0 B4R0.2 C(CCl)CCl 0CL [0,0,0,0,0,0|3,0,1]=4 1 B4R0.2 C(CN)CBr 4LJ [0,0,0,0,0,0|3,0,1]=4 2 B4R0.2 C(CN)CN 13D [0,0,0,0,0,0|3,0,1]=4 3 B4R0.2 C(CN)CO 0D8 [0,0,0,0,0,0|2,1,1]=4 4 B4R0.2 C(CO)CCl 3CL [0,0,0,0,0,0|2,1,1]=4 5 B4R0.2 C(CO)CO HPG [0,0,0,0,0,0|2,1,1]=4 6 B4R0.2 C(CO)CO PDO [0,0,0,0,0,0|2,1,1]=4 7 B4R0.2 C(CS)C=O MPR [0,0,0,0,0,0|2,1,1]=4 8 B4R0.2 C(CS)CS PDT [0,0,0,0,0,0|2,0,2]=4 9 B4R0.2 C(O)OCO 21H [0,0,0,0,0,0|2,1,1]=4 10 B4R0.2 C/C=C/C=O CRD [0,0,0,0,0,0|1,1,2]=4 11 B4R0.2 CC/C=N\O PXO [0,0,0,0,0,0|2,1,0]=3 12 B4R0.2 CCCCBr BBU [0,0,0,0,0,0|2,0,1]=3 13 B4R0.2 CCCCC LNK [0,0,0,0,0,0|2,0,1]=3 14 B4R0.2 CCCCN LYT [0,0,0,0,0,0|2,0,1]=3 15 B4R0.2 CCCCO 1BO [0,0,0,0,0,0|1,1,1]=3 16 B4R0.2 CCC[N+]#[C-] NPN [0,0,0,0,0,0|3,0,0]=3 17 B4R0.2 CCOC=O ETO [0,0,0,0,0,0|1,1,1]=3 18 B4R0.2 CCOCC ETZ [0,0,0,0,0,0|2,0,1]=3 19 B4R0.2 CCOC[O-] EOM [0,0,0,0,0,0|1,1,1]=3 20 B4R0.2 COCCO MXE [0,0,0,0,0,0|2,1,1]=4 21 B4R0.2 COCC[O-] MOE [0,0,0,0,0,0|2,1,1]=4 22 B3R0.1 C#CCN RRA [1,0,0,0,0,0|2,0,1]=4 23 B3R0.1 C(C=O)N GLZ [1,0,0,0,0,0|1,1,1]=4 24 B3R0.1 C(CBr)O BRJ [1,0,0,0,0,0|1,1,1]=4 25 B3R0.1 C(CCl)Cl DCE [1,0,0,0,0,0|2,0,1]=4 26 B3R0.1 C(CN)N EDN [1,0,0,0,0,0|2,0,1]=4 27 B3R0.1 C(CO)N ETA [1,0,0,0,0,0|1,1,1]=4 28 B3R0.1 C(CO)O EDO [1,0,0,0,0,0|1,1,1]=4 29 B3R0.1 C(CO)O EGL [1,0,0,0,0,0|1,1,1]=4 30 B3R0.1 C(CS)N DHL [1,0,0,0,0,0|1,0,2]=4 31 B3R0.1 C(CS)N SEA [1,0,0,0,0,0|1,0,2]=4 32 B3R0.1 C(CS)O BME [1,0,0,0,0,0|1,0,2]=4 33 B3R0.1 C(CS)O SEO [1,0,0,0,0,0|1,0,2]=4 34 B3R0.1 C(CS)S 6LN [1,0,0,0,0,0|1,0,2]=4 35 B3R0.1 C(N)[SH]=O OSM [1,0,0,0,0,0|2,1,0]=4 36 B3R0.1 C([C-]=O)[NH-] GLY_LL [1,0,0,0,0,0|1,1,1]=4 37 B3R0.1 C([C-]=O)[NH3+] GLY_LSN3 [1,0,0,0,0,0|1,1,1]=4 38 B3R0.1 C=CCN AYE [1,0,0,0,0,0|2,0,1]=4 39 B3R0.1 C=CCO 5VQ [1,0,0,0,0,0|2,0,1]=4 40 B3R0.1 CCC#N CNV [1,0,0,0,0,0|1,0,1]=3 41 B3R0.1 CCC=O CBG [1,0,0,0,0,0|0,1,1]=3 42 B3R0.1 CCC=O PNL [1,0,0,0,0,0|0,1,1]=3 43 B3R0.1 CCCBr 3BR [1,0,0,0,0,0|1,0,1]=3 44 B3R0.1 CCCC BUT [1,0,0,0,0,0|1,0,1]=3 45 B3R0.1 CCCC NBU [1,0,0,0,0,0|1,0,1]=3 46 B3R0.1 CCCC SBU [1,0,0,0,0,0|1,0,1]=3 47 B3R0.1 CCCN 3CN [1,0,0,0,0,0|1,0,1]=3 48 B3R0.1 CCCO POL [1,0,0,0,0,0|0,1,1]=3 49 B3R0.1 CCCS XL3 [1,0,0,0,0,0|0,0,2]=3 50 B3R0.1 CCN=O