0 B4R0.1 C#CC(=O)O F10329 [0,0,0,0,0,0|3,0,1]=4 1 B4R0.1 C#CC(C)=O F52495 [0,0,0,0,0,0|4,0,0]=4 2 B4R0.1 C#CC(N)=O BL007595 [0,0,0,0,0,0|4,0,0]=4 3 B4R0.1 C=C(C)C=O H10713 [0,0,0,0,0,0|4,0,0]=4 4 B4R0.1 C=CC(=O)[O-] D88317 [0,0,0,0,0,0|3,0,1]=4 5 B4R0.1 C=CC(=O)[O-] H10710 [0,0,0,0,0,0|3,0,1]=4 6 B4R0.1 CC(=O)CBr 76485 [0,0,0,0,0,0|4,0,0]=4 7 B4R0.1 CC(=O)CN 24448 [0,0,0,0,0,0|4,0,0]=4 8 B4R0.1 CC(=O)NBr 70825 [0,0,0,0,0,0|3,1,0]=4 9 B4R0.1 CC(=O)NN AB6005 [0,0,0,0,0,0|3,1,0]=4 10 B4R0.1 CC(=O)NO 78370 [0,0,0,0,0,0|2,1,1]=4 11 B4R0.1 CCC(N)=O O12053 [0,0,0,0,0,0|4,0,0]=4 12 B4R0.1 CC[S@](=O)[O-] F16489 [0,0,0,0,0,0|3,0,1]=4 13 B4R0.1 CN(C)N=O AT21751 [0,0,0,0,0,0|2,2,0]=4 14 B4R0.1 CNC(=O)Cl D81983 [0,0,0,0,0,0|3,1,0]=4 15 B4R0.1 CNC(N)=O AC8061 [0,0,0,0,0,0|3,1,0]=4 16 B4R0.1 COC(N)=O D86342 [0,0,0,0,0,0|4,0,0]=4 17 B4R0.1 CSC(C)=O D82067 [0,0,0,0,0,0|4,0,0]=4 18 B4R0.1 NC(=O)CBr 35276 [0,0,0,0,0,0|4,0,0]=4 19 B4R0.1 NC(=O)CI 25452 [0,0,0,0,0,0|4,0,0]=4 20 B4R0.1 NC(=O)CO D77798 [0,0,0,0,0,0|3,0,1]=4 21 B4R0.1 NC(=O)NO A10546 [0,0,0,0,0,0|2,1,1]=4 22 B4R0.1 NCC(=O)O D70890 [0,0,0,0,0,0|3,0,1]=4 23 B4R0.1 NCC(=O)O F21278 [0,0,0,0,0,0|3,0,1]=4 24 B4R0.1 NCC(=O)[O-] D70403 [0,0,0,0,0,0|3,0,1]=4 25 B4R0.1 NCC(=O)[O-] D77927 [0,0,0,0,0,0|3,0,1]=4 26 B4R0.1 NCC(=O)[O-] D84274 [0,0,0,0,0,0|3,0,1]=4 27 B4R0.1 NCC(=O)[O-] D95398 [0,0,0,0,0,0|3,0,1]=4 28 B4R0.1 NCC(N)=O 20652 [0,0,0,0,0,0|4,0,0]=4 29 B4R0.1 NCC(N)=O 58529 [0,0,0,0,0,0|4,0,0]=4 30 B4R0.1 NNC(N)=O D95915 [0,0,0,0,0,0|3,1,0]=4 31 B4R0.1 O=C(Cl)CBr D87897 [0,0,0,0,0,0|4,0,0]=4 32 B4R0.1 O=C(Cl)SCl D89346 [0,0,0,0,0,0|4,0,0]=4 33 B4R0.1 O=C(O)CO D78078 [0,0,0,0,0,0|2,0,2]=4 34 B4R0.1 O=CC(=O)O D70821 [0,0,0,0,0,0|2,0,1]=3 35 B4R0.1 O=CC(=O)O F14188 [0,0,0,0,0,0|2,0,1]=3 36 B4R0.1 O=[N+]([O-])CBr 76484 [0,0,0,0,0,0|2,1,1]=4 37 B3R0.1 NNC=O F11944 [1,0,0,0,0,0|2,1,0]=4 38 B3R0.2 CC(=O)O 29388 [1,0,0,0,0,0|2,0,1]=4 39 B3R0.2 CC(=O)O C90337 [1,0,0,0,0,0|2,0,1]=4 40 B3R0.2 CC(=O)S D92569 [1,0,0,0,0,0|2,1,0]=4 41 B3R0.2 CC(=O)[O-] 35848 [1,0,0,0,0,0|2,0,1]=4 42 B3R0.2 CC(=O)[O-] AC2542 [1,0,0,0,0,0|2,0,1]=4 43 B3R0.2 CC(=O)[O-] AC2625 [1,0,0,0,0,0|2,0,1]=4 44 B3R0.2 CC(=O)[O-] D70070 [1,0,0,0,0,0|2,0,1]=4 45 B3R0.2 CC(=O)[O-] D74466 [1,0,0,0,0,0|2,0,1]=4 46 B3R0.2 CC(=O)[O-] D74596 [1,0,0,0,0,0|2,0,1]=4 47 B3R0.2 CC(=O)[O-] D77673 [1,0,0,0,0,0|2,0,1]=4 48 B3R0.2 CC(=O)[O-] D77909 [1,0,0,0,0,0|2,0,1]=4 49 B3R0.2 CC(=O)[O-] D78215 [1,0,0,0,0,0|2,0,1]=4 50 B3R0.2 CC(=O)[O-] D78216 [1,0,0,0,0,0|2,0,1]=4 51 B3R0.2 CC(=O)[O-] D81958 [1,0,0,0,0,0|2,0,1]=4 52 B3R0.2 CC(=O)[O-] D84280 [1,0,0,0,0,0|2,0,1]=4 53 B3R0.2 CC(=O)[O-] D88447 [1,0,0,0,0,0|2,0,1]=4 54 B3R0.2 CC(=O)[O-] D91230 [1,0,0,0,0,0|2,0,1]=4 55 B3R0.2 CC(=O)[O-] D95368 [1,0,0,0,0,0|2,0,1]=4 56 B3R0.2 CC(=O)[O-] D95676 [1,0,0,0,0,0|2,0,1]=4 57 B3R0.2 CC(=O)[O-] D95836 [1,0,0,0,0,0|2,0,1]=4 58 B3R0.2 CC(=O)[O-] D95949 [1,0,0,0,0,0|2,0,1]=4 59 B3R0.2 CC(=O)[O-] D95967 [1,0,0,0,0,0|2,0,1]=4 60 B3R0.2 CC(=O)[O-] D95970 [1,0,0,0,0,0|2,0,1]=4 61 B3R0.2 CC(=O)[O-] D97851 [1,0,0,0,0,0|2,0,1]=4 62 B3R0.2 CC(=O)[O-] E70002 [1,0,0,0,0,0|2,0,1]=4 63 B3R0.2 CC(=O)[O-] H10718 [1,0,0,0,0,0|2,0,1]=4 64 B3R0.2 C[PH](C)=O 20677 [1,0,0,0,0,0|2,1,0]=4 65 B3R0.2 C[S@](=O)[O-] 35930 [1,0,0,0,0,0|2,0,1]=4 66 B3R0.2 NC(N)=O D70446 [1,0,0,0,0,0|2,1,0]=4 67 B3R0.2 O=C(O)O D78214 [1,0,0,0,0,0|1,0,2]=4 68 B3R0.2 O=C([O-])[O-] 29292 [1,0,0,0,0,0|1,0,2]=4 69 B3R0.2 O=C([O-])[O-] AC2635 [1,0,0,0,0,0|1,0,2]=4 70 B3R0.2 O=C([O-])[O-] D95733 [1,0,0,0,0,0|1,0,2]=4 71 B3R0.2 O=C([O-])[O-] H12045 [1,0,0,0,0,0|1,0,2]=4 72 B3R0.2 O=[N+]([O-])[O-] AC2340 [1,0,0,0,0,0|0,1,2]=4 73 B3R0.2 O=[N+]([O-])[O-] D78339 [1,0,0,0,0,0|0,1,2]=4 74 B3R0.2 O=[N+]([O-])[O-] D95172 [1,0,0,0,0,0|0,1,2]=4 75 B3R0.2 O=[N+]([O-])[O-] D95621 [1,0,0,0,0,0|0,1,2]=4 76 B3R0.2 O=[N+]([O-])[O-] D95671 [1,0,0,0,0,0|0,1,2]=4 77 B3R0.2 O=[N+]([O-])[O-] D95736 [1,0,0,0,0,0|0,1,2]=4 78 B3R0.2 O=[N+]([O-])[O-] D95950 [1,0,0,0,0,0|0,1,2]=4 79 B3R0.2 