137 [0,0,0,0,0,0|2,0,0]=2 155 B3R0.2 OS(=O)[O-] CHEBI:26709 [0,0,0,0,0,0|2,0,0]=2 156 B3R0.2 OS(=O)[S-] CHEBI:35945 [0,0,0,0,0,0|2,0,0]=2 157 B3R0.2 OS(=S)O CHEBI:50152 [0,0,0,0,0,0|2,0,1]=3 158 B3R0.2 O[Al](O)O CHEBI:33130 [0,0,0,0,0,0|2,0,1]=3 159 B3R0.2 O[AsH](=O)O CHEBI:29850 [0,0,0,0,0,0|2,0,0]=2 160 B3R0.2 O[AsH](=O)[O-] CHEBI:64448 [0,0,0,0,0,0|2,0,0]=2 161 B3R0.2 O[As](O)O CHEBI:49900 [0,0,0,0,0,0|2,0,1]=3 162 B3R0.2 O[As](O)[O-] CHEBI:29242 [0,0,0,0,0,0|2,0,1]=3 163 B3R0.2 O[As]([O-])[O-] CHEBI:29243 [0,0,0,0,0,0|2,0,1]=3 164 B3R0.2 O[SbH](=O)O CHEBI:30298 [0,0,0,0,0,0|2,0,0]=2 165 B3R0.2 O[Sb](O)O CHEBI:49870 [0,0,0,0,0,0|2,0,1]=3 166 B3R0.2 O[SeH](=O)=O CHEBI:29217 [0,0,0,0,0,0|2,0,0]=2 167 B3R0.2 O[Se](=O)O CHEBI:26642 [0,0,0,0,0,0|2,0,0]=2 168 B3R0.2 O[Se](=O)[O-] CHEBI:29924 [0,0,0,0,0,0|2,0,0]=2 169 B3R0.2 O[TeH](=O)=O CHEBI:30466 [0,0,0,0,0,0|2,0,0]=2 170 B3R0.2 O[Te](=O)O CHEBI:30465 [0,0,0,0,0,0|2,0,0]=2 171 B3R0.2 O[Te](=O)[O-] CHEBI:33522 [0,0,0,0,0,0|2,0,0]=2 172 B3R0.2 P(Cl)(Cl)Cl CHEBI:30334 [0,0,0,0,0,0|4,0,0]=4 173 B3R0.2 [*]B(O)O CHEBI:38269 [0,0,0,0,0,0|2,0,1]=3 174 B3R0.2 [*]B([*])O CHEBI:38270 [0,0,0,0,0,0|3,0,0]=3 175 B3R0.2 [*]C(=O)O CHEBI:33575 [0,0,0,0,0,0|1,0,0]=1 176 B3R0.2 [*]C(=O)[*] CHEBI:17087 [0,0,0,0,0,0|2,0,0]=2 177 B3R0.2 [*]C(=O)[O-] CHEBI:78892 [0,0,0,0,0,0|1,0,1]=2 178 B3R0.2 [*]C(=O)[O-] CHEBI:78893 [0,0,0,0,0,0|1,0,1]=2 179 B3R0.2 [*]C(=O)[O-] CHEBI:90582 [0,0,0,0,0,0|1,0,1]=2 180 B3R0.2 [*]C(=S)[*] CHEBI:36579 [0,0,0,0,0,0|2,1,0]=3 181 B3R0.2 [*]C(O)O CHEBI:63733 [0,0,0,0,0,0|1,0,2]=3 182 B3R0.2 [*]N([*])[*] CHEBI:32876 [0,0,0,0,0,0|4,0,0]=4 183 B3R0.2 [13C](=O)(N)N CHEBI:32285 [0,0,0,0,0,0|2,0,0]=2 184 B3R0.2 [Al](Cl)(Cl)Cl CHEBI:30114 [0,0,0,0,0,0|4,0,0]=4 185 B3R0.2 [Al](Cl)(Cl)Cl CHEBI:30115 [0,0,0,0,0,0|4,0,0]=4 186 B3R0.2 [Be-](F)(F)F CHEBI:30498 [0,0,0,0,0,0|4,0,0]=4 187 B3R0.2 [C](Cl)(Cl)Cl CHEBI:30737 [0,0,0,0,0,0|3,0,1]=4 188 B3R0.2 [Li]C(=C)C CHEBI:51485 [0,0,0,0,0,0|2,0,0]=2 189 B3R0.2 [Li]C(=C)F CHEBI:51483 [0,0,0,0,0,0|2,0,1]=3 190 B3R0.2 [Li]N([Li])[Li] CHEBI:30525 [0,0,0,0,0,0|4,0,0]=4 191 B3R0.2 [N+](=O)(O)[O-] CHEBI:48107 [0,0,0,0,0,0|2,0,0]=2 192 B3R0.2 [N+](=O)([O-])[O-] CHEBI:17632 [0,0,0,0,0,0|2,0,1]=3 193 B3R0.2 [N+](=O)([O-])[O-] CHEBI:63005 [0,0,0,0,0,0|2,0,1]=3 194 B3R0.2 [N+](=O)([O-])[O-] CHEBI:63038 [0,0,0,0,0,0|2,0,1]=3 195 B3R0.2 [N+](=O)([O-])[O-] CHEBI:63043 [0,0,0,0,0,0|2,0,1]=3 196 B3R0.2 [N+](=O)([O-])[O-] CHEBI:63315 [0,0,0,0,0,0|2,0,1]=3 197 B3R0.2 [N+](=O)([O-])[O-] CHEBI:63882 [0,0,0,0,0,0|2,0,1]=3 198 B3R0.2 [N+](=O)([O-])[O-] CHEBI:64205 [0,0,0,0,0,0|2,0,1]=3 199 B3R0.2 [N+](=O)([O-])[O-] CHEBI:64736 [0,0,0,0,0,0|2,0,1]=3 200 B3R0.2 [N+](=O)([O-])[O-] CHEBI:77732 [0,0,0,0,0,0|2,0,1]=3 201 B3R0.2 [N+](=O)([O-])[O-] CHEBI:78036 [0,0,0,0,0,0|2,0,1]=3 202 B3R0.2 [N+](=O)([O-])[O-] CHEBI:86156 [0,0,0,0,0,0|2,0,1]=3 203 B3R0.2 [N+](=O)([O-])[O-] CHEBI:86159 [0,0,0,0,0,0|2,0,1]=3 204 B3R0.2 [N+](=O)([O-])[O-] CHEBI:86204 [0,0,0,0,0,0|2,0,1]=3 205 B3R0.2 [N+](=O)([O-])[O-] CHEBI:86206 [0,0,0,0,0,0|2,0,1]=3 206 B3R0.2 [N+](=O)([O-])[O-] CHEBI:86209 [0,0,0,0,0,0|2,0,1]=3 207 B3R0.2 [N+](=O)([O-])[O-] CHEBI:86214 [0,0,0,0,0,0|2,0,1]=3 208 B3R0.2 [N+](=O)([O-])[O] CHEBI:29329 [0,0,0,0,0,0|2,0,1]=3 209 B3R0.2 [NH+](O)(O)[O-] CHEBI:37769 [0,0,0,0,0,0|2,0,1]=3 210 B3R0.2 [O-]Br(=O)=O CHEBI:29223 [0,0,0,0,0,0|2,0,1]=3 211 B3R0.2 [O-]Br(=O)=O CHEBI:38211 [0,0,0,0,0,0|2,0,1]=3 212 B3R0.2 [O-]Br(=O)=O CHEBI:75229 [0,0,0,0,0,0|2,0,1]=3 213 B3R0.2 [O-]Cl(=O)=O CHEBI:49709 [0,0,0,0,0,0|2,0,1]=3 214 B3R0.2 [O-]Cl(=O)=O CHEBI:65242 [0,0,0,0,0,0|2,0,1]=3 215 B3R0.2 [O-]F(=O)=O CHEBI:132769 [0,0,0,0,0,0|2,0,1]=3 216 B3R0.2 [O-]I(=O)=O CHEBI:29226 [0,0,0,0,0,0|2,0,1]=3 217 B3R0.2 [O-]P(=O)=O CHEBI:30932 [0,0,0,0,0,0|2,0,1]=3 218 B3R0.2 [O-]P(=O)[O-] CHEBI:16215 [0,0,0,0,0,0|2,0,1]=3 219 B3R0.2 [O-]P([O-])[O-] CHEBI:45064 [0,0,0,0,0,0|2,0,2]=4 220 B3R0.2 [O-]P([O-])[O] CHEBI:29930 [0,0,0,0,0,0|2,0,2]=4 221 B3R0.2 [O-]S(=O)=O CHEBI:33543 [0,0,0,0,0,0|2,0,1]=3 222 B3R0.2 [O-]S(=O)S CHEBI:35943 [0,0,0,0,0,0|2,0,1]=3 223 B3R0.2 [O-]S(=O)[O-] CHEBI:17359 [0,0,0,0,0,0|2,0,1]=3 224 B3R0.2 [O-]S(=O)[O-] CHEBI:86477 [0,0,0,0,0,0|2,0,1]=3 225 B3R0.2 [O-]S(=O)[O] CHEBI:29405 [0,0,0,0,0,0|2,0,1]=3 226 B3R0.2 [O-]S(=O)[S-] CHEBI:29257 [0,0,0,0,0,0|2,0,1]=3 227 B3R0.2 [O-][AsH](=O)[O-] CHEBI:29754 [0,0,0,0,0,0|2,0,1]=3 228 B3R0.2 [O-][As]([O-])[O-] CHEBI:29866 [0,0,0,0,0,0|2,0,2]=4 229 B3R0.2 [O-][Sb]([O-])[O-] CHEBI:30297 [0,0,0,0,0,0|2,0,2]=4 230 B3R0.2 [O-][Se](=O)[O-] CHEBI:131361 [0,0,0,0,0,0|2,0,1]=3 231 B3R0.2 [O-][Se](=O)[O-] CHEBI:18212 [0,0,0,0,0,0|2,0,1]=3 232 B3R0.2 [O-][Se](=O)[O-] CHEBI:48843 [0,0,0,0,0,0|2,0,1]=3 233 B3R0.2 [O-][Si](=O)[O-] CHEBI:132108 [0,0,0,0,0,0|1,1,1]=3 234 B3R0.2 [O-][Si](=O)[O-] CHEBI:60720 [0,0,0,0,0,0|1,1,1]=3 235 B3R0.2 [O-][Si](=O)[O] CHEBI:30199 [0,0,0,0,0,0|1,1,1]=3 236 B3R0.2 [O-][Te](=O)[O-] CHEBI:30477 [0,0,0,0,0,0|2,0,1]=3 237 B3R0.2 [O-][Te](=O)[O-] CHEBI:75248 [0,0,0,0,0,0|2,0,1]=3 238 B3R0.2 [O-][Te](=O)[O] CHEBI:30478 [0,0,0,0,0,0|2,0,1]=3 239 B3R0.2 [O-][V](=O)=O CHEBI:132095 [0,0,0,0,0,0|2,0,1]=3 240 B3R0.2 [O-][V](=O)=O CHEBI:132765 [0,0,0,0,0,0|2,0,1]=3 241 B3R0.2 [O-][V](=O)=O CHEBI:75221 [0,0,0,0,0,0|2,0,1]=3 242 B3R0.2 [O-][V](=O)=O CHEBI:75224 [0,0,0,0,0,0|2,0,1]=3 243 B2R0.1 B(=O)[O-] CHEBI:75227 [1,0,0,0,0,0|1,0,1]=3 244 B2R0.1 B(O)O CHEBI:38267 [1,0,0,0,0,0|1,0,1]=3 245 B2R0.1 BB=B CHEBI:33603 [1,0,0,0,0,0|3,0,0]=4 246 B2R0.1 BBB CHEBI:33602 [1,0,0,0,0,0|3,0,0]=4 247 B2R0.1 Br[Hg]Br CHEBI:49639 [1,0,0,0,0,0|3,0,0]=4 248 B2R0.1 C#N=S CHEBI:29428 [1,0,0,0,0,0|1,1,1]=4 249 B2R0.1 C#N=[Se] CHEBI:29777 [1,0,0,0,0,0|1,1,1]=4 250 B2R0.1 C#[N+][O-] CHEBI:29813 [1,0,0,0,0,0|1,0,2]=4 251 B2R0.1 C(#N)N CHEBI:16698 [1,0,0,0,0,0|2,0,1]=4 252 B2R0.1 C(#N)O CHEBI:28024 [1,0,0,0,0,0|1,0,1]=3 253 B2R0.1 C(#N)S CHEBI:29200 [1,0,0,0,0,0|1,1,1]=4 254 B2R0.1 C(#N)[O-] CHEBI:29195 [1,0,0,0,0,0|1,0,2]=4 255 B2R0.1 C(#N)[O] CHEBI:29808 [1,0,0,0,0,0|1,0,2]=4 256 B2R0.1 C(#N)[S-] CHEBI:18022 [1,0,0,0,0,0|1,1,1]=4 257 B2R0.1 C(#N)[S-] CHEBI:30951 [1,0,0,0,0,0|1,1,1]=4 258 B2R0.1 C(#N)[S-] CHEBI:30952 [1,0,0,0,0,0|1,1,1]=4 259 B2R0.1 C(#N)[S] CHEBI:29425 [1,0,0,0,0,0|1,1,1]=4 260 B2R0.1 C(#N)[Se-] CHEBI:29445 [1,0,0,0,0,0|1,1,1]=4 261 B2R0.1 C(#N)[SeH] CHEBI:29778 [1,0,0,0,0,0|1,1,1]=4 262 B2R0.1 C(#N)[Se] CHEBI:29442 [1,0,0,0,0,0|1,1,1]=4 263 B2R0.1 C(#N)[Te-] CHEBI:36837 [1,0,0,0,0,0|1,1,1]=4 264 B2R0.1 C(#N)[TeH] CHEBI:36833 [1,0,0,0,0,0|1,1,1]=4 265 B2R0.1 C(=N)=N CHEBI:87623 [1,0,0,0,0,0|2,0,1]=4 266 B2R0.1 C(=N)=O CHEBI:29202 [1,0,0,0,0,0|1,0,1]=3 267 B2R0.1 C(=N)=S CHEBI:24928 [1,0,0,0,0,0|1,1,1]=4 268 B2R0.1 C(=N)=[Se] CHEBI:29779 [1,0,0,0,0,0|1,1,1]=4 269 B2R0.1 C(=N)=[Te] CHEBI:36839 [1,0,0,0,0,0|1,1,1]=4 270 B2R0.1 C(=N)N CHEBI:38477 [1,0,0,0,0,0|2,0,0]=3 271 B2R0.1 C(=N)O CHEBI:48431 [1,0,0,0,0,0|1,0,0]=2 272 B2R0.1 C(=O)=O CHEBI:16526 [1,0,0,0,0,0|0,0,2]=3 273 B2R0.1 C(=O)=S CHEBI:16573 [1,0,0,0,0,0|0,1,1]=3 274 B2R0.1 C(=O)N CHEBI:16397 [1,0,0,0,0,0|1,0,0]=2 275 B2R0.1 C(=O)O CHEBI:30751 [1,0,0,0,0,0|0,0,0]=1 276 B2R0.1 C(=O)[O-] CHEBI:15740 [1,0,0,0,0,0|0,0,1]=2 277 B2R0.1 C(=O)[O-] CHEBI:62965 [1,0,0,0,0,0|0,0,1]=2 278 B2R0.1 C(=O)[O-] CHEBI:63006 [1,0,0,0,0,0|0,0,1]=2 279 B2R0.1 C(=O)[O-] CHEBI:63050 [1,0,0,0,0,0|0,0,1]=2 280 B2R0.1 C(=O)[O-] CHEBI:63316 [1,0,0,0,0,0|0,0,1]=2 281 B2R0.1 C(=S)=S CHEBI:23012 [1,0,0,0,0,0|0,2,1]=4 282 B2R0.1 C(=[N-])=[N-] CHEBI:64301 [1,0,0,0,0,0|2,0,1]=4 283 B2R0.1 C(=[N-])=[N-] CHEBI:64302 [1,0,0,0,0,0|2,0,1]=4 284 B2R0.1 C(Br)Br CHEBI:47077 [1,0,0,0,0,0|2,0,1]=4 285 B2R0.1 C(Cl)Br CHEBI:17194 [1,0,0,0,0,0|2,0,1]=4 286 B2R0.1 C(Cl)Cl CHEBI:15767 [1,0,0,0,0,0|2,0,1]=4 287 B2R0.1 C(F)F CHEBI:47855 [1,0,0,0,0,0|2,0,1]=4 288 B2R0.1 C(N)N CHEBI:35413 [1,0,0,0,0,0|2,0,1]=4 289 B2R0.1 C(O)O CHEBI:48397 [1,0,0,0,0,0|0,0,2]=3 290 B2R0.1 C=C=C CHEBI:37601 [1,0,0,0,0,0|1,0,2]=4 291 B2R0.1 C=C=O CHEBI:48003 [1,0,0,0,0,0|0,0,2]=3 292 B2R0.1 C=CBr CHEBI:51311 [1,0,0,0,0,0|1,0,1]=3 293 B2R0.1 C=CCl CHEBI:28509 [1,0,0,0,0,0|1,0,1]=3 294 B2R0.1 C=CF CHEBI:51314 [1,0,0,0,0,0|1,0,1]=3 295 B2R0.1 C=CI CHEBI:51315 [1,0,0,0,0,0|1,0,1]=3 296 B2R0.1 C=[N+]=[N-] CHEBI:73716 [1,0,0,0,0,0|2,0,1]=4 297 B2R0.1 CC#C CHEBI:48086 [1,0,0,0,0,0|1,0,1]=3 298 B2R0.1 CC#N CHEBI:38472 [1,0,0,0,0,0|1,0,1]=3 299 B2R0.1 CC=C CHEBI:16052 [1,0,0,0,0,0|1,0,0]=2 300 B2R0.1 CC=O CHEBI:15343 [1,0,0,0,0,0|0,0,0]=1 301 B2R0.1 CC=O CHEBI:16571 [1,0,0,0,0,0|0,0,0]=1 302 B2R0.1 CCC CHEBI:32879 [1,0,0,0,0,0|1,0,1]=3 303 B2R0.1 CCCl CHEBI:47554 [1,0,0,0,0,0|1,0,1]=3 304 B2R0.1 CCI CHEBI:42487 [1,0,0,0,0,0|1,0,1]=3 305 B2R0.1 CCN CHEBI:15862 [1,0,0,0,0,0|1,0,1]=3 306 B2R0.1 CCO CHEBI:16236 [1,0,0,0,0,0|0,0,1]=2 307 B2R0.1 CCO CHEBI:17246 [1,0,0,0,0,0|0,0,1]=2 308 B2R0.1 CCP CHEBI:35889 [1,0,0,0,0,0|1,0,1]=3 309 B2R0.1 CC[Hg+] CHEBI:33204 [1,0,0,0,0,0|1,0,1]=3 310 B2R0.1 CC[NH3+] CHEBI:566789 [1,0,0,0,0,0|1,0,1]=3 311 B2R0.1 CC[NH3+] CHEBI:63880 [1,0,0,0,0,0|1,0,1]=3 312 B2R0.1 CC[O-] CHEBI:52092 [1,0,0,0,0,0|0,0,2]=3 313 B2R0.1 CC[O-] CHEBI:52096 [1,0,0,0,0,0|0,0,2]=3 314 B2R0.1 CNC CHEBI:17170 [1,0,0,0,0,0|2,0,0]=3 315 B2R0.1 COC CHEBI:28887 [1,0,0,0,0,0|2,0,0]=3 316 B2R0.1 CPC CHEBI:35888 [1,0,0,0,0,0|2,0,0]=3 317 B2R0.1 CSC CHEBI:17437 [1,0,0,0,0,0|2,0,0]=3 318 B2R0.1 CSO CHEBI:48272 [1,0,0,0,0,0|1,0,0]=2 319 B2R0.1 C[C]=O CHEBI:46887 [1,0,0,0,0,0|0,0,1]=2 