NOE [1,0,0,0,0,0|0,1,0]=2 51 B3R0.1 CCNC ETN [1,0,0,0,0,0|0,0,2]=3 52 B3R0.1 CCOC 2ME [1,0,0,0,0,0|1,0,1]=3 53 B3R0.1 CC[N+]#C ENC [1,0,0,0,0,0|0,0,2]=3 54 B3R0.1 CNC=S MTF [1,0,0,0,0,0|0,0,2]=3 55 B3R0.1 C\C=C/N AKK [1,0,0,0,0,0|1,0,2]=4 56 B3R0.1 C\C=N\O AXO [1,0,0,0,0,0|0,1,1]=3 57 B3R0.1 N=C\CN AEM [1,0,0,0,0,0|2,0,1]=4 58 B5R0.1 CC(C)CCN LEN [0,1,0,0,0,0|2,0,1]=4 59 B5R0.1 CC(C)CCO IP3 [0,1,0,0,0,0|1,1,1]=4 60 B5R0.1 CCCC(=O)C PNH [0,1,0,0,0,0|1,1,1]=4 61 B5R0.1 CCCC(=O)N BMD [0,1,0,0,0,0|1,1,1]=4 62 B5R0.1 CCCC(=O)O BUA [0,1,0,0,0,0|1,1,1]=4 63 B5R0.1 CCC[N+](=O)[O-] N1P [0,1,0,0,0,0|2,1,0]=4 64 B5R0.1 CCOC(=O)C EEE [0,1,0,0,0,0|1,1,1]=4 65 B5R0.1 CCOC(=O)O 01F [0,1,0,0,0,0|1,1,1]=4 66 B5R0.1 CCO[P@H](=O)O ATJ [0,1,0,0,0,0|2,1,0]=4 67 B5R0.1 CCSC(=N)N ITU [0,1,0,0,0,0|2,0,1]=4 68 B5R0.1 CCSC(=N)N SEU [0,1,0,0,0,0|2,0,1]=4 69 B5R0.1 C[C@@H](CCO)O BU2 [0,1,0,0,0,0|1,1,1]=4 70 B5R0.1 C[C@H](CC=O)O 5KO [0,1,0,0,0,0|1,1,1]=4 71 B5R0.1 C[C@H](CCO)O BU4 [0,1,0,0,0,0|1,1,1]=4 72 B5R0.1 N=C(/N)\NCC EGD [0,1,0,0,0,0|1,0,2]=4 73 B5R0.1 N=C(\N)/[Se]CC ISU [0,1,0,0,0,0|2,0,1]=4 74 B5R0.2 C(CCN)CN PUT [0,1,0,0,0,0|2,0,1]=4 75 B5R0.2 C(CCO)CO BU1 [0,1,0,0,0,0|1,1,1]=4 76 B5R0.2 C(CCO)C[NH3+] 4HA [0,1,0,0,0,0|1,1,1]=4 77 B5R0.2 C(CCl)NC=O CEC [0,1,0,0,0,0|0,1,2]=4 78 B5R0.2 C(CN)CON XAP [0,1,0,0,0,0|3,0,0]=4 79 B5R0.2 C(CO)N=[N+]=[N-] AE9 [0,1,0,0,0,0|2,0,0]=3 80 B5R0.2 C=CCNC=S 9AI [0,1,0,0,0,0|0,0,3]=4 81 B5R0.2 CCC/C=N\O BXO [0,1,0,0,0,0|1,1,1]=4 82 B5R0.2 CCCCC=O PTL [0,1,0,0,0,0|1,1,1]=4 83 B5R0.2 CCCCCBr 5BR [0,1,0,0,0,0|2,0,1]=4 84 B5R0.2 CCCCCC HEX [0,1,0,0,0,0|2,0,1]=4 85 B5R0.2 CCCCCCl 7CL [0,1,0,0,0,0|2,0,1]=4 86 B5R0.2 CCCCCN AML [0,1,0,0,0,0|2,0,1]=4 87 B5R0.2 CCCCCO PE9 [0,1,0,0,0,0|1,1,1]=4 88 B5R0.2 CCCC[N+]#[C-] NBN [0,1,0,0,0,0|2,0,1]=4 89 B5R0.2 CCOCCO ETX [0,1,0,0,0,0|1,1,1]=4 90 B5R0.2 CNCCCN N3D [0,1,0,0,0,0|2,0,1]=4 91 B5R0.2 COCCOC DXE [0,1,0,0,0,0|3,0,0]=4 92 B5R0.3 CCC(CC)N D0M [0,1,0,0,0,0|2,0,1]=4 93 B5R0.3 CC[C@H](C)CN DCI [0,1,0,0,0,0|2,0,1]=4 94 B5R0.3 CC[C@H](C)CN MBA [0,1,0,0,0,0|2,0,1]=4 95 B5R1.1 C1CCNC1 VES [0,0,0,1,0,0|1,0,2]=4 96 B5R1.1 C1CCOC1 FU1 [0,0,0,1,0,0|1,1,1]=4 97 B5R1.3 C1CC1CO 09V [0,0,0,1,0,0|1,1,1]=4 98 B2R0.1 