O=[N+]([O-])[O-] D95955 [1,0,0,0,0,0|0,1,2]=4 80 B3R0.2 O=[N+]([O-])[O-] D95968 [1,0,0,0,0,0|0,1,2]=4 81 B3R0.2 O=[N+]([O-])[O-] S10441 [1,0,0,0,0,0|0,1,2]=4 82 B3R0.2 O=[V](=O)[O-] D78051 [1,0,0,0,0,0|1,0,1]=3 83 B5R0.3 O=CC(Br)C=O 23170 [0,1,0,0,0,0|3,0,0]=4 84 B5R0.3 O=CC(Cl)C=O A11058 [0,1,0,0,0,0|3,0,0]=4 85 B5R0.4 C=CS(C)(=O)=O D95725 [0,1,0,0,0,0|3,0,0]=4 86 B5R0.4 CCS(=O)(=O)Cl D78105 [0,1,0,0,0,0|3,0,0]=4 87 B5R0.4 CCS(=O)(=O)O F20396 [0,1,0,0,0,0|3,0,0]=4 88 B5R0.4 CCS(C)(=O)=O A10776 [0,1,0,0,0,0|3,0,0]=4 89 B5R0.4 CCS(N)(=O)=O 35724 [0,1,0,0,0,0|3,0,0]=4 90 B5R0.4 CNS(C)(=O)=O AB2915 [0,1,0,0,0,0|2,1,0]=4 91 B5R0.4 COS(=O)(=O)[O-] D91331 [0,1,0,0,0,0|3,0,0]=4 92 B5R0.4 COS(C)(=O)=O C10631 [0,1,0,0,0,0|3,0,0]=4 93 B5R0.4 CSS(C)(=O)=O H10854 [0,1,0,0,0,0|3,0,0]=4 94 B5R0.4 NOS(=O)(=O)[O-] D77993 [0,1,0,0,0,0|3,0,0]=4 95 B5R0.4 O=S(=O)([O-])CO D90827 [0,1,0,0,0,0|2,0,1]=4 96 B5R0.5 CC(=O)C(=O)[O-] D77796 [0,1,0,0,0,0|2,0,1]=4 97 B5R0.5 CC(=O)C(=O)[O-] D97786 [0,1,0,0,0,0|2,0,1]=4 98 B5R0.5 CC(=O)C(=O)[O-] H10783 [0,1,0,0,0,0|2,0,1]=4 99 B5R0.5 CC(=O)C(=O)[O-] H11289 [0,1,0,0,0,0|2,0,1]=4 100 B5R0.5 CC(=O)C(C)=O W18292 [0,1,0,0,0,0|3,0,0]=4 101 B5R0.5 NC(=O)C(=O)O A10798 [0,1,0,0,0,0|2,0,1]=4 102 B5R0.5 NC(=O)C(=O)[O-] 78317 [0,1,0,0,0,0|2,0,1]=4 103 B5R0.5 NC(=O)C(=O)[O-] D91824 [0,1,0,0,0,0|2,0,1]=4 104 B5R0.5 NC(=O)C(N)=O D70377 [0,1,0,0,0,0|3,0,0]=4 105 B5R0.5 O=C(O)C(=O)O 35743 [0,1,0,0,0,0|2,0,1]=4 106 B5R0.5 O=C(O)C(=O)O C11246 [0,1,0,0,0,0|2,0,1]=4 107 B5R0.5 O=C([O-])C(=O)[O-] 11920 [0,1,0,0,0,0|2,0,1]=4 108 B5R0.5 O=C([O-])C(=O)[O-] C13296 [0,1,0,0,0,0|2,0,1]=4 109 B2R0.1 CC=O D78540 [2,0,0,0,0,0|2,0,0]=4 110 B2R0.1 O=CO 43929 [2,0,0,0,0,0|1,0,1]=4 111 B2R0.1 O=CO D78097 [2,0,0,0,0,0|1,0,1]=4 112 B2R0.1 O=C[O-] D95946 [2,0,0,0,0,0|1,0,1]=4 113 B2R0.1 O=N[O-] D95565 [2,0,0,0,0,0|0,1,1]=4 114 B2R0.1 O=[13CH][O-] 41420 [2,0,0,0,0,0|1,0,1]=4 115 B2R0.1 O=[Ge]=O F20443 [2,0,0,0,0,0|1,0,0]=3 116 B2R0.1 O=[Si]=O C13405 [2,0,0,0,0,0|1,0,0]=3 