320 B2R0.1 C[Hg]C CHEBI:30786 [1,0,0,0,0,0|2,0,0]=3 321 B2R0.1 C[Hg]Cl CHEBI:28216 [1,0,0,0,0,0|2,0,0]=3 322 B2R0.1 C[Mg]Cl CHEBI:51492 [1,0,0,0,0,0|2,0,0]=3 323 B2R0.1 C[N+]#[C-] CHEBI:44177 [1,0,0,0,0,0|2,0,0]=3 324 B2R0.1 C[NH2+]C CHEBI:58040 [1,0,0,0,0,0|2,0,0]=3 325 B2R0.1 C[Se]C CHEBI:4610 [1,0,0,0,0,0|2,0,0]=3 326 B2R0.1 C[Se]O CHEBI:77062 [1,0,0,0,0,0|1,0,0]=2 327 B2R0.1 C[SnH2]C CHEBI:30538 [1,0,0,0,0,0|2,0,0]=3 328 B2R0.1 C[Sn]C CHEBI:30539 [1,0,0,0,0,0|2,0,0]=3 329 B2R0.1 C[Te]C CHEBI:4613 [1,0,0,0,0,0|2,0,0]=3 330 B2R0.1 C[Zn]C CHEBI:51497 [1,0,0,0,0,0|2,0,0]=3 331 B2R0.1 Cl[223Ra]Cl CHEBI:74895 [1,0,0,0,0,0|3,0,0]=4 332 B2R0.1 Cl[Cd]Cl CHEBI:35456 [1,0,0,0,0,0|3,0,0]=4 333 B2R0.1 Cl[Cd]Cl CHEBI:63938 [1,0,0,0,0,0|3,0,0]=4 334 B2R0.1 Cl[Cu]Cl CHEBI:49553 [1,0,0,0,0,0|3,0,0]=4 335 B2R0.1 Cl[Cu]Cl CHEBI:86318 [1,0,0,0,0,0|3,0,0]=4 336 B2R0.1 Cl[Cu]Cl CHEBI:91245 [1,0,0,0,0,0|3,0,0]=4 337 B2R0.1 Cl[Fe]Cl CHEBI:30812 [1,0,0,0,0,0|3,0,0]=4 338 B2R0.1 Cl[Fe]Cl CHEBI:86249 [1,0,0,0,0,0|3,0,0]=4 339 B2R0.1 Cl[Hg]Cl CHEBI:31823 [1,0,0,0,0,0|3,0,0]=4 340 B2R0.1 Cl[Mn]Cl CHEBI:131395 [1,0,0,0,0,0|3,0,0]=4 341 B2R0.1 Cl[Mn]Cl CHEBI:63041 [1,0,0,0,0,0|3,0,0]=4 342 B2R0.1 Cl[Mn]Cl CHEBI:86368 [1,0,0,0,0,0|3,0,0]=4 343 B2R0.1 Cl[Ni]Cl CHEBI:34887 [1,0,0,0,0,0|3,0,0]=4 344 B2R0.1 Cl[Pb]Cl CHEBI:88212 [1,0,0,0,0,0|3,0,0]=4 345 B2R0.1 Cl[Pd]Cl CHEBI:53434 [1,0,0,0,0,0|3,0,0]=4 346 B2R0.1 Cl[Pt]Cl CHEBI:49801 [1,0,0,0,0,0|3,0,0]=4 347 B2R0.1 Cl[Sr]Cl CHEBI:36385 [1,0,0,0,0,0|3,0,0]=4 348 B2R0.1 F[Cl-]F CHEBI:30124 [1,0,0,0,0,0|3,0,0]=4 349 B2R0.1 I[Hg]I CHEBI:49659 [1,0,0,0,0,0|3,0,0]=4 350 B2R0.1 N#[N+][O-] CHEBI:17045 [1,0,0,0,0,0|2,0,1]=4 351 B2R0.1 N(=O)O CHEBI:25567 [1,0,0,0,0,0|1,0,0]=2 352 B2R0.1 N(=O)S CHEBI:65308 [1,0,0,0,0,0|1,1,0]=3 353 B2R0.1 N(=O)[O-] CHEBI:16301 [1,0,0,0,0,0|1,0,1]=3 354 B2R0.1 N(=O)[O-] CHEBI:78870 [1,0,0,0,0,0|1,0,1]=3 355 B2R0.1 N=S=O CHEBI:48872 [1,0,0,0,0,0|2,0,0]=3 356 B2R0.1 N=[N+]=[N-] CHEBI:29449 [1,0,0,0,0,0|3,0,0]=4 357 B2R0.1 NN=N CHEBI:35468 [1,0,0,0,0,0|3,0,0]=4 358 B2R0.1 NNN CHEBI:50155 [1,0,0,0,0,0|3,0,0]=4 359 B2R0.1 N[Zn]N CHEBI:49558 [1,0,0,0,0,0|3,0,0]=4 360 B2R0.1 O(Cl)Cl CHEBI:30198 [1,0,0,0,0,0|3,0,0]=4 361 B2R0.1 O(F)F CHEBI:30494 [1,0,0,0,0,0|3,0,0]=4 362 B2R0.1 O([Fe])[Fe] CHEBI:47411 [1,0,0,0,0,0|3,0,0]=4 363 B2R0.1 O([SiH3])[SiH3] CHEBI:48141 [1,0,0,0,0,0|2,1,0]=4 364 B2R0.1 O=Br=O CHEBI:29874 [1,0,0,0,0,0|1,0,1]=3 365 B2R0.1 O=Cl=O CHEBI:29415 [1,0,0,0,0,0|1,0,1]=3 366 B2R0.1 O=ClF CHEBI:30127 [1,0,0,0,0,0|2,0,0]=3 367 B2R0.1 O=I=O CHEBI:29901 [1,0,0,0,0,0|1,0,1]=3 368 B2R0.1 O=S=O CHEBI:18422 [1,0,0,0,0,0|1,0,1]=3 369 B2R0.1 O=[Br+]=O CHEBI:29880 [1,0,0,0,0,0|1,0,1]=3 370 B2R0.1 O=[Ce]=O CHEBI:79089 [1,0,0,0,0,0|1,0,1]=3 371 B2R0.1 O=[Cl+]=O CHEBI:29418 [1,0,0,0,0,0|1,0,1]=3 372 B2R0.1 O=[Cr]=O CHEBI:48263 [1,0,0,0,0,0|1,0,1]=3 373 B2R0.1 O=[I+]=O CHEBI:29903 [1,0,0,0,0,0|1,0,1]=3 374 B2R0.1 O=[P]=O CHEBI:37370 [1,0,0,0,0,0|1,0,1]=3 375 B2R0.1 O=[Si]=O CHEBI:30563 [1,0,0,0,0,0|0,1,1]=3 376 B2R0.1 O=[Sn]=O CHEBI:52991 [1,0,0,0,0,0|1,0,1]=3 377 B2R0.1 O=[Tc]=O CHEBI:26864 [1,0,0,0,0,0|1,0,1]=3 378 B2R0.1 O=[Th]=O CHEBI:37339 [1,0,0,0,0,0|1,0,1]=3 379 B2R0.1 O=[Ti]=O CHEBI:32234 [1,0,0,0,0,0|1,0,1]=3 380 B2R0.1 O=[U+2]=O CHEBI:43515 [1,0,0,0,0,0|1,0,1]=3 381 B2R0.1 O=[U+]=O CHEBI:29124 [1,0,0,0,0,0|1,0,1]=3 382 B2R0.1 O=[V+]=O CHEBI:30048 [1,0,0,0,0,0|1,0,1]=3 383 B2R0.1 O=[V]=O CHEBI:30047 [1,0,0,0,0,0|1,0,1]=3 384 B2R0.1 OBr=O CHEBI:29247 [1,0,0,0,0,0|1,0,0]=2 385 B2R0.1 OCl=O CHEBI:29219 [1,0,0,0,0,0|1,0,0]=2 386 B2R0.1 OF=O CHEBI:47862 [1,0,0,0,0,0|1,0,0]=2 387 B2R0.1 OI=O CHEBI:29229 [1,0,0,0,0,0|1,0,0]=2 388 B2R0.1 OOO CHEBI:46736 [1,0,0,0,0,0|1,0,1]=3 389 B2R0.1 OO[O] CHEBI:29411 [1,0,0,0,0,0|1,0,1]=3 390 B2R0.1 OO[S] CHEBI:29409 [1,0,0,0,0,0|1,1,0]=3 391 B2R0.1 OP=O CHEBI:36363 [1,0,0,0,0,0|1,0,0]=2 392 B2R0.1 OPO CHEBI:29261 [1,0,0,0,0,0|1,0,1]=3 393 B2R0.1 OS=O CHEBI:29213 [1,0,0,0,0,0|1,0,0]=2 394 B2R0.1 OSO CHEBI:33536 [1,0,0,0,0,0|1,0,1]=3 395 B2R0.1 OS[O-] CHEBI:33538 [1,0,0,0,0,0|1,0,1]=3 396 B2R0.1 OS[O] CHEBI:29408 [1,0,0,0,0,0|1,0,1]=3 397 B2R0.1 O[Al]=O CHEBI:30188 [1,0,0,0,0,0|1,0,0]=2 398 B2R0.1 O[AsH2]=O CHEBI:29840 [1,0,0,0,0,0|1,0,0]=2 399 B2R0.1 O[AsH]O CHEBI:29847 [1,0,0,0,0,0|1,0,1]=3 400 B2R0.1 O[AsH][O-] CHEBI:33410 [1,0,0,0,0,0|1,0,1]=3 401 B2R0.1 O[PH2]=O CHEBI:29031 [1,0,0,0,0,0|1,0,0]=2 402 B2R0.1 O[P][O-] CHEBI:29926 [1,0,0,0,0,0|1,0,1]=3 403 B2R0.1 O[SbH2]=O CHEBI:30300 [1,0,0,0,0,0|1,0,0]=2 404 B2R0.1 O[SbH]O CHEBI:30299 [1,0,0,0,0,0|1,0,1]=3 405 B2R0.1 O[SeH]=O CHEBI:29218 [1,0,0,0,0,0|1,0,0]=2 406 B2R0.1 O[SiH2]O CHEBI:46888 [1,0,0,0,0,0|0,1,1]=3 407 B2R0.1 O[SiH2][SiH3] CHEBI:37174 [1,0,0,0,0,0|0,2,0]=3 408 B2R0.1 O[TeH]=O CHEBI:30467 [1,0,0,0,0,0|1,0,0]=2 409 B2R0.1 PPP CHEBI:35893 [1,0,0,0,0,0|3,0,0]=4 410 B2R0.1 S=S=S CHEBI:17909 [1,0,0,0,0,0|1,2,0]=4 411 B2R0.1 S=S=S CHEBI:29388 [1,0,0,0,0,0|1,2,0]=4 412 B2R0.1 S=[Mo]=S CHEBI:30704 [1,0,0,0,0,0|1,2,0]=4 413 B2R0.1 S=[S+]#[S+] CHEBI:29400 [1,0,0,0,0,0|1,2,0]=4 414 B2R0.1 S=[Sn]=S CHEBI:50886 [1,0,0,0,0,0|1,2,0]=4 415 B2R0.1 S=[W]=S CHEBI:30521 [1,0,0,0,0,0|1,2,0]=4 416 B2R0.1 SSS CHEBI:50365 [1,0,0,0,0,0|1,2,0]=4 417 B2R0.1 SS[S-] CHEBI:30609 [1,0,0,0,0,0|1,2,0]=4 418 B2R0.1 [*]C#C CHEBI:73477 [1,0,0,0,0,0|1,0,2]=4 419 B2R0.1 [*]C=O CHEBI:17478 [1,0,0,0,0,0|1,0,0]=2 420 B2R0.1 [*]CN CHEBI:17062 [1,0,0,0,0,0|2,0,1]=4 421 B2R0.1 [*]CO CHEBI:15734 [1,0,0,0,0,0|1,0,1]=3 422 B2R0.1 [*]N[*] CHEBI:32863 [1,0,0,0,0,0|3,0,0]=4 423 B2R0.1 [*]O[*] CHEBI:25698 [1,0,0,0,0,0|3,0,0]=4 424 B2R0.1 [1H]O[1H] CHEBI:29375 [1,0,0,0,0,0|3,0,0]=4 425 B2R0.1 [2H]O[2H] CHEBI:41981 [1,0,0,0,0,0|3,0,0]=4 426 B2R0.1 [3H]O[3H] CHEBI:29374 [1,0,0,0,0,0|3,0,0]=4 427 B2R0.1 [Be](Cl)Cl CHEBI:62843 [1,0,0,0,0,0|3,0,0]=4 428 B2R0.1 [Be](F)F CHEBI:49499 [1,0,0,0,0,0|3,0,0]=4 429 B2R0.1 [C-]#N=S CHEBI:29447 [1,0,0,0,0,0|1,1,1]=4 430 B2R0.1 [C-]#[N+]O CHEBI:29814 [1,0,0,0,0,0|1,0,1]=3 431 B2R0.1 [C-]#[N+]S CHEBI:29427 [1,0,0,0,0,0|1,1,1]=4 432 B2R0.1 [C-]#[N+][O-] CHEBI:29811 [1,0,0,0,0,0|1,0,2]=4 433 B2R0.1 [C-]#[N+][Se-] CHEBI:29446 [1,0,0,0,0,0|1,1,1]=4 434 B2R0.1 [C-]#[N+][SeH] CHEBI:29776 [1,0,0,0,0,0|1,1,1]=4 435 B2R0.1 [CH2]C=O CHEBI:46886 [1,0,0,0,0,0|0,0,1]=2 436 B2R0.1 [C](=N)O CHEBI:33099 [1,0,0,0,0,0|1,0,1]=3 437 B2R0.1 [C](=N)[O-] CHEBI:29817 [1,0,0,0,0,0|1,0,2]=4 438 B2R0.1 [C](=O)N CHEBI:33100 [1,0,0,0,0,0|1,0,1]=3 439 B2R0.1 [C](=O)O CHEBI:29326 [1,0,0,0,0,0|0,0,1]=2 440 B2R0.1 [C](=O)[O-] CHEBI:29325 [1,0,0,0,0,0|0,0,2]=3 441 B2R0.1 [C](=S)[S-] CHEBI:30252 [1,0,0,0,0,0|0,2,1]=4 442 B2R0.1 [C](=[N-])O CHEBI:29818 [1,0,0,0,0,0|1,0,1]=3 443 B2R0.1 [C](=[N-])[O-] CHEBI:29812 [1,0,0,0,0,0|1,0,2]=4 444 B2R0.1 [C](Cl)Cl CHEBI:51370 [1,0,0,0,0,0|2,0,1]=4 445 B2R0.1 [H+]([OH2])[OH2] CHEBI:30197 [1,0,0,0,0,0|1,0,2]=4 446 B2R0.1 [Hg+][Hg][Hg+] CHEBI:50236 [1,0,0,0,0,0|3,0,0]=4 447 B2R0.1 [Li]C#C CHEBI:51481 [1,0,0,0,0,0|1,0,2]=4 448 B2R0.1 [Li]C=C CHEBI:51472 [1,0,0,0,0,0|1,0,1]=3 449 B2R0.1 [Li]CC CHEBI:51468 [1,0,0,0,0,0|1,0,1]=3 450 B2R0.1 [N+](=O)=O CHEBI:29424 [1,0,0,0,0,0|1,0,1]=3 451 B2R0.1 [N-]=[N+]=[N-] CHEBI:278547 [1,0,0,0,0,0|3,0,0]=4 452 B2R0.1 [N-]=[N+]=[N-] CHEBI:40910 [1,0,0,0,0,0|3,0,0]=4 453 B2R0.1 [N-]=[N+]=[N] CHEBI:29448 [1,0,0,0,0,0|3,0,0]=4 454 B2R0.1 [N-]=[N]=O CHEBI:29796 [1,0,0,0,0,0|2,0,0]=3 455 B2R0.1 [NH2+](O)[O-] CHEBI:37766 [1,0,0,0,0,0|1,0,1]=3 456 B2R0.1 [NH4][Ag+][NH4] CHEBI:32129 [1,0,0,0,0,0|3,0,0]=4 457 B2R0.1 [NH4][Ag+][NH4] CHEBI:33049 [1,0,0,0,0,0|3,0,0]=4 458 B2R0.1 [NH4][Hg+2][NH4] CHEBI:36574 [1,0,0,0,0,0|3,0,0]=4 459 B2R0.1 [N](=O)=O CHEBI:33101 [1,0,0,0,0,0|1,0,1]=3 460 B2R0.1 [N]([O-])[O-] CHEBI:29423 [1,0,0,0,0,0|1,0,2]=4 461 B2R0.1 [O-]Br=O CHEBI:29248 [1,0,0,0,0,0|1,0,1]=3 462 B2R0.1 [O-]Cl=O CHEBI:17441 [1,0,0,0,0,0|1,0,1]=3 463 B2R0.1 [O-]Cl=O CHEBI:78667 [1,0,0,0,0,0|1,0,1]=3 464 B2R0.1 [O-]I=O CHEBI:29230 [1,0,0,0,0,0|1,0,1]=3 465 B2R0.1 [O-]O[O] CHEBI:29382 [1,0,0,0,0,0|1,0,2]=4 466 B2R0.1 [O-]P=O CHEBI:44951 [1,0,0,0,0,0|1,0,1]=3 467 B2R0.1 [O-]S=O CHEBI:9341 [1,0,0,0,0,0|1,0,1]=3 468 B2R0.1 [O-]S[O-] CHEBI:29821 [1,0,0,0,0,0|1,0,2]=4 469 B2R0.1 [O-]S[O] CHEBI:29820 [1,0,0,0,0,0|1,0,2]=4 470 B2R0.1 [O-][AsH2]=O CHEBI:29846 [1,0,0,0,0,0|1,0,1]=3 471 B2R0.1 [O-][AsH][O-] CHEBI:29753 [1,0,0,0,0,0|1,0,2]=4 472 B2R0.1 [O-][As]=O CHEBI:29678 [1,0,0,0,0,0|1,0,1]=3 473 B2R0.1 [O-][F+][O-] CHEBI:47861 [1,0,0,0,0,0|1,0,2]=4 474 B2R0.1 [O-][Fe]=O CHEBI:78619 [1,0,0,0,0,0|1,0,1]=3 475 B2R0.1 [O-][O+]=O CHEBI:25812 [1,0,0,0,0,0|1,0,1]=3 476 B2R0.1 [O-][PH2]=O CHEBI:29198 [1,0,0,0,0,0|1,0,1]=3 477 B2R0.1 [O]OBr CHEBI:29875 [1,0,0,0,0,0|2,0,1]=4 478 B2R0.1 [O]OCl CHEBI:29414 [1,0,0,0,0,0|2,0,1]=4 479 B2R0.1 [O]OI CHEBI:29902 [1,0,0,0,0,0|2,0,1]=4 480 B2R0.1 [O]OS CHEBI:29410 [1,0,0,0,0,0|1,1,1]=4 481 B2R0.1 [S-]S[S-] CHEBI:29398 [1,0,0,0,0,0|1,2,0]=4 482 B2R0.1 [S-]S[S] CHEBI:29399 [1,0,0,0,0,0|1,2,0]=4 483 B4R0.1 C#CC(=O)N CHEBI:51764 [0,1,0,0,0,0|1,0,1]=3 484 B4R0.1 C#CC(=O)O CHEBI:33199 [0,1,0,0,0,0|0,0,1]=2 485 B4R0.1 C#CC(=O)[O-] CHEBI:15364 [0,1,0,0,0,0|0,0,2]=3 486 B4R0.1 C(=C(Cl)Cl)Cl CHEBI:16602 [0,1,0,0,0,0|2,0,1]=4 487 B4R0.1 C(=N)(N)NN CHEBI:40618 [0,1,0,0,0,0|3,0,0]=4 488 B4R0.1 C(=N)(N)NO CHEBI:43089 [0,1,0,0,0,0|2,0,0]=3 489 B4R0.1 C(=N)C(=O)O CHEBI:53647 [0,1,0,0,0,0|0,0,1]=2 490 B4R0.1 C(=N)C(=O)[O-] CHEBI:53664 [0,1,0,0,0,0|0,0,2]=3 491 B4R0.1 C(=O)(N)NN