C(=O)=O CO2 [2,0,0,0,0,0|1,1,0]=4 99 B2R0.1 C(Br)Br 2BM [2,0,0,0,0,0|2,0,0]=4 100 B2R0.1 CC#N CCN [2,0,0,0,0,0|0,0,2]=4 101 B2R0.1 CC=O ACE [2,0,0,0,0,0|0,1,1]=4 102 B2R0.1 CC=O ACU [2,0,0,0,0,0|0,1,1]=4 103 B2R0.1 CC=O MCB [2,0,0,0,0,0|0,1,1]=4 104 B2R0.1 CCBr BBX [2,0,0,0,0,0|1,0,0]=3 105 B2R0.1 CCC TME [2,0,0,0,0,0|0,0,1]=3 106 B2R0.1 CCCl MCE [2,0,0,0,0,0|1,0,0]=3 107 B2R0.1 CCI ETI [2,0,0,0,0,0|1,0,0]=3 108 B2R0.1 CCN NEH [2,0,0,0,0,0|0,0,1]=3 109 B2R0.1 CCO EOH [2,0,0,0,0,0|0,1,0]=3 110 B2R0.1 CCO EOX [2,0,0,0,0,0|0,1,0]=3 111 B2R0.1 CCO OHE [2,0,0,0,0,0|0,1,0]=3 112 B2R0.1 CCS SCC [2,0,0,0,0,0|0,0,1]=3 113 B2R0.1 CCS XL1 [2,0,0,0,0,0|0,0,1]=3 114 B2R0.1 CC[Hg+] EMC [2,0,0,0,0,0|1,0,0]=3 115 B2R0.1 CC[O] OXA [2,0,0,0,0,0|0,1,0]=3 116 B2R0.1 CN=N HDN [2,0,0,0,0,0|1,0,0]=3 117 B2R0.1 CN=O NSM [2,0,0,0,0,0|0,1,0]=3 118 B2R0.1 CNC DMN [2,0,0,0,0,0|0,0,2]=4 119 B2R0.1 COC 2F2 [2,0,0,0,0,0|1,0,1]=4 120 B2R0.1 CSC MSM [2,0,0,0,0,0|1,0,1]=4 121 B2R0.1 C[N+]#[C-] MNC [2,0,0,0,0,0|0,0,2]=4 122 B2R0.1 N(=O)[O-] NO2 [2,0,0,0,0,0|1,1,0]=4 123 B2R0.1 N(=O)[O] 2NO [2,0,0,0,0,0|1,1,0]=4 124 B2R0.1 N=C/C E1H [2,0,0,0,0,0|0,0,1]=3 125 B4R0.1 B(CC)(O)O 3QD [1,1,0,0,0,0|1,1,0]=4 126 B4R0.1 CC(C)C=O 5OZ [1,1,0,0,0,0|0,1,1]=4 127 B4R0.1 CC(C)CN IBN [1,1,0,0,0,0|1,0,1]=4 128 B4R0.1 CCC(=O)N ROP [1,1,0,0,0,0|0,1,1]=4 129 B4R0.1 CCC(=O)O PPI [1,1,0,0,0,0|0,1,1]=4 130 B4R0.1 CC[C@H](C)O SBT [1,1,0,0,0,0|0,1,1]=4 131 B4R0.1 CC[N+](=O)[O-] NIE [1,1,0,0,0,0|0,1,1]=4 132 B4R0.1 C[C@@H](C=O)N 5XU [1,1,0,0,0,0|0,1,1]=4 133 B4R0.1 C[C@@H](CBr)O EBH [1,1,0,0,0,0|1,0,1]=4 134 B4R0.1 C[C@@H](CCl)Cl CP2 [1,1,0,0,0,0|1,0,1]=4 135 B4R0.1 C[C@@H](CO)N 2A1 [1,1,0,0,0,0|0,1,1]=4 136 B4R0.1 C[C@@H](CO)O PGO [1,1,0,0,0,0|0,1,1]=4 137 B4R0.1 C[C@@H](CO)O PGQ [1,1,0,0,0,0|0,1,1]=4 138 B4R0.1 C[C@@H]([C-]=O)[NH-] ALA_LL [1,1,0,0,0,0|0,1,1]=4 139 B4R0.1 C[C@@H]([C-]=O)[NH3+] ALA_LSN3 [1,1,0,0,0,0|0,1,1]=4 140 B4R0.1 C[C@H](CBr)O 1BP [1,1,0,0,0,0|1,0,1]=4 141 B4R0.1 C[C@H](CO)N 2A3 [1,1,0,0,0,0|0,1,1]=4 142 B4R0.1 C[C@H](CO)O HP3 [1,1,0,0,0,0|0,1,1]=4 143 B4R0.1 C[C@H](CO)O PGR [1,1,0,0,0,0|0,1,1]=4 144 B4R0.1 C[C@H](C[NH3+])O FOP [1,1,0,0,0,0|1,0,1]=4 145 B6R1.2 C1CSC(=N1)N ATQ [0,1,0,1,0,0|0,0,2]=4