117 B2R0.1 O=[Si]=O D78143 [2,0,0,0,0,0|1,0,0]=3 118 B2R0.1 O=[Te]=O D92683 [2,0,0,0,0,0|1,0,0]=3 119 B4R0.2 O=C[N-]C=O 78203 [1,1,0,0,0,0|1,1,0]=4 120 B4R0.2 O=[Dy]O[Dy]=O D94470 [1,1,0,0,0,0|2,0,0]=4 121 B4R0.2 O=[Eu]O[Eu]=O D95631 [1,1,0,0,0,0|2,0,0]=4 122 B4R0.2 O=[Ga]O[Ga]=O D95695 [1,1,0,0,0,0|2,0,0]=4 123 B4R0.2 O=[Mn]O[Mn]=O D97303 [1,1,0,0,0,0|2,0,0]=4 124 B4R0.2 O=[Nd]O[Nd]=O F20379 [1,1,0,0,0,0|2,0,0]=4 125 B4R0.2 O=[Sc]O[Sc]=O D94779 [1,1,0,0,0,0|2,0,0]=4 126 B4R0.2 O=[Tb]O[Tb]=O D97472 [1,1,0,0,0,0|2,0,0]=4 127 B4R0.2 O=[Y]O[Y]=O D92799 [1,1,0,0,0,0|2,0,0]=4 128 B4R0.3 CS(=O)(=O)O AT25153 [1,1,0,0,0,0|1,0,1]=4 129 B4R0.3 CS(=O)(=O)[O-] A11504 [1,1,0,0,0,0|1,0,1]=4 130 B4R0.3 CS(=O)(=O)[O-] D82065 [1,1,0,0,0,0|1,0,1]=4 131 B4R0.3 CS(=O)(=O)[O-] E70319 [1,1,0,0,0,0|1,0,1]=4 132 B4R0.3 CS(=O)(=O)[S-] W18874 [1,1,0,0,0,0|1,1,0]=4 133 B4R0.3 CS(C)(=O)=O D70240 [1,1,0,0,0,0|2,0,0]=4 134 B4R0.3 CS(N)(=O)=O AC7862 [1,1,0,0,0,0|1,1,0]=4 135 B4R0.3 NS(=O)(=O)Cl 30747 [1,1,0,0,0,0|1,1,0]=4 136 B4R0.3 NS(=O)(=O)[O-] D95248 [1,1,0,0,0,0|1,0,1]=4 137 B4R0.3 NS(=O)(=O)[O-] H10675 [1,1,0,0,0,0|1,0,1]=4 138 B4R0.3 NS(N)(=O)=O S12311 [1,1,0,0,0,0|1,1,0]=4 139 B4R0.3 O=Cl(=O)(=O)[O-] D97853 [1,1,0,0,0,0|1,0,0]=3 140 B4R0.3 O=S(=O)(O)O D77746 [1,1,0,0,0,0|1,0,1]=4 141 B4R0.3 O=S(=O)(O)O H11038 [1,1,0,0,0,0|1,0,1]=4 142 B4R0.3 O=S(=O)([O-])O D90622 [1,1,0,0,0,0|1,0,1]=4 143 B4R0.3 O=S(=O)([O-])[O-] AC2339 [1,1,0,0,0,0|1,0,1]=4 144 B4R0.3 O=S(=O)([O-])[O-] AC2544 [1,1,0,0,0,0|1,0,1]=4 145 B4R0.3 O=S(=O)([O-])[O-] C13502 [1,1,0,0,0,0|1,0,1]=4 146 B4R0.3 O=S(=O)([O-])[O-] D95954 [1,1,0,0,0,0|1,0,1]=4 147 B4R0.3 O=S(=O)([O-])[O-] D97195 [1,1,0,0,0,0|1,0,1]=4 148 B4R0.3 O=S(=O)([O-])[O-] D97777 [1,1,0,0,0,0|1,0,1]=4 149 B4R0.3 O=[Mo](=O)(O)O D78107 [1,1,0,0,0,0|1,0,1]=4 150 B4R0.3 O=[Mo](=O)([O-])[O-] A11800 [1,1,0,0,0,0|1,0,1]=4 151 B4R0.3 O=[Os](=O)([O-])[O-] C13967 [1,1,0,0,0,0|1,0,1]=4 152 B4R0.3 O=[W](=O)([O-])[O-] H11589 [1,1,0,0,0,0|1,0,1]=4