CHEBI:28306 [0,1,0,0,0,0|2,0,0]=3 492 B4R0.1 C(=O)(N)NO CHEBI:44423 [0,1,0,0,0,0|1,0,0]=2 493 B4R0.1 C(=O)(NN)O CHEBI:38662 [0,1,0,0,0,0|1,0,0]=2 494 B4R0.1 C(=O)C(=O)N CHEBI:59839 [0,1,0,0,0,0|1,0,1]=3 495 B4R0.1 C(=O)C(=O)O CHEBI:16891 [0,1,0,0,0,0|0,0,1]=2 496 B4R0.1 C(=O)C(=O)[O-] CHEBI:36655 [0,1,0,0,0,0|0,0,2]=3 497 B4R0.1 C(=O)C(=O)[O-] CHEBI:91251 [0,1,0,0,0,0|0,0,2]=3 498 B4R0.1 C(=[NH2+])C(=O)[O-] CHEBI:77846 [0,1,0,0,0,0|0,0,2]=3 499 B4R0.1 C(C(=O)N)F CHEBI:53124 [0,1,0,0,0,0|1,0,0]=2 500 B4R0.1 C(C(=O)N)N CHEBI:42843 [0,1,0,0,0,0|1,0,0]=2 501 B4R0.1 C(C(=O)N)O CHEBI:30321 [0,1,0,0,0,0|1,0,0]=2 502 B4R0.1 C(C(=O)O)Cl CHEBI:27869 [0,1,0,0,0,0|0,0,0]=1 503 B4R0.1 C(C(=O)O)F CHEBI:30775 [0,1,0,0,0,0|0,0,0]=1 504 B4R0.1 C(C(=O)O)I CHEBI:74571 [0,1,0,0,0,0|0,0,0]=1 505 B4R0.1 C(C(=O)O)N CHEBI:15428 [0,1,0,0,0,0|0,0,0]=1 506 B4R0.1 C(C(=O)O)O CHEBI:17497 [0,1,0,0,0,0|0,0,0]=1 507 B4R0.1 C(C(=O)O)S CHEBI:30065 [0,1,0,0,0,0|0,0,0]=1 508 B4R0.1 C(C(=O)O)[NH3+] CHEBI:32507 [0,1,0,0,0,0|0,0,0]=1 509 B4R0.1 C(C(=O)S)N CHEBI:46799 [0,1,0,0,0,0|0,1,0]=2 510 B4R0.1 C(C(=O)[O-])Cl CHEBI:23123 [0,1,0,0,0,0|0,0,1]=2 511 B4R0.1 C(C(=O)[O-])F CHEBI:18172 [0,1,0,0,0,0|0,0,1]=2 512 B4R0.1 C(C(=O)[O-])F CHEBI:38699 [0,1,0,0,0,0|0,0,1]=2 513 B4R0.1 C(C(=O)[O-])N CHEBI:32508 [0,1,0,0,0,0|0,0,1]=2 514 B4R0.1 C(C(=O)[O-])O CHEBI:132094 [0,1,0,0,0,0|0,0,1]=2 515 B4R0.1 C(C(=O)[O-])O CHEBI:29805 [0,1,0,0,0,0|0,0,1]=2 516 B4R0.1 C(C(=O)[O-])S CHEBI:30066 [0,1,0,0,0,0|0,0,1]=2 517 B4R0.1 C(C(=O)[O-])S CHEBI:86481 [0,1,0,0,0,0|0,0,1]=2 518 B4R0.1 C(C(=O)[O-])[NH3+] CHEBI:57305 [0,1,0,0,0,0|0,0,1]=2 519 B4R0.1 C(C(=O)[O-])[S-] CHEBI:47869 [0,1,0,0,0,0|0,0,1]=2 520 B4R0.1 C(C(Cl)Cl)Cl CHEBI:36018 [0,1,0,0,0,0|2,0,1]=4 521 B4R0.1 C=C(CO)Br CHEBI:49514 [0,1,0,0,0,0|1,0,1]=3 522 B4R0.1 C=CC(=C)Cl CHEBI:39481 [0,1,0,0,0,0|2,0,1]=4 523 B4R0.1 C=CC(=O)N CHEBI:28619 [0,1,0,0,0,0|1,0,1]=3 524 B4R0.1 C=CC(=O)O CHEBI:18308 [0,1,0,0,0,0|0,0,1]=2 525 B4R0.1 C=CC(=O)[O-] CHEBI:37080 [0,1,0,0,0,0|0,0,2]=3 526 B4R0.1 C=C[N+](=O)[O-] CHEBI:51131 [0,1,0,0,0,0|1,0,2]=4 527 B4R0.1 CC(=C)C=C CHEBI:35194 [0,1,0,0,0,0|2,0,0]=3 528 B4R0.1 CC(=NO)C CHEBI:15349 [0,1,0,0,0,0|1,0,0]=2 529 B4R0.1 CC(=O)C#C CHEBI:48060 [0,1,0,0,0,0|1,0,0]=2 530 B4R0.1 CC(=O)C=C CHEBI:48058 [0,1,0,0,0,0|1,0,0]=2 531 B4R0.1 CC(=O)C=O CHEBI:17158 [0,1,0,0,0,0|0,0,1]=2 532 B4R0.1 CC(=O)CBr CHEBI:51845 [0,1,0,0,0,0|1,0,0]=2 533 B4R0.1 CC(=O)CCl CHEBI:47220 [0,1,0,0,0,0|1,0,0]=2 534 B4R0.1 CC(=O)CN CHEBI:17906 [0,1,0,0,0,0|1,0,0]=2 535 B4R0.1 CC(=O)CO CHEBI:27957 [0,1,0,0,0,0|0,0,0]=1 536 B4R0.1 CC(=O)C[NH3+] CHEBI:58320 [0,1,0,0,0,0|1,0,0]=2 537 B4R0.1 CC(=O)NC CHEBI:87321 [0,1,0,0,0,0|1,0,0]=2 538 B4R0.1 CC(=O)NN CHEBI:2422 [0,1,0,0,0,0|1,0,0]=2 539 B4R0.1 CC(=O)NO CHEBI:27777 [0,1,0,0,0,0|0,0,0]=1 540 B4R0.1 CC(=O)OC CHEBI:77700 [0,1,0,0,0,0|0,0,0]=1 541 B4R0.1 CC(=O)O[Hg+] CHEBI:49727 [0,1,0,0,0,0|0,0,0]=1 542 B4R0.1 CC(=O)SC CHEBI:51280 [0,1,0,0,0,0|0,1,0]=2 543 B4R0.1 CC(=S)OC CHEBI:51281 [0,1,0,0,0,0|0,1,0]=2 544 B4R0.1 CC(C#N)N CHEBI:27959 [0,1,0,0,0,0|2,0,1]=4 545 B4R0.1 CC(C)C#C CHEBI:87379 [0,1,0,0,0,0|2,0,1]=4 546 B4R0.1 CC(C)C=C CHEBI:77914 [0,1,0,0,0,0|2,0,1]=4 547 B4R0.1 CC(C)C=O CHEBI:48943 [0,1,0,0,0,0|1,0,1]=3 548 B4R0.1 CC(C)CN CHEBI:15997 [0,1,0,0,0,0|2,0,1]=4 549 B4R0.1 CC(C)CO CHEBI:46645 [0,1,0,0,0,0|1,0,1]=3 550 B4R0.1 CC(C)C[NH3+] CHEBI:57601 [0,1,0,0,0,0|2,0,1]=4 551 B4R0.1 CC(C)OC CHEBI:53505 [0,1,0,0,0,0|1,0,1]=3 552 B4R0.1 CC(C=O)O CHEBI:18419 [0,1,0,0,0,0|0,0,1]=2 553 B4R0.1 CC(CCl)O CHEBI:76260 [0,1,0,0,0,0|1,0,1]=3 554 B4R0.1 CC(CN)N CHEBI:30630 [0,1,0,0,0,0|2,0,1]=4 555 B4R0.1 CC(CN)O CHEBI:19030 [0,1,0,0,0,0|1,0,1]=3 556 B4R0.1 CC(CO)O CHEBI:16997 [0,1,0,0,0,0|0,0,2]=3 557 B4R0.1 CC=C(C)C CHEBI:77916 [0,1,0,0,0,0|2,0,0]=3 558 B4R0.1 CC=[N+]([O-])[O-] CHEBI:55327 [0,1,0,0,0,0|1,0,2]=4 559 B4R0.1 CCC(=C)C CHEBI:77915 [0,1,0,0,0,0|2,0,0]=3 560 B4R0.1 CCC(=O)C CHEBI:28398 [0,1,0,0,0,0|1,0,0]=2 561 B4R0.1 CCC(=O)N CHEBI:45422 [0,1,0,0,0,0|1,0,0]=2 562 B4R0.1 CCC(=O)O CHEBI:30768 [0,1,0,0,0,0|0,0,0]=1 563 B4R0.1 CCC(=O)[O-] CHEBI:132106 [0,1,0,0,0,0|0,0,1]=2 564 B4R0.1 CCC(=O)[O-] CHEBI:17272 [0,1,0,0,0,0|0,0,1]=2 565 B4R0.1 CCC(=O)[O-] CHEBI:63884 [0,1,0,0,0,0|0,0,1]=2 566 B4R0.1 CCC(=S)C CHEBI:36581 [0,1,0,0,0,0|1,1,0]=3 567 B4R0.1 CCC(C)C CHEBI:30362 [0,1,0,0,0,0|2,0,1]=4 568 B4R0.1 CCC(C)N CHEBI:74526 [0,1,0,0,0,0|2,0,1]=4 569 B4R0.1 CCC(C)O CHEBI:35687 [0,1,0,0,0,0|1,0,1]=3 570 B4R0.1 CC[C@@H](C)O CHEBI:35686 [0,1,0,0,0,0|1,0,1]=3 571 B4R0.1 CC[C@H](C)O CHEBI:45475 [0,1,0,0,0,0|1,0,1]=3 572 B4R0.1 CC[N+](=O)[O-] CHEBI:16268 [0,1,0,0,0,0|1,0,1]=3 573 B4R0.1 CN(C)C=O CHEBI:17741 [0,1,0,0,0,0|2,0,0]=3 574 B4R0.1 CN(C)N=O CHEBI:35807 [0,1,0,0,0,0|2,0,0]=3 575 B4R0.1 CNC(=N)N CHEBI:16628 [0,1,0,0,0,0|2,0,0]=3 576 B4R0.1 CNC(=O)N CHEBI:44383 [0,1,0,0,0,0|1,0,0]=2 577 B4R0.1 CNC(=O)O CHEBI:45379 [0,1,0,0,0,0|0,0,0]=1 578 B4R0.1 CNC(=[NH2+])N CHEBI:57840 [0,1,0,0,0,0|2,0,0]=3 579 B4R0.1 COC(=O)N CHEBI:76606 [0,1,0,0,0,0|1,0,0]=2 580 B4R0.1 C[C@@H](C#N)N CHEBI:50617 [0,1,0,0,0,0|2,0,1]=4 581 B4R0.1 C[C@@H](C=O)O CHEBI:18041 [0,1,0,0,0,0|0,0,1]=2 582 B4R0.1 C[C@@H](CO)N CHEBI:78502 [0,1,0,0,0,0|1,0,1]=3 583 B4R0.1 C[C@@H](CO)O CHEBI:29002 [0,1,0,0,0,0|0,0,2]=3 584 B4R0.1 C[C@@H](CO)[NH3+] CHEBI:85422 [0,1,0,0,0,0|1,0,1]=3 585 B4R0.1 C[C@H](C#N)N CHEBI:50618 [0,1,0,0,0,0|2,0,1]=4 586 B4R0.1 C[C@H](C=O)O CHEBI:17167 [0,1,0,0,0,0|0,0,1]=2 587 B4R0.1 C[C@H](CN)O CHEBI:15675 [0,1,0,0,0,0|1,0,1]=3 588 B4R0.1 C[C@H](CO)O CHEBI:28972 [0,1,0,0,0,0|0,0,2]=3 589 B4R0.1 C[C@H](C[NH3+])O CHEBI:42677 [0,1,0,0,0,0|1,0,1]=3 590 B4R0.1 C\C(=N/O)\O CHEBI:49029 [0,1,0,0,0,0|0,0,1]=2 591 B4R0.1 C\C(=N\N)\O CHEBI:48978 [0,1,0,0,0,0|1,0,0]=2 592 B4R0.1 C\C=[N+](\O)/[O-] CHEBI:77894 [0,1,0,0,0,0|1,0,1]=3 593 B4R0.1 N(=O)(=O)OO CHEBI:29271 [0,1,0,0,0,0|2,0,0]=3 594 B4R0.1 N(=O)(=O)O[O-] CHEBI:29270 [0,1,0,0,0,0|2,0,0]=3 595 B4R0.1 N(=O)N([O-])[O-] CHEBI:29801 [0,1,0,0,0,0|2,0,1]=4 596 B4R0.1 N(=O)[N+](=O)[O-] CHEBI:29799 [0,1,0,0,0,0|2,0,1]=4 597 B4R0.1 [*](C(=O)[O-])O CHEBI:131871 [0,1,0,0,0,0|1,0,0]=2 598 B4R0.1 [*]C(=C=O)[*] CHEBI:48002 [0,1,0,0,0,0|2,0,0]=3 599 B4R0.1 [*]C(=O)CO CHEBI:52501 [0,1,0,0,0,0|1,0,0]=2 600 B4R0.1 [*]C(=O)O[*] CHEBI:33308 [0,1,0,0,0,0|1,0,0]=2 601 B4R0.1 [*]C(=O)O[*] CHEBI:78553 [0,1,0,0,0,0|1,0,0]=2 602 B4R0.1 [*]C(=O)O[*] CHEBI:78555 [0,1,0,0,0,0|1,0,0]=2 603 B4R0.1 [*]C(=O)O[*] CHEBI:78557 [0,1,0,0,0,0|1,0,0]=2 604 B4R0.1 [*]C(=O)O[*] CHEBI:78558 [0,1,0,0,0,0|1,0,0]=2 605 B4R0.1 [*]C(=O)O[*] CHEBI:78560 [0,1,0,0,0,0|1,0,0]=2 606 B4R0.1 [*]C(=O)O[*] CHEBI:78561 [0,1,0,0,0,0|1,0,0]=2 607 B4R0.1 [*]C(=O)O[*] CHEBI:78562 [0,1,0,0,0,0|1,0,0]=2 608 B4R0.1 [*]C(=O)O[*] CHEBI:78563 [0,1,0,0,0,0|1,0,0]=2 609 B4R0.1 [*]C(=O)S[*] CHEBI:51277 [0,1,0,0,0,0|1,1,0]=3 610 B4R0.1 [*]C(=S)O[*] CHEBI:51278 [0,1,0,0,0,0|1,1,0]=3 611 B4R0.1 [*]C(=S)S[*] CHEBI:59785 [0,1,0,0,0,0|1,2,0]=4 612 B4R0.1 [*]N([*])N=O CHEBI:35803 [0,1,0,0,0,0|3,0,0]=4 613 B4R0.1 [*]SC(=O)C CHEBI:17093 [0,1,0,0,0,0|0,1,0]=2 614 B4R0.1 [*][C@H](CO)O CHEBI:27636 [0,1,0,0,0,0|1,0,1]=3 615 B4R0.1 [*]\C(=N\O)\[*] CHEBI:24983 [0,1,0,0,0,0|2,0,0]=3 616 B4R0.1 [*]\C(=N\O)\[*] CHEBI:25750 [0,1,0,0,0,0|2,0,0]=3 617 B4R0.1 [*]\C(=N\[*])\[*] CHEBI:24783 [0,1,0,0,0,0|3,0,0]=4 618 B4R0.1 [CH](C(=O)O)N CHEBI:32721 [0,1,0,0,0,0|0,0,1]=2 619 B4R0.3 CC(C)(C)C CHEBI:30358 [0,1,0,0,0,0|2,0,1]=4 620 B4R0.3 CC(C)(C)N CHEBI:44639 [0,1,0,0,0,0|2,0,1]=4 621 B4R0.3 CC(C)(C)O CHEBI:45895 [0,1,0,0,0,0|1,0,1]=3 622 B4R0.3 CC(C)(C)[NH3+] CHEBI:224366 [0,1,0,0,0,0|2,0,1]=4 623 B4R0.3 CC(Cl)(Cl)Cl CHEBI:36015 [0,1,0,0,0,0|2,0,1]=4 624 B4R0.3 CP(=O)(C)O CHEBI:23814 [0,1,0,0,0,0|1,0,0]=2 625 B4R0.3 CP(=O)(O)O CHEBI:45129 [0,1,0,0,0,0|1,0,0]=2 626 B4R0.3 CP(=O)(O)[O-] CHEBI:68684 [0,1,0,0,0,0|1,0,0]=2 627 B4R0.3 CP(=O)([O-])[O-] CHEBI:68822 [0,1,0,0,0,0|1,0,1]=3 628 B4R0.3 CS(=O)(=O)C CHEBI:9349 [0,1,0,0,0,0|1,0,1]=3 629 B4R0.3 CS(=O)(=O)O CHEBI:27376 [0,1,0,0,0,0|1,0,0]=2 630 B4R0.3 CS(=O)(=O)[O-] CHEBI:25224 [0,1,0,0,0,0|1,0,1]=3 631 B4R0.3 CS(=O)(=O)[O-] CHEBI:63881 [0,1,0,0,0,0|1,0,1]=3 632 B4R0.3 C[As](=O)(C)C CHEBI:27131 [0,1,0,0,0,0|2,0,0]=3 633 B4R0.3 C[As](=O)(C)O CHEBI:48765 [0,1,0,0,0,0|1,0,0]=2 634 B4R0.3 C[As](=O)(C)[O-] CHEBI:16223 [0,1,0,0,0,0|1,0,1]=3 635 B4R0.3 C[As](=O)(C)[O-] CHEBI:62956 [0,1,0,0,0,0|1,0,1]=3 636 B4R0.3 C[As](=O)(O)O CHEBI:29852 [0,1,0,0,0,0|1,0,0]=2 637 B4R0.3 C[As](=O)(O)[O-] CHEBI:33409 [0,1,0,0,0,0|1,0,0]=2 638 B4R0.3 C[As](=O)([O-])[O-] CHEBI:16005 [0,1,0,0,0,0|1,0,1]=3 639 B4R0.3 C[N+](C)(C)C CHEBI:46020 [0,1,0,0,0,0|3,0,0]=4 640 B4R0.3 C[N+](C)(C)C CHEBI:55317 [0,1,0,0,0,0|3,0,0]=4 641 B4R0.3 C[N+](C)(C)[O-] CHEBI:15724 [0,1,0,0,0,0|2,0,1]=4 642 B4R0.3 C[Pb](C)(C)C CHEBI:30183 [0,1,0,0,0,0|3,0,0]=4 643 B4R0.3 C[Si](C)(C)C CHEBI:85361 [0,1,0,0,0,0|2,1,0]=4 644 B4R0.3 C[Si](C)(C)Cl CHEBI:85069 [0,1,0,0,0,0|2,1,0]=4 645 B4R0.3 C[Si](C)(O)O CHEBI:23816 [0,1,0,0,0,0|0,1,1]=3 646 B4R0.3 C[Si](O)(O)O CHEBI:25342 [0,1,0,0,0,0|0,1,1]=3 647 B4R0.3 C[Sn](C)(C)C CHEBI:30420 [0,1,0,0,0,0|3,0,0]=4 648 B4R0.3 C[Te](=O)(=O)O CHEBI:70755 [0,1,0,0,0,0|1,0,0]=2 649 B4R0.3 C[Te](=O)(=O)[O-] CHEBI:71624 [0,1,0,0,0,0|1,0,1]=3 650 B4R0.3 C[Te](C)(Cl)Cl CHEBI:30471 [0,1,0,0,0,0|3,0,0]=4 651 B4R0.3 N#[Os](=O)(=O)[O-] CHEBI:35656 [0,1,0,0,0,0|2,0,1]=4 652 B4R0.3 N#[Os](=O)(=O)[O-] CHEBI:35657 [0,1,0,0,0,0|2,0,1]=4 653 B4R0.3 NP(=O)(O)O CHEBI:15907 [0,1,0,0,0,0|2,0,0]=3 654 B4R0.3 NP(=O)([O-])[O-] CHEBI:29920 [0,1,0,0,0,0|2,0,1]=4 655 B4R0.3 NS(=O)(=O)N CHEBI:29368 [0,1,0,0,0,0|2,0,1]=4 656 B4R0.3 NS(=O)(=O)O CHEBI:9330 [0,1,0,0,0,0|2,0,0]=3 657 B4R0.3 O=Br(=O)(=O)[O] CHEBI:29893 [0,1,0,0,0,0|2,0,1]=4 658 B4R0.3 O=Cl(=O)(=O)[O] CHEBI:29420 [0,1,0,0,0,0|2,0,1]=4 659 B4R0.3 O=I(=O)(=O)[O] CHEBI:29910 [0,1,0,0,0,0|2,0,1]=4 660 B4R0.3 O=P(Cl)(Cl)Cl CHEBI:30336 [0,1,0,0,0,0|3,0,0]=4 661 B4R0.3 O=S(=O)(Cl)Cl CHEBI:29291 [0,1,0,0,0,0|2,0,1]=4 662 B4R0.3 O=S(=O)(F)Cl CHEBI:39445 [0,1,0,0,0,0|2,0,1]=4 663 B4R0.3 O=S(=O)(F)F CHEBI:39287 [0,1,0,0,0,0|2,0,1]=4 664 B4R0.3 O=S(=O)(S)S CHEBI:50495 [0,1,0,0,0,0|2,0,1]=4 665 B4R0.3 O=S(=O)([O])[S-] CHEBI:29394 [0,1,0,0,0,0|2,0,1]=4 666 B4R0.3 O=[Cr-](=O)(=O)I CHEBI:51547 [0,1,0,0,0,0|2,0,1]=4 667 B4R0.3 O=[Cr](=O)(Cl)Cl CHEBI:33038 [0,1,0,0,0,0|2,0,1]=4 668 B4R0.3 O=[Mo](Cl)(Cl)Cl CHEBI:30696 [0,1,0,0,0,0|3,0,0]=4 669 B4R0.3 O=[Os](=O)(=O)=O CHEBI:88215 [0,1,0,0,0,0|2,0,1]=4 670 B4R0.3 OBr(=O)(=O)=O CHEBI:29245 [0,1,0,0,0,0|2,0,0]=3 671 B4R0.3 OCl(=O)(=O)=O CHEBI:29221 [0,1,0,0,0,0|2,0,0]=3 672 B4R0.3 OI(=O)(=O)=O CHEBI:29149 [0,1,0,0,0,0|2,0,0]=3 673 B4R0.3 OP(=O)(O)F CHEBI:30210 [0,1,0,0,0,0|2,0,0]=3 674 B4R0.3 OP(=O)(O)O CHEBI:26078 [0,1,0,0,0,0|2,0,0]=3 675 B4R0.3 OP(=O)(O)O CHEBI:52641 [0,1,0,0,0,0|2,0,0]=3 676 B4R0.3 OP(=O)(O)S CHEBI:46613 [0,1,0,0,0,0|2,0,0]=3 677 B4R0.3 OP(=O)(O)[O-] CHEBI:114249 [0,1,0,0,0,0|2,0,0]=3 678 B4R0.3 OP(=O)(O)[O-] CHEBI:35433 [0,1,0,0,0,0|2,0,0]=3 679 B4R0.3 OP(=O)(O)[O-] CHEBI:37585 [0,1,0,0,0,0|2,0,0]=3 680 B4R0.3 OP(=O)(O)[O-] CHEBI:39745 [0,1,0,0,0,0|2,0,0]=3 681 B4R0.3 OP(=O)(O)[O-] CHEBI:62982 [0,1,0,0,0,0|2,0,0]=3 682 B4R0.3 OP(=O)(O)[O-] CHEBI:63036 [0,1,0,0,0,0|2,0,0]=3 683 B4R0.3 OP(=O)(O)[O] CHEBI:29931 [0,1,0,0,0,0|2,0,0]=3 684 B4R0.3 OP(=O)(O)[SeH] CHEBI:64331 [0,1,0,0,0,0|2,0,0]=3 685 B4R0.3 OP(=O)([O-])[O-] CHEBI:131527 [0,1,0,0,0,0|2,0,0]=3 686 B4R0.3 OP(=O)([O-])[O-] CHEBI:16838 [0,1,0,0,0,0|2,0,0]=3 687 B4R0.3 OP(=O)([O-])[O-] CHEBI:32596 [0,1,0,0,0,0|2,0,0]=3 688 B4R0.3 OP(=O)([O-])[O-] CHEBI:34683 [0,1,0,0,0,0|2,0,0]=3 689 B4R0.3 OP(=O)([O-])[O-] CHEBI:43474 [0,1,0,0,0,0|2,0,0]=3 690 B4R0.3 OP(=O)([O-])[O-] CHEBI:4496 [0,1,0,0,0,0|2,0,0]=3 691 B4R0.3 OP(=O)([O-])[O-] CHEBI:63051 [0,1,0,0,0,0|2,0,0]=3 692 B4R0.3 OP(=O)([O-])[O-] CHEBI:91258 [0,1,0,0,0,0|2,0,0]=3 693 B4R0.3 OP(=O)([O-])[O-] CHEBI:91259 [0,1,0,0,0,0|2,0,0]=3 694 B4R0.3 OP(=O)([O-])[O] CHEBI:29925 [0,1,0,0,0,0|2,0,0]=3 695 B4R0.3 OP(=S)(O)O CHEBI:46611 [0,1,0,0,0,0|2,0,1]=4 696 B4R0.3 OP(=S)(O)S CHEBI:74944 [0,1,0,0,0,0|2,0,1]=4 697 B4R0.3 OP(=S)([O-])[O-] CHEBI:74752 [0,1,0,0,0,0|2,0,1]=4 698 B4R0.3 OP(=S)([O-])[S-] CHEBI:74591 [0,1,0,0,0,0|2,0,1]=4 699 B4R0.3 OP(=[Se])(O)O CHEBI:29269 [0,1,0,0,0,0|2,0,1]=4 700 B4R0.3 OP(=[Se])([O-])[O-] CHEBI:58618 [0,1,0,0,0,0|2,0,1]=4 701 B4R0.3 OS(=O)(=O)O CHEBI:26836 [0,1,0,0,0,0|2,0,0]=3 702 B4R0.3 OS(=O)(=O)S CHEBI:5587 [0,1,0,0,0,0|2,0,0]=3 703 B4R0.3 OS(=O)(=O)[O-] CHEBI:45696 [0,1,0,0,0,0|2,0,0]=3 704 B4R0.3 OS(=O)(=O)[O] CHEBI:29407 [0,1,0,0,0,0|2,0,0]=3 705 B4R0.3 OS(=O)(=O)[S-] CHEBI:33539 [0,1,0,0,0,0|2,0,0]=3 706 B4R0.3 OS(=O)(=S)O CHEBI:29279 [0,1,0,0,0,0|2,0,0]=3 707 B4R0.3 OS(=S)(=S)O CHEBI:50494 [0,1,0,0,0,0|2,0,1]=4 708 B4R0.3 O[As](=O)(O)O CHEBI:18231 [0,1,0,0,0,0|2,0,0]=3 709 B4R0.3 O[As](=O)(O)[O-] CHEBI:48600 [0,1,0,0,0,0|2,0,0]=3 710 B4R0.3 O[As](=O)(O)[O-] CHEBI:77719 [0,1,0,0,0,0|2,0,0]=3 711 B4R0.3 O[As](=O)([O-])[O-] CHEBI:48597 [0,1,0,0,0,0|2,0,0]=3 712 B4R0.3 O[As](=O)([O-])[O-] CHEBI:91256 [0,1,0,0,0,0|2,0,0]=3 713 B4R0.3 O[As](=O)([O-])[O-] CHEBI:91257 [0,1,0,0,0,0|2,0,0]=3 714 B4R0.3 O[Cd-2](O)(O)O CHEBI:36661 [0,1,0,0,0,0|2,0,1]=4 715 B4R0.3 O[Cr](=O)(=O)O CHEBI:33143 [0,1,0,0,0,0|2,0,0]=3 716 B4R0.3 O[Cr](=O)(=O)[O-] CHEBI:33144 [0,1,0,0,0,0|2,0,0]=3 717 B4R0.3 O[Mn](=O)(=O)=O CHEBI:35124 [0,1,0,0,0,0|2,0,0]=3 718 B4R0.3 O[Mn](=O)(=O)O CHEBI:35119 [0,1,0,0,0,0|2,0,0]=3 719 B4R0.3 O[Mn](=O)(=O)[O-] CHEBI:35123 [0,1,0,0,0,0|2,0,0]=3 720 B4R0.3 O[Mn](=O)(O)O CHEBI:35125 [0,1,0,0,0,0|2,0,0]=3 721 B4R0.3 O[Mn](=O)(O)[O-] CHEBI:35126 [0,1,0,0,0,0|2,0,0]=3 722 B4R0.3 O[Mn](=O)([O-])[O-] CHEBI:35127 [0,1,0,0,0,0|2,0,0]=3 723 B4R0.3 O[Mo](=O)(=O)O CHEBI:25371 [0,1,0,0,0,0|2,0,0]=3 724 B4R0.3 O[Mo](=O)(=O)[O-] CHEBI:36263 [0,1,0,0,0,0|2,0,0]=3 725 B4R0.3 O[Sb](=O)(O)O CHEBI:30294 [0,1,0,0,0,0|2,0,0]=3 726 B4R0.3 O[Sb](=O)(O)[O-] CHEBI:36923 [0,1,0,0,0,0|2,0,0]=3 727 B4R0.3 O[Sb](=O)([O-])[O-] CHEBI:36924 [0,1,0,0,0,0|2,0,0]=3 728 B4R0.3 O[Se](=O)(=O)O CHEBI:18170 [0,1,0,0,0,0|2,0,0]=3 729 B4R0.3 O[Se](=O)(=O)[O-] CHEBI:33490 [0,1,0,0,0,0|2,0,0]=3 730 B4R0.3 O[Si](O)(O)O CHEBI:26675 [0,1,0,0,0,0|1,1,1]=4 731 B4R0.3 O[Si](O)(O)[O-] CHEBI:48125 [0,1,0,0,0,0|1,1,1]=4 732 B4R0.3 O[Si](O)([O-])[O-] CHEBI:48124 [0,1,0,0,0,0|1,1,1]=4 733 B4R0.3 O[Si]([O-])([O-])[O-] CHEBI:48122 [0,1,0,0,0,0|1,1,1]=4 734 B4R0.3 O[Te](=O)(=O)O CHEBI:30463 [0,1,0,0,0,0|2,0,0]=3 735 B4R0.3 O[Te](=O)(=O)[O-] CHEBI:36287 [0,1,0,0,0,0|2,0,0]=3 736 B4R0.3 O[V](=O)(O)O CHEBI:27273 [0,1,0,0,0,0|2,0,0]=3 737 B4R0.3 O[V](=O)(O)[O-] CHEBI:35169 [0,1,0,0,0,0|2,0,0]=3 738 B4R0.3 O[V](=O)([O-])[O-] CHEBI:35168 [0,1,0,0,0,0|2,0,0]=3 739 B4R0.3 O[W](=O)(=O)O CHEBI:36272 [0,1,0,0,0,0|2,0,0]=3 740 B4R0.3 O[W](=O)(=O)[O-] CHEBI:36271 [0,1,0,0,0,0|2,0,0]=3 741 B4R0.3 [*]C([*])(O)O CHEBI:63734 [0,1,0,0,0,0|1,0,2]=4 742 B4R0.3 [*]P(=O)([*])[*] CHEBI:59656 [0,1,0,0,0,0|3,0,0]=4 743 B4R0.3 [B-](O)(O)(O)O CHEBI:41132 [0,1,0,0,0,0|2,0,1]=4 744 B4R0.3 [Be-2](O)(O)(O)O CHEBI:30499 [0,1,0,0,0,0|2,0,1]=4 745 B4R0.3 [O-]Br(=O)(=O)=O CHEBI:29246 [0,1,0,0,0,0|2,0,1]=4 746 B4R0.3 [O-]Cl(=O)(=O)=O CHEBI:132103 [0,1,0,0,0,0|2,0,1]=4 747 B4R0.3 [O-]Cl(=O)(=O)=O CHEBI:49706 [0,1,0,0,0,0|2,0,1]=4 748 B4R0.3 [O-]I(=O)(=O)=O CHEBI:49826 [0,1,0,0,0,0|2,0,1]=4 749 B4R0.3 [O-]I(=O)(=O)=O CHEBI:75226 [0,1,0,0,0,0|2,0,1]=4 750 B4R0.3 [O-]P(=O)([O-])F CHEBI:42699 [0,1,0,0,0,0|2,0,1]=4 751 B4R0.3 [O-]P(=O)([O-])F CHEBI:86431 [0,1,0,0,0,0|2,0,1]=4 752 B4R0.3 [O-]P(=O)([O-])[O-] CHEBI:131371 [0,1,0,0,0,0|2,0,1]=4 753 B4R0.3 [O-]P(=O)([O-])[O-] CHEBI:131372 [0,1,0,0,0,0|2,0,1]=4 754 B4R0.3 [O-]P(=O)([O-])[O-] CHEBI:132107 [0,1,0,0,0,0|2,0,1]=4 755 B4R0.3 [O-]P(=O)([O-])[O-] CHEBI:18367 [0,1,0,0,0,0|2,0,1]=4 756 B4R0.3 [O-]P(=O)([O-])[O-] CHEBI:37583 [0,1,0,0,0,0|2,0,1]=4 757 B4R0.3 [O-]P(=O)([O-])[O-] CHEBI:9679 [0,1,0,0,0,0|2,0,1]=4 758 B4R0.3 [O-]P(=O)([O-])[O] CHEBI:29932 [0,1,0,0,0,0|2,0,1]=4 759 B4R0.3 [O-]S(=O)(=O)S CHEBI:33542 [0,1,0,0,0,0|2,0,1]=4 760 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:131378 [0,1,0,0,0,0|2,0,1]=4 761 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:131387 [0,1,0,0,0,0|2,0,1]=4 762 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:131523 [0,1,0,0,0,0|2,0,1]=4 763 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:131524 [0,1,0,0,0,0|2,0,1]=4 764 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:132758 [0,1,0,0,0,0|2,0,1]=4 765 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:132762 [0,1,0,0,0,0|2,0,1]=4 766 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:133326 [0,1,0,0,0,0|2,0,1]=4 767 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:16189 [0,1,0,0,0,0|2,0,1]=4 768 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:23414 [0,1,0,0,0,0|2,0,1]=4 769 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:31346 [0,1,0,0,0,0|2,0,1]=4 770 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:31440 [0,1,0,0,0,0|2,0,1]=4 771 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:31795 [0,1,0,0,0,0|2,0,1]=4 772 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:32036 [0,1,0,0,0,0|2,0,1]=4 773 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:32149 [0,1,0,0,0,0|2,0,1]=4 774 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:32312 [0,1,0,0,0,0|2,0,1]=4 775 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:32583 [0,1,0,0,0,0|2,0,1]=4 776 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:32584 [0,1,0,0,0,0|2,0,1]=4 777 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:32586 [0,1,0,0,0,0|2,0,1]=4 778 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:32599 [0,1,0,0,0,0|2,0,1]=4 779 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:33146 [0,1,0,0,0,0|2,0,1]=4 780 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:35176 [0,1,0,0,0,0|2,0,1]=4 781 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:50292 [0,1,0,0,0,0|2,0,1]=4 782 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:53001 [0,1,0,0,0,0|2,0,1]=4 783 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:53437 [0,1,0,0,0,0|2,0,1]=4 784 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:53438 [0,1,0,0,0,0|2,0,1]=4 785 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:53470 [0,1,0,0,0,0|2,0,1]=4 786 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:53471 [0,1,0,0,0,0|2,0,1]=4 787 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:53473 [0,1,0,0,0,0|2,0,1]=4 788 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:53474 [0,1,0,0,0,0|2,0,1]=4 789 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:53502 [0,1,0,0,0,0|2,0,1]=4 790 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:53504 [0,1,0,0,0,0|2,0,1]=4 791 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:62946 [0,1,0,0,0,0|2,0,1]=4 792 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:74768 [0,1,0,0,0,0|2,0,1]=4 793 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:74779 [0,1,0,0,0,0|2,0,1]=4 794 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:74780 [0,1,0,0,0,0|2,0,1]=4 795 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:75832 [0,1,0,0,0,0|2,0,1]=4 796 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:75834 [0,1,0,0,0,0|2,0,1]=4 797 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:75836 [0,1,0,0,0,0|2,0,1]=4 798 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:76181 [0,1,0,0,0,0|2,0,1]=4 799 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:76243 [0,1,0,0,0,0|2,0,1]=4 800 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:86149 [0,1,0,0,0,0|2,0,1]=4 801 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:86151 [0,1,0,0,0,0|2,0,1]=4 802 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:86157 [0,1,0,0,0,0|2,0,1]=4 803 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:86356 [0,1,0,0,0,0|2,0,1]=4 804 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:86358 [0,1,0,0,0,0|2,0,1]=4 805 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:86360 [0,1,0,0,0,0|2,0,1]=4 806 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:86364 [0,1,0,0,0,0|2,0,1]=4 807 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:86463 [0,1,0,0,0,0|2,0,1]=4 808 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:86465 [0,1,0,0,0,0|2,0,1]=4 809 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:87009 [0,1,0,0,0,0|2,0,1]=4 810 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:87011 [0,1,0,0,0,0|2,0,1]=4 811 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:87014 [0,1,0,0,0,0|2,0,1]=4 812 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:87020 [0,1,0,0,0,0|2,0,1]=4 813 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:91240 [0,1,0,0,0,0|2,0,1]=4 814 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:91244 [0,1,0,0,0,0|2,0,1]=4 815 B4R0.3 [O-]S(=O)(=O)[O-] CHEBI:91246 [0,1,0,0,0,0|2,0,1]=4 816 B4R0.3 [O-]S(=O)(=O)[O] CHEBI:29406 [0,1,0,0,0,0|2,0,1]=4 817 B4R0.3 [O-]S(=O)(=O)[S-] CHEBI:132112 [0,1,0,0,0,0|2,0,1]=4 818 B4R0.3 [O-]S(=O)(=O)[S-] CHEBI:16094 [0,1,0,0,0,0|2,0,1]=4 819 B4R0.3 [O-]S(=O)(=O)[S-] CHEBI:32150 [0,1,0,0,0,0|2,0,1]=4 820 B4R0.3 [O-][As](=O)([O-])[O-] CHEBI:29125 [0,1,0,0,0,0|2,0,1]=4 821 B4R0.3 [O-][As](=O)([O-])[O-] CHEBI:84070 [0,1,0,0,0,0|2,0,1]=4 822 B4R0.3 [O-][Cr](=O)(=O)[O-] CHEBI:35404 [0,1,0,0,0,0|2,0,1]=4 823 B4R0.3 [O-][Cr](=O)(=O)[O-] CHEBI:75249 [0,1,0,0,0,0|2,0,1]=4 824 B4R0.3 [O-][Cr](=O)(=O)[O-] CHEBI:78671 [0,1,0,0,0,0|2,0,1]=4 825 B4R0.3 [O-][Cr](=O)(=O)[O-] CHEBI:86257 [0,1,0,0,0,0|2,0,1]=4 826 B4R0.3 [O-][Cr](=O)([O-])[O-] CHEBI:30072 [0,1,0,0,0,0|2,0,1]=4 827 B4R0.3 [O-][Fe](=O)(=O)[O-] CHEBI:30992 [0,1,0,0,0,0|2,0,1]=4 828 B4R0.3 [O-][Fe](=O)([O-])[O-] CHEBI:30993 [0,1,0,0,0,0|2,0,1]=4 829 B4R0.3 [O-][Mn](=O)(=O)=O CHEBI:25939 [0,1,0,0,0,0|2,0,1]=4 830 B4R0.3 [O-][Mn](=O)(=O)[O-] CHEBI:25152 [0,1,0,0,0,0|2,0,1]=4 831 B4R0.3 [O-][Mn](=O)([O-])[O-] CHEBI:29244 [0,1,0,0,0,0|2,0,1]=4 832 B4R0.3 [O-][Mo](=O)(=O)[O-] CHEBI:132099 [0,1,0,0,0,0|2,0,1]=4 833 B4R0.3 [O-][Mo](=O)(=O)[O-] CHEBI:36264 [0,1,0,0,0,0|2,0,1]=4 834 B4R0.3 [O-][Mo](=O)(=O)[O-] CHEBI:75213 [0,1,0,0,0,0|2,0,1]=4 835 B4R0.3 [O-][Mo](=O)(=O)[O-] CHEBI:75215 [0,1,0,0,0,0|2,0,1]=4 836 B4R0.3 [O-][Mo](=O)(=O)[O-] CHEBI:86473 [0,1,0,0,0,0|2,0,1]=4 837 B4R0.3 [O-][Mo](=O)(=O)[O-] CHEBI:91249 [0,1,0,0,0,0|2,0,1]=4 838 B4R0.3 [O-][Re](=O)(=O)=O CHEBI:49858 [0,1,0,0,0,0|2,0,1]=4 839 B4R0.3 [O-][Re](=O)(=O)[O-] CHEBI:37243 [0,1,0,0,0,0|2,0,1]=4 840 B4R0.3 [O-][Sb](=O)([O-])[O-] CHEBI:30295 [0,1,0,0,0,0|2,0,1]=4 841 B4R0.3 [O-][Se](=O)(=O)[O-] CHEBI:15075 [0,1,0,0,0,0|2,0,1]=4 842 B4R0.3 [O-][Se](=O)(=O)[O-] CHEBI:77775 [0,1,0,0,0,0|2,0,1]=4 843 B4R0.3 [O-][Te](=O)(=O)[O-] CHEBI:30464 [0,1,0,0,0,0|2,0,1]=4 844 B4R0.3 [O-][V](=O)([O-])[O-] CHEBI:35607 [0,1,0,0,0,0|2,0,1]=4 845 B4R0.3 [O-][V](=O)([O-])[O-] CHEBI:46442 [0,1,0,0,0,0|2,0,1]=4 846 B4R0.3 [O-][W](=O)(=O)[O-] CHEBI:46502 [0,1,0,0,0,0|2,0,1]=4 847 B4R0.3 [O-][W](=O)(=O)[O-] CHEBI:63939 [0,1,0,0,0,0|2,0,1]=4 848 B4R0.3 [O-][W](=O)(=O)[O-] CHEBI:63940 [0,1,0,0,0,0|2,0,1]=4 849 B4R1.2 C1C(O1)Cl CHEBI:29129 [0,0,0,1,0,0|1,0,1]=3 850 B4R1.2 C1CC1N CHEBI:34660 [0,0,0,1,0,0|2,0,1]=4 851 B4R1.2 CC1=CC1 CHEBI:132592 [0,0,0,1,0,0|2,0,0]=3 852 B4R1.2 CC1CO1 CHEBI:38685 [0,0,0,1,0,0|1,0,1]=3 853 B4R1.2 C[C@@H]1CO1 CHEBI:28985 [0,0,0,1,0,0|1,0,1]=3 854 B4R1.2 C[C@H]1CO1 CHEBI:28982 [0,0,0,1,0,0|1,0,1]=3 855 B1R0.1 B#B CHEBI:51707 [2,0,0,0,0,0|2,0,0]=4 856 B1R0.1 B#N CHEBI:50883 [2,0,0,0,0,0|2,0,0]=4 857 B1R0.1 B#[O+] CHEBI:30161 [2,0,0,0,0,0|1,0,1]=4 858 B1R0.1 BB CHEBI:38288 [2,0,0,0,0,0|2,0,0]=4 859 B1R0.1 BO CHEBI:38268 [2,0,0,0,0,0|1,0,0]=3 860 B1R0.1 BrBr CHEBI:29224 [2,0,0,0,0,0|2,0,0]=4 861 B1R0.1 Br[Br+] CHEBI:30074 [2,0,0,0,0,0|2,0,0]=4 862 B1R0.1 C#C CHEBI:27518 [2,0,0,0,0,0|0,0,2]=4 863 B1R0.1 C#N CHEBI:18407 [2,0,0,0,0,0|1,0,1]=4 864 B1R0.1 C#[C-] CHEBI:55387 [2,0,0,0,0,0|0,0,2]=4 865 B1R0.1 C#[C-] CHEBI:55390 [2,0,0,0,0,0|0,0,2]=4 866 B1R0.1 C#[C] CHEBI:30085 [2,0,0,0,0,0|0,0,2]=4 867 B1R0.1 C#[O+] CHEBI:58072 [2,0,0,0,0,0|0,0,2]=4 868 B1R0.1 C=C CHEBI:18153 [2,0,0,0,0,0|0,0,1]=3 869 B1R0.1 C=N CHEBI:38220 [2,0,0,0,0,0|1,0,0]=3 870 B1R0.1 C=O CHEBI:16842 [2,0,0,0,0,0|0,0,0]=2 871 B1R0.1 CBr CHEBI:39275 [2,0,0,0,0,0|1,0,0]=3 872 B1R0.1 CC CHEBI:42266 [2,0,0,0,0,0|0,0,1]=3 873 B1R0.1 CCl CHEBI:36014 [2,0,0,0,0,0|1,0,0]=3 874 B1R0.1 CF CHEBI:28826 [2,0,0,0,0,0|1,0,0]=3 875 B1R0.1 CI CHEBI:39282 [2,0,0,0,0,0|1,0,0]=3 876 B1R0.1 CN CHEBI:16830 [2,0,0,0,0,0|1,0,0]=3 877 B1R0.1 CO CHEBI:17790 [2,0,0,0,0,0|0,0,0]=2 878 B1R0.1 CP CHEBI:35887 [2,0,0,0,0,0|1,0,0]=3 879 B1R0.1 CS CHEBI:16007 [2,0,0,0,0,0|0,1,0]=3 880 B1R0.1 C[CH2] CHEBI:62801 [2,0,0,0,0,0|0,0,1]=3 881 B1R0.1 C[Co+2] CHEBI:85035 [2,0,0,0,0,0|1,0,0]=3 882 B1R0.1 C[Hg+] CHEBI:49747 [2,0,0,0,0,0|1,0,0]=3 883 B1R0.1 C[Hg] CHEBI:30785 [2,0,0,0,0,0|1,0,0]=3 884 B1R0.1 C[NH3+] CHEBI:59337 [2,0,0,0,0,0|1,0,0]=3 885 B1R0.1 C[NH3+] CHEBI:59338 [2,0,0,0,0,0|1,0,0]=3 886 B1R0.1 C[O-] CHEBI:52090 [2,0,0,0,0,0|0,0,1]=3 887 B1R0.1 C[O] CHEBI:32772 [2,0,0,0,0,0|0,0,1]=3 888 B1R0.1 C[SeH] CHEBI:64685 [2,0,0,0,0,0|0,1,0]=3 889 B1R0.1 ClCl CHEBI:29310 [2,0,0,0,0,0|2,0,0]=4 890 B1R0.1 Cl[201Tl] CHEBI:32213 [2,0,0,0,0,0|2,0,0]=4 891 B1R0.1 Cl[Cl+] CHEBI:29419 [2,0,0,0,0,0|2,0,0]=4 892 B1R0.1 Cl[Cu] CHEBI:53472 [2,0,0,0,0,0|2,0,0]=4 893 B1R0.1 Cl[Tl] CHEBI:37117 [2,0,0,0,0,0|2,0,0]=4 894 B1R0.1 FCl CHEBI:30121 [2,0,0,0,0,0|2,0,0]=4 895 B1R0.1 FF CHEBI:30236 [2,0,0,0,0,0|2,0,0]=4 896 B1R0.1 F[Cl+] CHEBI:30122 [2,0,0,0,0,0|2,0,0]=4 897 B1R0.1 F[F+] CHEBI:30237 [2,0,0,0,0,0|2,0,0]=4 898 B1R0.1 II CHEBI:17606 [2,0,0,0,0,0|2,0,0]=4 899 B1R0.1 I[I+] CHEBI:36899 [2,0,0,0,0,0|2,0,0]=4 900 B1R0.1 N#N CHEBI:17997 [2,0,0,0,0,0|2,0,0]=4 901 B1R0.1 N#[Al] CHEBI:50884 [2,0,0,0,0,0|2,0,0]=4 902 B1R0.1 N#[N+2] CHEBI:29275 [2,0,0,0,0,0|2,0,0]=4 903 B1R0.1 N#[N+] CHEBI:29276 [2,0,0,0,0,0|2,0,0]=4 904 B1R0.1 N#[O+] CHEBI:29120 [2,0,0,0,0,0|1,0,1]=4 905 B1R0.1 N=N CHEBI:30096 [2,0,0,0,0,0|2,0,0]=4 906 B1R0.1 N=O CHEBI:84879 [2,0,0,0,0,0|1,0,0]=3 907 B1R0.1 N=[N-] CHEBI:30103 [2,0,0,0,0,0|2,0,0]=4 908 B1R0.1 NN CHEBI:15571 [2,0,0,0,0,0|2,0,0]=4 909 B1R0.1 NN CHEBI:35511 [2,0,0,0,0,0|2,0,0]=4 910 B1R0.1 NO CHEBI:15429 [2,0,0,0,0,0|1,0,0]=3 911 B1R0.1 N[N-2] CHEBI:30101 [2,0,0,0,0,0|2,0,0]=4 912 B1R0.1 N[NH-] CHEBI:30095 [2,0,0,0,0,0|2,0,0]=4 913 B1R0.1 N[NH] CHEBI:30093 [2,0,0,0,0,0|2,0,0]=4 914 B1R0.1 N[O-] CHEBI:29773 [2,0,0,0,0,0|1,0,1]=4 915 B1R0.1 N[O] CHEBI:29767 [2,0,0,0,0,0|1,0,1]=4 916 B1R0.1 O#[Si+] CHEBI:30589 [2,0,0,0,0,0|0,1,1]=4 917 B1R0.1 O=O CHEBI:15379 [2,0,0,0,0,0|0,0,1]=3 918 B1R0.1 O=O CHEBI:26689 [2,0,0,0,0,0|0,0,1]=3 919 B1R0.1 O=S CHEBI:45822 [2,0,0,0,0,0|0,1,0]=3 920 B1R0.1 O=[Al+] CHEBI:30129 [2,0,0,0,0,0|1,0,0]=3 921 B1R0.1 O=[Al] CHEBI:30128 [2,0,0,0,0,0|1,0,0]=3 922 B1R0.1 O=[AsH3] CHEBI:35844 [2,0,0,0,0,0|1,0,0]=3 923 B1R0.1 O=[Br+] CHEBI:29873 [2,0,0,0,0,0|1,0,0]=3 924 B1R0.1 O=[Ca] CHEBI:31344 [2,0,0,0,0,0|1,0,0]=3 925 B1R0.1 O=[F+] CHEBI:30243 [2,0,0,0,0,0|1,0,0]=3 926 B1R0.1 O=[Fe] CHEBI:50820 [2,0,0,0,0,0|1,0,0]=3 927 B1R0.1 O=[I+] CHEBI:29899 [2,0,0,0,0,0|1,0,0]=3 928 B1R0.1 O=[O+] CHEBI:29372 [2,0,0,0,0,0|0,0,1]=3 929 B1R0.1 O=[P-] CHEBI:33125 [2,0,0,0,0,0|1,0,0]=3 930 B1R0.1 O=[P] CHEBI:29315 [2,0,0,0,0,0|1,0,0]=3 931 B1R0.1 O=[S+] CHEBI:29823 [2,0,0,0,0,0|0,1,0]=3 932 B1R0.1 O=[Ti] CHEBI:134455 [2,0,0,0,0,0|1,0,0]=3 933 B1R0.1 O=[V+2] CHEBI:30046 [2,0,0,0,0,0|1,0,0]=3 934 B1R0.1 O=[V] CHEBI:30044 [2,0,0,0,0,0|1,0,0]=3 935 B1R0.1 O=[Zn] CHEBI:36560 [2,0,0,0,0,0|1,0,0]=3 936 B1R0.1 OBr CHEBI:29249 [2,0,0,0,0,0|1,0,0]=3 937 B1R0.1 OCl CHEBI:24757 [2,0,0,0,0,0|1,0,0]=3 938 B1R0.1 OF CHEBI:47864 [2,0,0,0,0,0|1,0,0]=3 939 B1R0.1 OI CHEBI:29231 [2,0,0,0,0,0|1,0,0]=3 940 B1R0.1 OO CHEBI:16240 [2,0,0,0,0,0|0,0,1]=3 941 B1R0.1 OP CHEBI:29260 [2,0,0,0,0,0|1,0,0]=3 942 B1R0.1 OS CHEBI:37858 [2,0,0,0,0,0|0,1,0]=3 943 B1R0.1 O[AsH2] CHEBI:29844 [2,0,0,0,0,0|1,0,0]=3 944 B1R0.1 O[Ba] CHEBI:35112 [2,0,0,0,0,0|1,0,0]=3 945 B1R0.1 O[Ca] CHEBI:35111 [2,0,0,0,0,0|1,0,0]=3 946 B1R0.1 O[Mg] CHEBI:35110 [2,0,0,0,0,0|1,0,0]=3 947 B1R0.1 O[O-] CHEBI:29192 [2,0,0,0,0,0|0,0,1]=3 948 B1R0.1 O[OH+] CHEBI:30492 [2,0,0,0,0,0|0,0,1]=3 949 B1R0.1 O[O] CHEBI:25935 [2,0,0,0,0,0|0,0,1]=3 950 B1R0.1 O[SbH2] CHEBI:30301 [2,0,0,0,0,0|1,0,0]=3 951 B1R0.1 O[SiH3] CHEBI:37173 [2,0,0,0,0,0|0,1,0]=3 952 B1R0.1 O[Sr] CHEBI:35109 [2,0,0,0,0,0|1,0,0]=3 953 B1R0.1 P#P CHEBI:33472 [2,0,0,0,0,0|2,0,0]=4 954 B1R0.1 P#[P+] CHEBI:33476 [2,0,0,0,0,0|2,0,0]=4 955 B1R0.1 PP CHEBI:35880 [2,0,0,0,0,0|2,0,0]=4 956 B1R0.1 S=S CHEBI:29387 [2,0,0,0,0,0|0,2,0]=4 957 B1R0.1 S=[Cd] CHEBI:50833 [2,0,0,0,0,0|1,1,0]=4 958 B1R0.1 S=[S+] CHEBI:29397 [2,0,0,0,0,0|0,2,0]=4 959 B1R0.1 SS CHEBI:33114 [2,0,0,0,0,0|0,2,0]=4 960 B1R0.1 S[S-] CHEBI:30604 [2,0,0,0,0,0|0,2,0]=4 961 B1R0.1 [*]N CHEBI:32877 [2,0,0,0,0,0|2,0,0]=4 962 B1R0.1 [1H][1H+] CHEBI:29297 [2,0,0,0,0,0|2,0,0]=4 963 B1R0.1 [1H][1H] CHEBI:29299 [2,0,0,0,0,0|2,0,0]=4 964 B1R0.1 [2H]O CHEBI:33806 [2,0,0,0,0,0|1,0,0]=3 965 B1R0.1 [2H][2H+] CHEBI:29295 [2,0,0,0,0,0|2,0,0]=4 966 B1R0.1 [2H][2H] CHEBI:29294 [2,0,0,0,0,0|2,0,0]=4 967 B1R0.1 [3H]O CHEBI:33811 [2,0,0,0,0,0|1,0,0]=3 968 B1R0.1 [3H][3H+] CHEBI:29296 [2,0,0,0,0,0|2,0,0]=4 969 B1R0.1 [3H][3H] CHEBI:29298 [2,0,0,0,0,0|2,0,0]=4 970 B1R0.1 [Al+]Cl CHEBI:30132 [2,0,0,0,0,0|2,0,0]=4 971 B1R0.1 [Al-2]=[Al+] CHEBI:30117 [2,0,0,0,0,0|2,0,0]=4 972 B1R0.1 [Al]#[Al] CHEBI:30116 [2,0,0,0,0,0|2,0,0]=4 973 B1R0.1 [Al]=[Al+] CHEBI:33621 [2,0,0,0,0,0|2,0,0]=4 974 B1R0.1 [Al]Cl CHEBI:30131 [2,0,0,0,0,0|2,0,0]=4 975 B1R0.1 [AsH-][As-2] CHEBI:35872 [2,0,0,0,0,0|2,0,0]=4 976 B1R0.1 [AsH2][AsH2] CHEBI:33110 [2,0,0,0,0,0|2,0,0]=4 977 B1R0.1 [AsH]=[As-] CHEBI:35870 [2,0,0,0,0,0|2,0,0]=4 978 B1R0.1 [AsH]=[AsH] CHEBI:33107 [2,0,0,0,0,0|2,0,0]=4 979 B1R0.1 [AsH]=[AsH] CHEBI:33108 [2,0,0,0,0,0|2,0,0]=4 980 B1R0.1 [AsH]=[AsH] CHEBI:33109 [2,0,0,0,0,0|2,0,0]=4 981 B1R0.1 [As]#[As+] CHEBI:35869 [2,0,0,0,0,0|2,0,0]=4 982 B1R0.1 [As]#[As] CHEBI:35830 [2,0,0,0,0,0|2,0,0]=4 983 B1R0.1 [At][At] CHEBI:30414 [2,0,0,0,0,0|2,0,0]=4 984 B1R0.1 [B+2][B+2] CHEBI:51709 [2,0,0,0,0,0|2,0,0]=4 985 B1R0.1 [B]=O CHEBI:30162 [2,0,0,0,0,0|1,0,0]=3 986 B1R0.1 [B]C CHEBI:38987 [2,0,0,0,0,0|1,0,0]=3 987 B1R0.1 [B][O-] CHEBI:30160 [2,0,0,0,0,0|1,0,1]=4 988 B1R0.1 [Be]=O CHEBI:62842 [2,0,0,0,0,0|1,0,0]=3 989 B1R0.1 [Be]O CHEBI:35103 [2,0,0,0,0,0|1,0,0]=3 990 B1R0.1 [Br-]Br CHEBI:30075 [2,0,0,0,0,0|2,0,0]=4 991 B1R0.1 [C+]#N CHEBI:29307 [2,0,0,0,0,0|1,0,1]=4 992 B1R0.1 [C+]#[O+] CHEBI:29334 [2,0,0,0,0,0|0,0,2]=4 993 B1R0.1 [C-]#N CHEBI:17514 [2,0,0,0,0,0|1,0,1]=4 994 B1R0.1 [C-]#N CHEBI:33191 [2,0,0,0,0,0|1,0,1]=4 995 B1R0.1 [C-]#N CHEBI:33192 [2,0,0,0,0,0|1,0,1]=4 996 B1R0.1 [C-]#[C+] CHEBI:30083 [2,0,0,0,0,0|0,0,2]=4 997 B1R0.1 [C-]#[C-] CHEBI:30081 [2,0,0,0,0,0|0,0,2]=4 998 B1R0.1 [C-]#[C-] CHEBI:55388 [2,0,0,0,0,0|0,0,2]=4 999 B1R0.1 [C-]#[C] CHEBI:30082 [2,0,0,0,0,0|0,0,2]=4 1000 B1R0.1 [C-]#[NH+] CHEBI:36856 [2,0,0,0,0,0|1,0,1]=4 1001 B1R0.1 [C-]#[O+] CHEBI:17245 [2,0,0,0,0,0|0,0,2]=4 1002 B1R0.1 [C-]#[S+] CHEBI:30253 [2,0,0,0,0,0|0,1,1]=4 1003 B1R0.1 [C-]#[Si+] CHEBI:29390 [2,0,0,0,0,0|0,1,1]=4 1004 B1R0.1 [C-]=O CHEBI:29335 [2,0,0,0,0,0|0,0,1]=3 1005 B1R0.1 [C-]=S CHEBI:30255 [2,0,0,0,0,0|0,1,1]=4 1006 B1R0.1 [CH]=O CHEBI:29327 [2,0,0,0,0,0|0,0,1]=3 1007 B1R0.1 [C]#N CHEBI:29306 [2,0,0,0,0,0|1,0,1]=4 1008 B1R0.1 [C]#[C+] CHEBI:30084 [2,0,0,0,0,0|0,0,2]=4 1009 B1R0.1 [C]#[O+] CHEBI:29333 [2,0,0,0,0,0|0,0,2]=4 1010 B1R0.1 [C]#[S+] CHEBI:30254 [2,0,0,0,0,0|0,1,1]=4 1011 B1R0.1 [Cl-]Cl CHEBI:29413 [2,0,0,0,0,0|2,0,0]=4 1012 B1R0.1 [F-]F CHEBI:30238 [2,0,0,0,0,0|2,0,0]=4 1013 B1R0.1 [H+][Li] CHEBI:30147 [2,0,0,0,0,0|2,0,0]=4 1014 B1R0.1 [H+][N] CHEBI:29344 [2,0,0,0,0,0|2,0,0]=4 1015 B1R0.1 [H+][P] CHEBI:29940 [2,0,0,0,0,0|2,0,0]=4 1016 B1R0.1 [H-][Li] CHEBI:30148 [2,0,0,0,0,0|2,0,0]=4 1017 B1R0.1 [He+][He+] CHEBI:33684 [2,0,0,0,0,0|2,0,0]=4 1018 B1R0.1 [He-][He] CHEBI:33686 [2,0,0,0,0,0|2,0,0]=4 1019 B1R0.1 [He][He+] CHEBI:33682 [2,0,0,0,0,0|2,0,0]=4 1020 B1R0.1 [He][He] CHEBI:33685 [2,0,0,0,0,0|2,0,0]=4 1021 B1R0.1 [Hg+][Hg+] CHEBI:25198 [2,0,0,0,0,0|2,0,0]=4 1022 B1R0.1 [I-]I CHEBI:36898 [2,0,0,0,0,0|2,0,0]=4 1023 B1R0.1 [In]#[In] CHEBI:37116 [2,0,0,0,0,0|2,0,0]=4 1024 B1R0.1 [Li]C CHEBI:51486 [2,0,0,0,0,0|1,0,0]=3 1025 B1R0.1 [Mo]#[Mo] CHEBI:37238 [2,0,0,0,0,0|2,0,0]=4 1026 B1R0.1 [N-2][N-2] CHEBI:29278 [2,0,0,0,0,0|2,0,0]=4 1027 B1R0.1 [N-]=O CHEBI:29121 [2,0,0,0,0,0|1,0,0]=3 1028 B1R0.1 [N-]=[N-] CHEBI:29277 [2,0,0,0,0,0|2,0,0]=4 1029 B1R0.1 [NH+]#N CHEBI:30102 [2,0,0,0,0,0|2,0,0]=4 1030 B1R0.1 [NH+]#[NH+] CHEBI:30099 [2,0,0,0,0,0|2,0,0]=4 1031 B1R0.1 [NH-]O CHEBI:29772 [2,0,0,0,0,0|1,0,0]=3 1032 B1R0.1 [NH-][N-2] CHEBI:30104 [2,0,0,0,0,0|2,0,0]=4 1033 B1R0.1 [NH-][NH-] CHEBI:30100 [2,0,0,0,0,0|2,0,0]=4 1034 B1R0.1 [NH2+]=N CHEBI:30094 [2,0,0,0,0,0|2,0,0]=4 1035 B1R0.1 [NH3+]N CHEBI:35324 [2,0,0,0,0,0|2,0,0]=4 1036 B1R0.1 [NH3+][NH3+] CHEBI:35325 [2,0,0,0,0,0|2,0,0]=4 1037 B1R0.1 [NH]O CHEBI:29768 [2,0,0,0,0,0|1,0,0]=3 1038 B1R0.1 [N]=O CHEBI:16480 [2,0,0,0,0,0|1,0,0]=3 1039 B1R0.1 [N]=S CHEBI:29451 [2,0,0,0,0,0|1,1,0]=4 1040 B1R0.1 [N][O-] CHEBI:29272 [2,0,0,0,0,0|1,0,1]=4 1041 B1R0.1 [O+]#P CHEBI:33124 [2,0,0,0,0,0|1,0,1]=4 1042 B1R0.1 [O+]#[O+] CHEBI:29371 [2,0,0,0,0,0|0,0,2]=4 1043 B1R0.1 [O+]#[Si-] CHEBI:30588 [2,0,0,0,0,0|0,1,1]=4 1044 B1R0.1 [O-]Br CHEBI:29250 [2,0,0,0,0,0|1,0,1]=4 1045 B1R0.1 [O-]Cl CHEBI:29222 [2,0,0,0,0,0|1,0,1]=4 1046 B1R0.1 [O-]Cl CHEBI:32146 [2,0,0,0,0,0|1,0,1]=4 1047 B1R0.1 [O-]F CHEBI:30244 [2,0,0,0,0,0|1,0,1]=4 1048 B1R0.1 [O-]I CHEBI:29232 [2,0,0,0,0,0|1,0,1]=4 1049 B1R0.1 [O-]S CHEBI:37859 [2,0,0,0,0,0|0,1,1]=4 1050 B1R0.1 [O-][Al] CHEBI:30130 [2,0,0,0,0,0|1,0,1]=4 1051 B1R0.1 [O-][AsH2] CHEBI:29845 [2,0,0,0,0,0|1,0,1]=4 1052 B1R0.1 [O-][I-] CHEBI:29900 [2,0,0,0,0,0|1,0,1]=4 1053 B1R0.1 [O-][O-] CHEBI:44785 [2,0,0,0,0,0|0,0,2]=4 1054 B1R0.1 [O-][O] CHEBI:18421 [2,0,0,0,0,0|0,0,2]=4 1055 B1R0.1 [OH+]=O CHEBI:29793 [2,0,0,0,0,0|0,0,1]=3 1056 B1R0.1 [O]Br CHEBI:29876 [2,0,0,0,0,0|1,0,1]=4 1057 B1R0.1 [O]Cl CHEBI:29314 [2,0,0,0,0,0|1,0,1]=4 1058 B1R0.1 [O]F CHEBI:30242 [2,0,0,0,0,0|1,0,1]=4 1059 B1R0.1 [O]I CHEBI:29896 [2,0,0,0,0,0|1,0,1]=4 1060 B1R0.1 [O][O] CHEBI:27140 [2,0,0,0,0,0|0,0,2]=4 1061 B1R0.1 [O][S-] CHEBI:29824 [2,0,0,0,0,0|0,1,1]=4 1062 B1R0.1 [P-]=[P-] CHEBI:33479 [2,0,0,0,0,0|2,0,0]=4 1063 B1R0.1 [P-]=[P] CHEBI:33480 [2,0,0,0,0,0|2,0,0]=4 1064 B1R0.1 [S-][S-] CHEBI:29396 [2,0,0,0,0,0|0,2,0]=4 1065 B1R0.1 [S-][S-] CHEBI:86471 [2,0,0,0,0,0|0,2,0]=4 1066 B1R0.1 [S-][S] CHEBI:29395 [2,0,0,0,0,0|0,2,0]=4 1067 B1R0.1 [Sb]#[Sb] CHEBI:30303 [2,0,0,0,0,0|2,0,0]=4 1068 B1R0.1 [SeH][Se-] CHEBI:30603 [2,0,0,0,0,0|0,2,0]=4 1069 B1R0.1 [SeH][SeH] CHEBI:50476 [2,0,0,0,0,0|0,2,0]=4 1070 B1R0.1 [Se]=[Cd] CHEBI:50834 [2,0,0,0,0,0|1,1,0]=4 1071 B1R0.1 [Se]=[Se] CHEBI:36905 [2,0,0,0,0,0|0,2,0]=4 1072 B1R0.1 [Si-]#[Si-] CHEBI:30592 [2,0,0,0,0,0|0,2,0]=4 1073 B1R0.1 [SiH3][SiH2+] CHEBI:30595 [2,0,0,0,0,0|0,2,0]=4 1074 B1R0.1 [SiH3][SiH2-] CHEBI:30596 [2,0,0,0,0,0|0,2,0]=4 1075 B1R0.1 [SiH3][SiH2] CHEBI:30593 [2,0,0,0,0,0|0,2,0]=4 1076 B1R0.1 [SiH3][SiH3] CHEBI:30597 [2,0,0,0,0,0|0,2,0]=4 1077 B1R0.1 [Si]#[Si+] CHEBI:30591 [2,0,0,0,0,0|0,2,0]=4 1078 B1R0.1 [Si]#[Si] CHEBI:30590 [2,0,0,0,0,0|0,2,0]=4 1079 B1R0.1 [TeH][Te-] CHEBI:30600 [2,0,0,0,0,0|0,2,0]=4 1080 B1R0.1 [TeH][TeH] CHEBI:50478 [2,0,0,0,0,0|0,2,0]=4 1081 B1R0.1 [Tl]#[Tl] CHEBI:37118 [2,0,0,0,0,0|2,0,0]=4 1082 B1R0.1 [U]#[U] CHEBI:50560 [2,0,0,0,0,0|2,0,0]=4 1083 B1R0.1 [Zn]=[Zn] CHEBI:37256 [2,0,0,0,0,0|2,0,0]=4 1084 B3R0.1 B(BO)O CHEBI:38274 [1,1,0,0,0,0|1,0,1]=4 1085 B3R0.1 C#CC=O CHEBI:27976 [1,1,0,0,0,0|0,0,1]=3 1086 B3R0.1 C#CCO CHEBI:28905 [1,1,0,0,0,0|0,0,2]=4 1087 B3R0.1 C(#N)O[K] CHEBI:38904 [1,1,0,0,0,0|1,0,1]=4 1088 B3R0.1 C(#N)O[Na] CHEBI:38906 [1,1,0,0,0,0|1,0,1]=4 1089 B3R0.1 C(=C/Cl)/Cl CHEBI:28805 [1,1,0,0,0,0|1,0,1]=4 1090 B3R0.1 C(=C/O)/O CHEBI:131198 [1,1,0,0,0,0|0,0,1]=3 1091 B3R0.1 C(=C\Cl)/Cl CHEBI:18882 [1,1,0,0,0,0|1,0,1]=4 1092 B3R0.1 C(=C\Cl)/Cl CHEBI:29027 [1,1,0,0,0,0|1,0,1]=4 1093 B3R0.1 C(=O)C=O CHEBI:34779 [1,1,0,0,0,0|0,0,1]=3 1094 B3R0.1 C(C=O)Cl CHEBI:27871 [1,1,0,0,0,0|0,0,0]=2 1095 B3R0.1 C(C=O)F CHEBI:14272 [1,1,0,0,0,0|0,0,0]=2 1096 B3R0.1 C(C=O)N CHEBI:17628 [1,1,0,0,0,0|0,0,0]=2 1097 B3R0.1 C(C=O)O CHEBI:17071 [1,1,0,0,0,0|0,0,0]=2 1098 B3R0.1 C(C=O)[NH3+] CHEBI:58213 [1,1,0,0,0,0|0,0,0]=2 1099 B3R0.1 C(CBr)Br CHEBI:28534 [1,1,0,0,0,0|1,0,1]=4 1100 B3R0.1 C(CBr)Cl CHEBI:19032 [1,1,0,0,0,0|1,0,1]=4 1101 B3R0.1 C(CCl)Cl CHEBI:27789 [1,1,0,0,0,0|1,0,1]=4 1102 B3R0.1 C(CCl)O CHEBI:28200 [1,1,0,0,0,0|0,0,1]=3 1103 B3R0.1 C(CN)N CHEBI:30346 [1,1,0,0,0,0|1,0,1]=4 1104 B3R0.1 C(CN)N CHEBI:30347 [1,1,0,0,0,0|1,0,1]=4 1105 B3R0.1 C(CN)N CHEBI:53626 [1,1,0,0,0,0|1,0,1]=4 1106 B3R0.1 C(CO)N CHEBI:16000 [1,1,0,0,0,0|0,0,1]=3 1107 B3R0.1 C(CO)O CHEBI:30742 [1,1,0,0,0,0|0,0,1]=3 1108 B3R0.1 C(CO)[NH3+] CHEBI:57603 [1,1,0,0,0,0|0,0,1]=3 1109 B3R0.1 C(CO)[NH3+] CHEBI:63878 [1,1,0,0,0,0|0,0,1]=3 1110 B3R0.1 C(CS)N CHEBI:17141 [1,1,0,0,0,0|0,1,1]=4 1111 B3R0.1 C(CS)O CHEBI:41218 [1,1,0,0,0,0|0,0,1]=3 1112 B3R0.1 C(CS)[NH3+] CHEBI:58029 [1,1,0,0,0,0|0,1,1]=4 1113 B3R0.1 C=CC#C CHEBI:48088 [1,1,0,0,0,0|1,0,1]=4 1114 B3R0.1 C=CC#N CHEBI:28217 [1,1,0,0,0,0|1,0,1]=4 1115 B3R0.1 C=CC=C CHEBI:39478 [1,1,0,0,0,0|1,0,1]=4 1116 B3R0.1 C=CC=O CHEBI:15368 [1,1,0,0,0,0|0,0,1]=3 1117 B3R0.1 C=CC=S CHEBI:59787 [1,1,0,0,0,0|0,1,1]=4 1118 B3R0.1 C=CCO CHEBI:16605 [1,1,0,0,0,0|0,0,1]=3 1119 B3R0.1 CC#N=S CHEBI:47842 [1,1,0,0,0,0|0,1,1]=4 1120 B3R0.1 CC#[N+][O-] CHEBI:47841 [1,1,0,0,0,0|0,0,2]=4 1121 B3R0.1 CC=C=C CHEBI:39480 [1,1,0,0,0,0|1,0,0]=3 1122 B3R0.1 CC=[N+]=[N-] CHEBI:87492 [1,1,0,0,0,0|1,0,0]=3 1123 B3R0.1 CCC#C CHEBI:48087 [1,1,0,0,0,0|1,0,1]=4 1124 B3R0.1 CCC#N CHEBI:26307 [1,1,0,0,0,0|1,0,1]=4 1125 B3R0.1 CCC=C CHEBI:48362 [1,1,0,0,0,0|1,0,0]=3 1126 B3R0.1 CCC=O CHEBI:17153 [1,1,0,0,0,0|0,0,0]=2 1127 B3R0.1 CCCBr CHEBI:47105 [1,1,0,0,0,0|1,0,1]=4 1128 B3R0.1 CCCC CHEBI:37808 [1,1,0,0,0,0|1,0,1]=4 1129 B3R0.1 CCCN CHEBI:39870 [1,1,0,0,0,0|1,0,1]=4 1130 B3R0.1 CCCO CHEBI:28831 [1,1,0,0,0,0|0,0,1]=3 1131 B3R0.1 CCCP CHEBI:35891 [1,1,0,0,0,0|1,0,1]=4 1132 B3R0.1 CCCS CHEBI:8473 [1,1,0,0,0,0|0,1,1]=4 1133 B3R0.1 CCC[NH3+] CHEBI:566825 [1,1,0,0,0,0|1,0,1]=4 1134 B3R0.1 CCN=O CHEBI:50722 [1,1,0,0,0,0|0,0,1]=3 1135 B3R0.1 CCOC CHEBI:39832 [1,1,0,0,0,0|0,0,1]=3 1136 B3R0.1 CC[Mg]Cl CHEBI:51239 [1,1,0,0,0,0|1,0,1]=4 1137 B3R0.1 CN=C=O CHEBI:59059 [1,1,0,0,0,0|0,0,1]=3 1138 B3R0.1 CN=C=S CHEBI:78337 [1,1,0,0,0,0|0,1,1]=4 1139 B3R0.1 CNC=O CHEBI:7438 [1,1,0,0,0,0|0,0,0]=2 1140 B3R0.1 CNNC CHEBI:73755 [1,1,0,0,0,0|2,0,0]=4 1141 B3R0.1 CNNC CHEBI:73759 [1,1,0,0,0,0|2,0,0]=4 1142 B3R0.1 COC#N CHEBI:38907 [1,1,0,0,0,0|1,0,1]=4 1143 B3R0.1 COC=O CHEBI:77699 [1,1,0,0,0,0|0,0,0]=2 1144 B3R0.1 COCO CHEBI:46791 [1,1,0,0,0,0|0,0,1]=3 1145 B3R0.1 COOC CHEBI:35928 [1,1,0,0,0,0|1,0,0]=3 1146 B3R0.1 CSC#N CHEBI:61112 [1,1,0,0,0,0|1,0,1]=4 1147 B3R0.1 CSSC CHEBI:4608 [1,1,0,0,0,0|1,1,0]=4 1148 B3R0.1 C[NH2+][NH2+]C CHEBI:73760 [1,1,0,0,0,0|2,0,0]=4 1149 B3R0.1 C[Te][Te]C CHEBI:68648 [1,1,0,0,0,0|1,1,0]=4 1150 B3R0.1 C\C=C/C CHEBI:48366 [1,1,0,0,0,0|1,0,0]=3 1151 B3R0.1 C\C=C\C CHEBI:48363 [1,1,0,0,0,0|1,0,0]=3 1152 B3R0.1 C\C=C\C CHEBI:48365 [1,1,0,0,0,0|1,0,0]=3 1153 B3R0.1 C\C=C\S CHEBI:59723 [1,1,0,0,0,0|0,1,0]=3 1154 B3R0.1 C\C=N/N CHEBI:38538 [1,1,0,0,0,0|1,0,0]=3 1155 B3R0.1 C\C=N/O CHEBI:50719 [1,1,0,0,0,0|0,0,0]=2 1156 B3R0.1 C\C=N\N CHEBI:38535 [1,1,0,0,0,0|1,0,0]=3 1157 B3R0.1 C\C=N\N CHEBI:38536 [1,1,0,0,0,0|1,0,0]=3 1158 B3R0.1 C\C=N\O CHEBI:28465 [1,1,0,0,0,0|0,0,0]=2 1159 B3R0.1 C\C=N\O CHEBI:50718 [1,1,0,0,0,0|0,0,0]=2 1160 B3R0.1 N(=NO)O CHEBI:14428 [1,1,0,0,0,0|1,0,1]=4 1161 B3R0.1 N(=N[O-])O CHEBI:50115 [1,1,0,0,0,0|1,0,1]=4 1162 B3R0.1 N(=O)N=O CHEBI:29797 [1,1,0,0,0,0|1,0,1]=4 1163 B3R0.1 N(=O)OO CHEBI:25942 [1,1,0,0,0,0|1,0,0]=3 1164 B3R0.1 N(=O)O[O-] CHEBI:25941 [1,1,0,0,0,0|1,0,0]=3 1165 B3R0.1 N(=O)O[O] CHEBI:29330 [1,1,0,0,0,0|1,0,0]=3 1166 B3R0.1 O(OCl)Cl CHEBI:35927 [1,1,0,0,0,0|2,0,0]=4 1167 B3R0.1 O(OF)F CHEBI:47866 [1,1,0,0,0,0|2,0,0]=4 1168 B3R0.1 O(O[S-])[S-] CHEBI:29391 [1,1,0,0,0,0|1,1,0]=4 1169 B3R0.1 O=ClOCl CHEBI:52354 [1,1,0,0,0,0|1,0,0]=3 1170 B3R0.1 OSSO CHEBI:35921 [1,1,0,0,0,0|1,0,1]=4 1171 B3R0.1 OSS[O-] CHEBI:35922 [1,1,0,0,0,0|1,0,1]=4 1172 B3R0.1 [*]C#CO CHEBI:33824 [1,1,0,0,0,0|0,0,2]=4 1173 B3R0.1 [*]CN[*] CHEBI:50981 [1,1,0,0,0,0|2,0,0]=4 1174 B3R0.1 [*]C[NH2+][*] CHEBI:58855 [1,1,0,0,0,0|2,0,0]=4 1175 B3R0.1 [*]\C=N/O CHEBI:22307 [1,1,0,0,0,0|1,0,0]=3 1176 B3R0.1 [*]\C=N\[*] CHEBI:33271 [1,1,0,0,0,0|2,0,0]=4 1177 B3R0.1 [C](=O)OO CHEBI:29790 [1,1,0,0,0,0|0,0,1]=3 1178 B3R0.1 [C](=O)O[O-] CHEBI:29788 [1,1,0,0,0,0|0,0,1]=3 1179 B3R0.1 [Li]C#CC CHEBI:51473 [1,1,0,0,0,0|1,0,1]=4 1180 B3R0.1 [N](N=O)[O-] CHEBI:29798 [1,1,0,0,0,0|1,0,1]=4 1181 B5R0.1 C#CCC(=O)O CHEBI:1461 [0,2,0,0,0,0|0,0,0]=2 1182 B5R0.1 C#CCC(=O)[O-] CHEBI:62211 [0,2,0,0,0,0|0,0,1]=3 1183 B5R0.1 C(=C/N)/C(=O)O CHEBI:59893 [0,2,0,0,0,0|0,0,1]=3 1184 B5R0.1 C(=C/N)/C(=O)[O-] CHEBI:59894 [0,2,0,0,0,0|0,0,2]=4 1185 B5R0.1 C(=C\Cl)/C(=O)O CHEBI:19982 [0,2,0,0,0,0|0,0,1]=3 1186 B5R0.1 C(=C\Cl)/C(=O)[O-] CHEBI:62074 [0,2,0,0,0,0|0,0,2]=4 1187 B5R0.1 C(C#N)C(=O)O CHEBI:51889 [0,2,0,0,0,0|0,0,0]=2 1188 B5R0.1 C(C(=O)O)NO CHEBI:38049 [0,2,0,0,0,0|0,0,0]=2 1189 B5R0.1 C(C=O)C(=O)O CHEBI:17960 [0,2,0,0,0,0|0,0,0]=2 1190 B5R0.1 C(C=O)C(=O)[O-] CHEBI:33190 [0,2,0,0,0,0|0,0,1]=3 1191 B5R0.1 C(CN)C(=O)N CHEBI:55360 [0,2,0,0,0,0|1,0,0]=3 1192 B5R0.1 C(CN)C(=O)O CHEBI:16958 [0,2,0,0,0,0|0,0,0]=2 1193 B5R0.1 C(CN)C(=O)[O-] CHEBI:63070 [0,2,0,0,0,0|0,0,1]=3 1194 B5R0.1 C(CO)C(=O)O CHEBI:33404 [0,2,0,0,0,0|0,0,0]=2 1195 B5R0.1 C(CO)C(=O)[O-] CHEBI:16510 [0,2,0,0,0,0|0,0,1]=3 1196 B5R0.1 C(CS(=O)O)N CHEBI:16668 [0,2,0,0,0,0|1,0,0]=3 1197 B5R0.1 C(CS(=O)[O-])[NH3+] CHEBI:57853 [0,2,0,0,0,0|1,0,1]=4 1198 B5R0.1 C(CS)C(=O)O CHEBI:44111 [0,2,0,0,0,0|0,0,0]=2 1199 B5R0.1 C(CS)C(=O)[O-] CHEBI:86386 [0,2,0,0,0,0|0,0,1]=3 1200 B5R0.1 C(C[NH3+])C(=O)N CHEBI:58918 [0,2,0,0,0,0|1,0,0]=3 1201 B5R0.1 C(C[NH3+])C(=O)[O-] CHEBI:57966 [0,2,0,0,0,0|0,0,1]=3 1202 B5R0.1 C(N)NC(=O)N CHEBI:15609 [0,2,0,0,0,0|1,0,0]=3 1203 B5R0.1 C(NC(=O)N)O CHEBI:16481 [0,2,0,0,0,0|1,0,0]=3 1204 B5R0.1 C(N[N+](=O)[O-])O CHEBI:24722 [0,2,0,0,0,0|1,0,1]=4 1205 B5R0.1 C([NH3+])NC(=O)N CHEBI:57431 [0,2,0,0,0,0|1,0,0]=3 1206 B5R0.1 C=CCC(=O)O CHEBI:35897 [0,2,0,0,0,0|0,0,0]=2 1207 B5R0.1 C=CCC(=O)[O-] CHEBI:35900 [0,2,0,0,0,0|0,0,1]=3 1208 B5R0.1 C=COC(=O)N CHEBI:27292 [0,2,0,0,0,0|1,0,0]=3 1209 B5R0.1 CC(=C)CCO CHEBI:62898 [0,2,0,0,0,0|1,0,0]=3 1210 B5R0.1 CC(=CC=O)C CHEBI:15825 [0,2,0,0,0,0|1,0,0]=3 1211 B5R0.1 CC(=CCO)C CHEBI:16019 [0,2,0,0,0,0|1,0,0]=3 1212 B5R0.1 CC(=O)CC=C CHEBI:87508 [0,2,0,0,0,0|1,0,0]=3 1213 B5R0.1 CC(=O)CCO CHEBI:41268 [0,2,0,0,0,0|0,0,0]=2 1214 B5R0.1 CC(=O)OC=C CHEBI:46916 [0,2,0,0,0,0|0,0,0]=2 1215 B5R0.1 CC(C)CC=O CHEBI:16638 [0,2,0,0,0,0|1,0,1]=4 1216 B5R0.1 CC(C)CCO CHEBI:15837 [0,2,0,0,0,0|1,0,1]=4 1217 B5R0.1 CC(C)CNO CHEBI:131928 [0,2,0,0,0,0|1,0,1]=4 1218 B5R0.1 CC(C)\C=C\O CHEBI:77922 [0,2,0,0,0,0|1,0,1]=4 1219 B5R0.1 CC(C)\C=N/O CHEBI:61144 [0,2,0,0,0,0|1,0,1]=4 1220 B5R0.1 CC(C)\C=N\O CHEBI:17502 [0,2,0,0,0,0|1,0,1]=4 1221 B5R0.1 CC(C)\C=N\O CHEBI:61143 [0,2,0,0,0,0|1,0,1]=4 1222 B5R0.1 CC(CCO)O CHEBI:52683 [0,2,0,0,0,0|0,0,2]=4 1223 B5R0.1 CC=CC(=O)C CHEBI:89540 [0,2,0,0,0,0|1,0,0]=3 1224 B5R0.1 CCCC(=O)C CHEBI:16472 [0,2,0,0,0,0|1,0,0]=3 1225 B5R0.1 CCCC(=O)N CHEBI:50724 [0,2,0,0,0,0|1,0,0]=3 1226 B5R0.1 CCCC(=O)O CHEBI:30772 [0,2,0,0,0,0|0,0,0]=2 1227 B5R0.1 CCCC(=O)[O-] CHEBI:17968 [0,2,0,0,0,0|0,0,1]=3 1228 B5R0.1 CCCC(=O)[O-] CHEBI:64103 [0,2,0,0,0,0|0,0,1]=3 1229 B5R0.1 CCCC(C)O CHEBI:77518 [0,2,0,0,0,0|1,0,1]=4 1230 B5R0.1 CCC[N+](=O)[O-] CHEBI:76261 [0,2,0,0,0,0|1,0,1]=4 1231 B5R0.1 CCNC(=O)C CHEBI:87370 [0,2,0,0,0,0|1,0,0]=3 1232 B5R0.1 CCOC(=O)C CHEBI:27750 [0,2,0,0,0,0|0,0,0]=2 1233 B5R0.1 CCOC(=O)N CHEBI:17967 [0,2,0,0,0,0|1,0,0]=3 1234 B5R0.1 CCOC(=O)O CHEBI:50849 [0,2,0,0,0,0|0,0,0]=2 1235 B5R0.1 CCOP(=O)O CHEBI:40926 [0,2,0,0,0,0|1,0,0]=3 1236 B5R0.1 CCOP(=O)[O-] CHEBI:84033 [0,2,0,0,0,0|1,0,1]=4 1237 B5R0.1 CN(C)CCO CHEBI:271436 [0,2,0,0,0,0|2,0,0]=4 1238 B5R0.1 CNCC(=O)O CHEBI:15611 [0,2,0,0,0,0|0,0,0]=2 1239 B5R0.1 CNCC(=O)[O-] CHEBI:46915 [0,2,0,0,0,0|0,0,1]=3 1240 B5R0.1 COCC(=O)O CHEBI:132098 [0,2,0,0,0,0|0,0,0]=2 1241 B5R0.1 COCC(=O)[O-] CHEBI:132096 [0,2,0,0,0,0|0,0,1]=3 1242 B5R0.1 COCC(=O)[O-] CHEBI:132097 [0,2,0,0,0,0|0,0,1]=3 1243 B5R0.1 CSCC(=O)O CHEBI:47870 [0,2,0,0,0,0|0,0,0]=2 1244 B5R0.1 CSCC(=O)[O-] CHEBI:18071 [0,2,0,0,0,0|0,0,1]=3 1245 B5R0.1 C[C@@H](CCO)O CHEBI:52688 [0,2,0,0,0,0|0,0,2]=4 1246 B5R0.1 C[C@H](CCO)O CHEBI:52687 [0,2,0,0,0,0|0,0,2]=4 1247 B5R0.1 C[NH2+]CC(=O)O CHEBI:46842 [0,2,0,0,0,0|0,0,0]=2 1248 B5R0.1 C[NH2+]CC(=O)[O-] CHEBI:57433 [0,2,0,0,0,0|0,0,1]=3 1249 B5R0.1 C[S+](C)CCO CHEBI:63035 [0,2,0,0,0,0|2,0,0]=4 1250 B5R0.1 C\C=C/C(=O)O CHEBI:36253 [0,2,0,0,0,0|0,0,0]=2 1251 B5R0.1 C\C=C/C(=O)[O-] CHEBI:36254 [0,2,0,0,0,0|0,0,1]=3 1252 B5R0.1 C\C=C\C(=O)O CHEBI:17217 [0,2,0,0,0,0|0,0,0]=2 1253 B5R0.1 C\C=C\C(=O)O CHEBI:41131 [0,2,0,0,0,0|0,0,0]=2 1254 B5R0.1 C\C=C\C(=O)[O-] CHEBI:35899 [0,2,0,0,0,0|0,0,1]=3 1255 B5R0.1 C\C=C\C(=O)[O-] CHEBI:36258 [0,2,0,0,0,0|0,0,1]=3 1256 B5R0.1 C\[N+](=N\CO)\[O-] CHEBI:29323 [0,2,0,0,0,0|1,0,1]=4 1257 B5R0.1 [*]C#CC(=O)[*] CHEBI:51723 [0,2,0,0,0,0|1,0,1]=4 1258 B5R0.1 [*]C(=O)NO[*] CHEBI:75606 [0,2,0,0,0,0|1,0,0]=3 1259 B5R0.1 [*]C(=O)OCC CHEBI:13209 [0,2,0,0,0,0|1,0,0]=3 1260 B5R0.1 [*]O\N=C(/[*])\[*] CHEBI:36816 [0,2,0,0,0,0|2,0,0]=4 1261 B5R0.1 [Li]C(=C)OCC CHEBI:59557 [0,2,0,0,0,0|1,0,1]=4 1262 B5R0.3 C(#N)C(=O)C#N CHEBI:33187 [0,2,0,0,0,0|1,0,1]=4 1263 B5R0.3 C(=O)(NN)NN CHEBI:61308 [0,2,0,0,0,0|2,0,0]=4 1264 B5R0.3 C(C(=O)C=O)O CHEBI:46660 [0,2,0,0,0,0|0,0,1]=3 1265 B5R0.3 C(C(=O)CO)O CHEBI:16016 [0,2,0,0,0,0|0,0,0]=2 1266 B5R0.3 C(C(=O)NO)N CHEBI:75426 [0,2,0,0,0,0|0,0,0]=2 1267 B5R0.3 C(C(C=O)O)O CHEBI:15693 [0,2,0,0,0,0|0,0,1]=3 1268 B5R0.3 C(C(C=O)O)O CHEBI:5445 [0,2,0,0,0,0|0,0,1]=3 1269 B5R0.3 C(C(CBr)O)O CHEBI:18719 [0,2,0,0,0,0|0,0,2]=4 1270 B5R0.3 C(C(CCl)O)Cl CHEBI:18917 [0,2,0,0,0,0|1,0,1]=4 1271 B5R0.3 C(C(CCl)O)O CHEBI:18721 [0,2,0,0,0,0|0,0,2]=4 1272 B5R0.3 C(C(CO)O)O CHEBI:17522 [0,2,0,0,0,0|0,0,2]=4 1273 B5R0.3 C(C(CO)O)O CHEBI:17754 [0,2,0,0,0,0|0,0,2]=4 1274 B5R0.3 C(C(CS)O)O CHEBI:74537 [0,2,0,0,0,0|0,0,2]=4 1275 B5R0.3 C(C(CS)S)O CHEBI:64198 [0,2,0,0,0,0|0,1,1]=4 1276 B5R0.3 C([C@@H](C=O)O)O CHEBI:27975 [0,2,0,0,0,0|0,0,1]=3 1277 B5R0.3 C([C@H](C=O)O)O CHEBI:17378 [0,2,0,0,0,0|0,0,1]=3 1278 B5R0.3 C([C@H](CCl)O)O CHEBI:18663 [0,2,0,0,0,0|0,0,2]=4 1279 B5R0.3 C([C@H](CS)O)O CHEBI:45619 [0,2,0,0,0,0|0,0,2]=4 1280 B5R0.3 CCC(=O)CC CHEBI:87755 [0,2,0,0,0,0|1,0,0]=3 1281 B5R0.3 CCC(C)C=O CHEBI:16182 [0,2,0,0,0,0|1,0,1]=4 1282 B5R0.3 CCC(C)CO CHEBI:48945 [0,2,0,0,0,0|1,0,1]=4 1283 B5R0.3 CCC(CC)O CHEBI:77519 [0,2,0,0,0,0|1,0,1]=4 1284 B5R0.3 CCC(CO)O CHEBI:52682 [0,2,0,0,0,0|0,0,2]=4 1285 B5R0.3 CCC(C[SnH3])O CHEBI:22843 [0,2,0,0,0,0|1,0,1]=4 1286 B5R0.3 CC[C@@H](C)CO CHEBI:50624 [0,2,0,0,0,0|1,0,1]=4 1287 B5R0.3 CC[C@@H](CO)O CHEBI:52686 [0,2,0,0,0,0|0,0,2]=4 1288 B5R0.3 CC[C@H](C)CO CHEBI:50625 [0,2,0,0,0,0|1,0,1]=4 1289 B5R0.3 CC[C@H](CO)O CHEBI:52685 [0,2,0,0,0,0|0,0,2]=4 1290 B5R0.3 CNC(=O)CS CHEBI:38731 [0,2,0,0,0,0|0,1,0]=3 1291 B5R0.3 CNC(=O)NC CHEBI:80472 [0,2,0,0,0,0|1,0,0]=3 1292 B5R0.3 COC(=O)CN CHEBI:87375 [0,2,0,0,0,0|0,0,0]=2 1293 B5R0.3 COC(=O)OC CHEBI:36596 [0,2,0,0,0,0|0,0,0]=2 1294 B5R0.3 COS(=O)OC CHEBI:48858 [0,2,0,0,0,0|1,0,0]=3 1295 B5R0.3 CO[Se](=O)OC CHEBI:48842 [0,2,0,0,0,0|1,0,0]=3 1296 B5R0.3 C\C(=N\O)\SC CHEBI:38534 [0,2,0,0,0,0|0,1,0]=3 1297 B5R0.4 C(=O)[Si](O)(O)O CHEBI:24098 [0,2,0,0,0,0|1,1,0]=4 1298 B5R0.4 C(N)P(=O)(O)O CHEBI:28812 [0,2,0,0,0,0|1,0,0]=3 1299 B5R0.4 C(O)P(=O)(O)O CHEBI:5810 [0,2,0,0,0,0|1,0,0]=3 1300 B5R0.4 C(O)P(=O)(O)[O-] CHEBI:71199 [0,2,0,0,0,0|1,0,0]=3 1301 B5R0.4 C(O)[Si](O)(O)O CHEBI:24725 [0,2,0,0,0,0|0,1,1]=4 1302 B5R0.4 C([NH3+])P(=O)([O-])[O-] CHEBI:133674 [0,2,0,0,0,0|1,0,1]=4 1303 B5R0.4 CC(C)(C#N)O CHEBI:15348 [0,2,0,0,0,0|1,0,1]=4 1304 B5R0.4 CC(C)(C)OC CHEBI:27642 [0,2,0,0,0,0|1,0,1]=4 1305 B5R0.4 CC(C)(C)OO CHEBI:64090 [0,2,0,0,0,0|1,0,1]=4 1306 B5R0.4 CC(C)(C=C)O CHEBI:132752 [0,2,0,0,0,0|1,0,1]=4 1307 B5R0.4 CC(C)(C=O)O CHEBI:131846 [0,2,0,0,0,0|0,0,1]=3 1308 B5R0.4 CC(C)(CO)O CHEBI:131845 [0,2,0,0,0,0|0,0,2]=4 1309 B5R0.4 CCC(C)(C)O CHEBI:132750 [0,2,0,0,0,0|1,0,1]=4 1310 B5R0.4 CCS(=O)(=O)O CHEBI:42465 [0,2,0,0,0,0|1,0,0]=3 1311 B5R0.4 CCS(=O)(=O)[O-] CHEBI:61909 [0,2,0,0,0,0|1,0,1]=4 1312 B5R0.4 COP(=O)(O)O CHEBI:340824 [0,2,0,0,0,0|1,0,0]=3 1313 B5R0.4 COP(=O)([O-])[O-] CHEBI:59761 [0,2,0,0,0,0|1,0,1]=4 1314 B5R0.4 COS(=O)(=O)C CHEBI:25255 [0,2,0,0,0,0|1,0,0]=3 1315 B5R0.4 COS(=O)(=O)O CHEBI:17760 [0,2,0,0,0,0|1,0,0]=3 1316 B5R0.4 COS(=O)(=O)[O-] CHEBI:58261 [0,2,0,0,0,0|1,0,1]=4 1317 B5R0.4 CSS(=O)(=O)C CHEBI:74357 [0,2,0,0,0,0|1,0,1]=4 1318 B5R0.4 C[Si](C=O)(O)O CHEBI:24096 [0,2,0,0,0,0|0,1,0]=3 1319 B5R0.4 C[Si](CO)(O)O CHEBI:24720 [0,2,0,0,0,0|0,1,1]=4 1320 B5R0.4 NOP(=O)(O)O CHEBI:28048 [0,2,0,0,0,0|2,0,0]=4 1321 B5R0.4 O=Cl(=O)(=O)OCl CHEBI:52353 [0,2,0,0,0,0|2,0,0]=4 1322 B5R0.4 OOP(=O)(O)O CHEBI:29282 [0,2,0,0,0,0|2,0,0]=4 1323 B5R0.4 OOS(=O)(=O)O CHEBI:29286 [0,2,0,0,0,0|2,0,0]=4 1324 B5R0.4 OOS(=O)(=O)[O-] CHEBI:33525 [0,2,0,0,0,0|2,0,0]=4 1325 B5R0.4 OP(=O)([O-])O[O] CHEBI:29928 [0,2,0,0,0,0|2,0,0]=4 1326 B5R0.4 OS(=O)(=O)O[O-] CHEBI:33524 [0,2,0,0,0,0|2,0,0]=4 1327 B5R0.4 OS(=O)(=O)O[O] CHEBI:29929 [0,2,0,0,0,0|2,0,0]=4 1328 B5R0.4 [*]CS(=O)(=O)[O-] CHEBI:62081 [0,2,0,0,0,0|1,0,1]=4 1329 B5R0.4 [*]S(=O)(=O)O[*] CHEBI:83347 [0,2,0,0,0,0|2,0,0]=4 1330 B5R0.4 [O-]OP(=O)([O-])[O-] CHEBI:29283 [0,2,0,0,0,0|2,0,0]=4 1331 B5R0.4 [O-]OS(=O)(=O)[O-] CHEBI:29288 [0,2,0,0,0,0|2,0,0]=4 1332 B5R0.4 [O-]P(=O)([O-])O[O] CHEBI:29933 [0,2,0,0,0,0|2,0,0]=4 1333 B5R0.5 C(=O)(C(=O)N)N CHEBI:48248 [0,2,0,0,0,0|1,0,1]=4 1334 B5R0.5 C(=O)(C(=O)O)N CHEBI:18058 [0,2,0,0,0,0|0,0,1]=3 1335 B5R0.5 C(=O)(C(=O)O)O CHEBI:16995 [0,2,0,0,0,0|0,0,1]=3 1336 B5R0.5 C(=O)(C(=O)[O-])N CHEBI:58363 [0,2,0,0,0,0|0,0,2]=4 1337 B5R0.5 C(=O)(C(=O)[O-])O CHEBI:46904 [0,2,0,0,0,0|0,0,1]=3 1338 B5R0.5 C(=O)(C(=O)[O-])[O-] CHEBI:132764 [0,2,0,0,0,0|0,0,2]=4 1339 B5R0.5 C(=O)(C(=O)[O-])[O-] CHEBI:30623 [0,2,0,0,0,0|0,0,2]=4 1340 B5R0.5 C(=O)(C(=O)[O-])[O-] CHEBI:60579 [0,2,0,0,0,0|0,0,2]=4 1341 B5R0.5 C(=O)(C(=O)[O-])[O-] CHEBI:91241 [0,2,0,0,0,0|0,0,2]=4 1342 B5R0.5 C(C(=O)Cl)(Cl)Cl CHEBI:34688 [0,2,0,0,0,0|1,0,0]=3 1343 B5R0.5 C(C(=O)O)(Br)Br CHEBI:90124 [0,2,0,0,0,0|0,0,0]=2 1344 B5R0.5 C(C(=O)O)(Cl)Br CHEBI:64206 [0,2,0,0,0,0|0,0,0]=2 1345 B5R0.5 C(C(=O)O)(Cl)Cl CHEBI:36386 [0,2,0,0,0,0|0,0,0]=2 1346 B5R0.5 C(C(=O)O)(F)F CHEBI:23716 [0,2,0,0,0,0|0,0,0]=2 1347 B5R0.5 C(C(=O)O)(N)O CHEBI:38048 [0,2,0,0,0,0|0,0,0]=2 1348 B5R0.5 C(C(=O)[O-])(Cl)Cl CHEBI:28240 [0,2,0,0,0,0|0,0,1]=3 1349 B5R0.5 C(C(=O)[O-])(F)F CHEBI:23715 [0,2,0,0,0,0|0,0,1]=3 1350 B5R0.5 C=C(C(=O)O)Cl CHEBI:73963 [0,2,0,0,0,0|0,0,1]=3 1351 B5R0.5 C=C(C(=O)O)N CHEBI:17123 [0,2,0,0,0,0|0,0,1]=3 1352 B5R0.5 C=C(C(=O)O)O CHEBI:86354 [0,2,0,0,0,0|0,0,1]=3 1353 B5R0.5 C=C(C(=O)[O-])Cl CHEBI:73935 [0,2,0,0,0,0|0,0,2]=4 1354 B5R0.5 C=C(C(=O)[O-])N CHEBI:58020 [0,2,0,0,0,0|0,0,2]=4 1355 B5R0.5 C=C(C(=O)[O-])[NH3+] CHEBI:76565 [0,2,0,0,0,0|0,0,2]=4 1356 B5R0.5 CC(=C)C(=O)N CHEBI:51759 [0,2,0,0,0,0|1,0,0]=3 1357 B5R0.5 CC(=C)C(=O)O CHEBI:25219 [0,2,0,0,0,0|0,0,0]=2 1358 B5R0.5 CC(=C)C(=O)[O-] CHEBI:25218 [0,2,0,0,0,0|0,0,1]=3 1359 B5R0.5 CC(=N)C(=O)O CHEBI:76608 [0,2,0,0,0,0|0,0,0]=2 1360 B5R0.5 CC(=N)C(=O)[O-] CHEBI:77456 [0,2,0,0,0,0|0,0,1]=3 1361 B5R0.5 CC(=O)C(=O)C CHEBI:16583 [0,2,0,0,0,0|0,0,1]=3 1362 B5R0.5 CC(=O)C(=O)O CHEBI:32816 [0,2,0,0,0,0|0,0,0]=2 1363 B5R0.5 CC(=O)C(=O)[O-] CHEBI:15361 [0,2,0,0,0,0|0,0,1]=3 1364 B5R0.5 CC(=O)C(=O)[O-] CHEBI:50144 [0,2,0,0,0,0|0,0,1]=3 1365 B5R0.5 CC(=O)N(C)C CHEBI:84254 [0,2,0,0,0,0|1,0,0]=3 1366 B5R0.5 CC(=[NH2+])C(=O)[O-] CHEBI:44400 [0,2,0,0,0,0|0,0,1]=3 1367 B5R0.5 CC(C(=O)C)O CHEBI:15688 [0,2,0,0,0,0|0,0,0]=2 1368 B5R0.5 CC(C(=O)N)O CHEBI:75144 [0,2,0,0,0,0|0,0,1]=3 1369 B5R0.5 CC(C(=O)O)N CHEBI:16449 [0,2,0,0,0,0|0,0,0]=2 1370 B5R0.5 CC(C(=O)O)O CHEBI:78320 [0,2,0,0,0,0|0,0,0]=2 1371 B5R0.5 CC(C(=O)O)S CHEBI:47872 [0,2,0,0,0,0|0,0,0]=2 1372 B5R0.5 CC(C(=O)O)[NH3+] CHEBI:32440 [0,2,0,0,0,0|0,0,0]=2 1373 B5R0.5 CC(C(=O)[O-])N CHEBI:32439 [0,2,0,0,0,0|0,0,1]=3 1374 B5R0.5 CC(C(=O)[O-])O CHEBI:24996 [0,2,0,0,0,0|0,0,1]=3 1375 B5R0.5 CC(C(=O)[O-])O CHEBI:75228 [0,2,0,0,0,0|0,0,1]=3 1376 B5R0.5 CC(C(=O)[O-])[NH3+] CHEBI:66916 [0,2,0,0,0,0|0,0,1]=3 1377 B5R0.5 CC(C(C)O)O CHEBI:62064 [0,2,0,0,0,0|0,0,2]=4 1378 B5R0.5 CC(C)C(=O)O CHEBI:16135 [0,2,0,0,0,0|0,0,0]=2 1379 B5R0.5 CC(C)C(=O)[O-] CHEBI:48944 [0,2,0,0,0,0|0,0,1]=3 1380 B5R0.5 CC(C)C(C)O CHEBI:77517 [0,2,0,0,0,0|1,0,1]=4 1381 B5R0.5 CC(C)[N+](=O)[O-] CHEBI:16037 [0,2,0,0,0,0|1,0,1]=4 1382 B5R0.5 CN(C)C(=O)O CHEBI:38544 [0,2,0,0,0,0|0,0,0]=2 1383 B5R0.5 CN(C)C(=S)S CHEBI:83061 [0,2,0,0,0,0|0,2,0]=4 1384 B5R0.5 CN(C)C(=S)[S-] CHEBI:84293 [0,2,0,0,0,0|0,2,0]=4 1385 B5R0.5 C[C@@H](C(=O)C)O CHEBI:15687 [0,2,0,0,0,0|0,0,0]=2 1386 B5R0.5 C[C@@H](C(=O)N)N CHEBI:21217 [0,2,0,0,0,0|1,0,0]=3 1387 B5R0.5 C[C@@H](C(=O)N)[NH3+] CHEBI:74169 [0,2,0,0,0,0|1,0,0]=3 1388 B5R0.5 C[C@@H](C(=O)O)Cl CHEBI:73956 [0,2,0,0,0,0|0,0,0]=2 1389 B5R0.5 C[C@@H](C(=O)O)N CHEBI:16977 [0,2,0,0,0,0|0,0,0]=2 1390 B5R0.5 C[C@@H](C(=O)O)O CHEBI:422 [0,2,0,0,0,0|0,0,0]=2 1391 B5R0.5 C[C@@H](C(=O)O)S CHEBI:47873 [0,2,0,0,0,0|0,0,0]=2 1392 B5R0.5 C[C@@H](C(=O)O)[NH3+] CHEBI:32432 [0,2,0,0,0,0|0,0,0]=2 1393 B5R0.5 C[C@@H](C(=O)[O-])Cl CHEBI:73934 [0,2,0,0,0,0|0,0,1]=3 1394 B5R0.5 C[C@@H](C(=O)[O-])N CHEBI:32431 [0,2,0,0,0,0|0,0,1]=3 1395 B5R0.5 C[C@@H](C(=O)[O-])O CHEBI:16651 [0,2,0,0,0,0|0,0,1]=3 1396 B5R0.5 C[C@@H](C(=O)[O-])[NH3+] CHEBI:57972 [0,2,0,0,0,0|0,0,1]=3 1397 B5R0.5 C[C@@H]([C@H](C)O)O CHEBI:16812 [0,2,0,0,0,0|0,0,2]=4 1398 B5R0.5 C[C@H](C(=O)C)O CHEBI:15686 [0,2,0,0,0,0|0,0,0]=2 1399 B5R0.5 C[C@H](C(=O)O)N CHEBI:15570 [0,2,0,0,0,0|0,0,0]=2 1400 B5R0.5 C[C@H](C(=O)O)O CHEBI:42111 [0,2,0,0,0,0|0,0,0]=2 1401 B5R0.5 C[C@H](C(=O)O)S CHEBI:47874 [0,2,0,0,0,0|0,0,0]=2 1402 B5R0.5 C[C@H](C(=O)O)[NH3+] CHEBI:32436 [0,2,0,0,0,0|0,0,0]=2 1403 B5R0.5 C[C@H](C(=O)[O-])N CHEBI:32435 [0,2,0,0,0,0|0,0,1]=3 1404 B5R0.5 C[C@H](C(=O)[O-])O CHEBI:16004 [0,2,0,0,0,0|0,0,1]=3 1405 B5R0.5 C[C@H](C(=O)[O-])[NH3+] CHEBI:57416 [0,2,0,0,0,0|0,0,1]=3 1406 B5R0.5 C[C@H]([C@@H](C)O)O CHEBI:16982 [0,2,0,0,0,0|0,0,2]=4 1407 B5R0.5 C[C@H]([C@H](C)O)O CHEBI:75460 [0,2,0,0,0,0|0,0,2]=4 1408 B5R0.5 OS(=O)S(=O)O CHEBI:29253 [0,2,0,0,0,0|2,0,0]=4 1409 B5R0.5 OS(=O)S(=O)[O-] CHEBI:33487 [0,2,0,0,0,0|2,0,0]=4 1410 B5R0.5 [*]C(=O)C(=O)O CHEBI:35910 [0,2,0,0,0,0|0,0,1]=3 1411 B5R0.5 [*]C(=O)C(=O)[O-] CHEBI:35179 [0,2,0,0,0,0|0,0,2]=4 1412 B5R0.5 [*]C(=O)N([*])[*] CHEBI:37622 [0,2,0,0,0,0|2,0,0]=4 1413 B5R0.5 [*]C(C)C(=O)O CHEBI:16333 [0,2,0,0,0,0|0,0,0]=2 1414 B5R0.5 [*]\C(=C(\[*])/O)\[*] CHEBI:33823 [0,2,0,0,0,0|1,0,1]=4 1415 B3R1.1 C1=CN1 CHEBI:30970 [1,0,0,1,0,0|1,0,1]=4 1416 B3R1.1 C1=CO1 CHEBI:30973 [1,0,0,1,0,0|0,0,1]=3 1417 B3R1.1 C1=CS1 CHEBI:30976 [1,0,0,1,0,0|0,1,1]=4 1418 B3R1.1 C1=NN1 CHEBI:51622 [1,0,0,1,0,0|2,0,0]=4 1419 B3R1.1 C1=NO1 CHEBI:30978 [1,0,0,1,0,0|1,0,0]=3 1420 B3R1.1 C1C=C1 CHEBI:51205 [1,0,0,1,0,0|1,0,0]=3 1421 B3R1.1 C1C=N1 CHEBI:30971 [1,0,0,1,0,0|1,0,0]=3 1422 B3R1.1 C1CC1 CHEBI:30365 [1,0,0,1,0,0|1,0,1]=4 1423 B3R1.1 C1CN1 CHEBI:30969 [1,0,0,1,0,0|1,0,1]=4 1424 B3R1.1 C1CO1 CHEBI:27561 [1,0,0,1,0,0|0,0,1]=3 1425 B3R1.1 C1CS1 CHEBI:30977 [1,0,0,1,0,0|0,1,1]=4 1426 B3R1.1 C1C[NH2+]1 CHEBI:50929 [1,0,0,1,0,0|1,0,1]=4 1427 B3R1.1 C1N=N1 CHEBI:51620 [1,0,0,1,0,0|2,0,0]=4 1428 B3R1.1 O1O[Ca]1 CHEBI:48233 [1,0,0,1,0,0|1,0,1]=4 1429 B5R1.2 C1CNC1=O CHEBI:327119 [0,1,0,1,0,0|1,0,0]=3 1430 B5R1.2 C1COC1=O CHEBI:49073 [0,1,0,1,0,0|0,0,0]=2 1431 B5R1.3 C1C(O1)CBr CHEBI:18718 [0,1,0,1,0,0|1,0,1]=4 1432 B5R1.3 C1C(O1)CCl CHEBI:37144 [0,1,0,1,0,0|1,0,1]=4 1433 B5R1.3 C1C(O1)CO CHEBI:30966 [0,1,0,1,0,0|0,0,2]=4 1434 B5R1.3 C1[C@@H](O1)CCl CHEBI:18662 [0,1,0,1,0,0|1,0,1]=4 1435 B5R1.3 C1[C@@H](O1)CO CHEBI:38690 [0,1,0,1,0,0|0,0,2]=4 1436 B5R1.3 C1[C@H](O1)CCl CHEBI:37145 [0,1,0,1,0,0|1,0,1]=4 1437 B5R1.3 C1[C@H](O1)CO CHEBI:18664 [0,1,0,1,0,0|0,0,2]=4