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C[C@H](CN)C(=O)[O-] DB03432 [1,0,0,0,0,0|1,0,1]=3 18 B6R0.3 C\C=C(/N)C(=O)O DB03720 [1,0,0,0,0,0|1,0,2]=4 19 B6R0.3 N[C@@H](C[NH3+])C(=O)O DB03320 [1,0,0,0,0,0|2,0,0]=3 20 B6R0.3 N[C@@H](C[SeH])C(=O)O DB02345 [1,0,0,0,0,0|2,0,0]=3 21 B6R0.3 N[C@H](CO)C(=O)O DB03929 [1,0,0,0,0,0|2,0,0]=3 22 B6R0.3 N[C@H](CS)C(=O)O DB03201 [1,0,0,0,0,0|2,0,0]=3 23 B6R0.3 O=C(O)C(=O)CO DB02951 [1,0,0,0,0,0|2,0,1]=4 24 B6R0.3 [C@H](N)(CS)C(=N)O DB03275 [1,0,0,0,0,0|3,0,0]=4 25 B6R0.3 [NH3+][C@H](CCl)C(=O)[O-] DB01735 [1,0,0,0,0,0|2,0,1]=4 26 B6R0.4 CCCCB(O)O DB02664 [1,0,0,0,0,0|1,0,1]=3 27 B6R0.4 CCCCC(=O)O DB02406 [1,0,0,0,0,0|0,0,0]=1 28 B6R0.4 CCCOC(C)=O DB01670 [1,0,0,0,0,0|2,0,0]=3 29 B8R0.2 CC[C@@H](C)[C@H](N)C(=O)O DB01739 [0,1,0,0,0,0|1,0,0]=2 30 B8R0.8 C(OC)=C[C@H](N)C(=O)O DB03611 [0,1,0,0,0,0|1,0,2]=4 31 B8R0.8 CCCC[C@@H](N)C(=O)O DB04419 [0,1,0,0,0,0|1,0,0]=2 32 B8R0.8 CSCCC(=O)C(=O)O DB02238 [0,1,0,0,0,0|1,0,1]=3 33 B8R0.8 CSCCC(N)C(=O)O DB13972 [0,1,0,0,0,0|1,0,0]=2 34 B8R0.8 CSCC[C@@H](N)C(=O)O DB02893 [0,1,0,0,0,0|1,0,0]=2 35 B8R0.8 CSCC[C@H](N)[P@H](=O)O DB04015 [0,1,0,0,0,0|2,0,0]=3 36 B8R0.8 C[Hg]SC[C@@H](N)C(=O)O DB02750 [0,1,0,0,0,0|2,0,0]=3 37 B8R0.8 NOCC[C@H](N)C(=O)O DB02821 [0,1,0,0,0,0|2,0,0]=3 38 B8R0.8 N[C@@H](CCC=O)C(=O)O DB04388 [0,1,0,0,0,0|1,0,1]=3 39 B8R0.8 N[C@@H](CCCO)C(=O)O DB03105 [0,1,0,0,0,0|1,0,0]=2 40 B8R0.8 N[C@@H](CS[AsH]O)C(=O)O DB01808 [0,1,0,0,0,0|3,0,0]=4 41 B8R0.8 [C@H](N)(CSSC)C(=O)O DB02361 [0,1,0,0,0,0|2,0,0]=3 42 B8R0.8 [NH3+][C@@H](CCC=O)C(=O)O DB03774 [0,1,0,0,0,0|1,0,1]=3 43 B8R0.23 CC(=O)N[C@@H](C)C(=O)O DB02518 [0,1,0,0,0,0|1,0,1]=3 44 B8R0.23 CC(C)CC(=O)C(=O)O DB03229 [0,1,0,0,0,0|1,0,1]=3 45 B8R0.23 CC(C)C[C@@H](N)C(=O)O DB01746 [0,1,0,0,0,0|1,0,0]=2 46 B8R0.23 C[C@@H](NC(N)=O)C(=O)O DB04048 [0,1,0,0,0,0|2,0,1]=4 47 B8R0.23 NC(=O)C[C@@H](N)C(=O)O DB03943 [0,1,0,0,0,0|2,0,1]=4 48 B8R0.23 N[C@@H](C[S@](=O)O)C(=O)O DB02153 [0,1,0,0,0,0|3,0,0]=4 49 B8R0.23 N[C@H](CC(=O)O)C(=O)O DB02655 [0,1,0,0,0,0|2,0,1]=4 50 B8R0.23 O=C(O)C[C@@H](O)C(=O)O DB03499 [0,1,0,0,0,0|2,0,1]=4 51 B8R0.23 [C@H](N)(C[SeH](=O)=O)C(=O)O DB02442 [0,1,0,0,0,0|3,0,0]=4 52 B8R1.7 O=C(O)[C@H]1CCCN1 DB02853 [0,0,0,1,0,0|1,0,0]=2 53 B8R1.7 O=C(O)[C@H]1CCCO1 DB03051 [0,0,0,1,0,0|1,0,0]=2 54 B8R1.7 O=C([O-])C1=[NH+]CCC1 DB02838 [0,0,0,1,0,0|1,0,2]=4 55 B8R1.7 [C@@H]1(C(=O)O)CSCN1 DB02846 [0,0,0,1,0,0|2,0,0]=3 56 B5R0.1 CC(=O)CCO DB04094 [2,0,0,0,0,0|1,0,1]=4 57 B5R0.1 CC(C)CCO DB02296 [2,0,0,0,0,0|1,0,1]=4 58 B5R0.1 CC(O)CCO DB14110 [2,0,0,0,0,0|1,0,0]=3 59 B5R0.1 CCCC(=O)O DB03568 [2,0,0,0,0,0|0,0,0]=2 60 B5R0.1 CCCC(N)=O DB02121 [2,0,0,0,0,0|1,0,0]=3 61 B5R0.1 CSCC(=O)[O-] DB03517 [2,0,0,0,0,0|1,0,1]=4 62 B5R0.1 CSC[S@](C)=O DB02311 [2,0,0,0,0,0|2,0,0]=4 63 B5R0.1 C[C@H](O)CCO DB02202 [2,0,0,0,0,0|1,0,0]=3 64 B5R0.1 C[Se]CC(=O)[O-] DB03098 [2,0,0,0,0,0|1,0,1]=4 65 B5R0.1 C[Te]CC(=O)[O-] DB01918 [2,0,0,0,0,0|1,0,1]=4 66 B5R0.1 C\C=C\C(=O)O DB02074 [2,0,0,0,0,0|0,0,2]=4 67 B5R0.1 NCCC(=O)O DB03107 [2,0,0,0,0,0|1,0,0]=3 68 B5R0.1 NOCC(=O)O DB02079 [2,0,0,0,0,0|2,0,0]=4 69 B5R0.1 O=C(O)CCO DB03688 [2,0,0,0,0,0|1,0,0]=3 70 B5R0.2 CCCCC=O DB01919 [2,0,0,0,0,0|0,0,0]=2 71 B5R0.2 CCCCCN DB02045 [2,0,0,0,0,0|1,0,1]=4 72 B5R0.2 CCOCCO DB02249 [2,0,0,0,0,0|1,0,1]=4 73 B5R0.2 OCCCCO DB01955 [2,0,0,0,0,0|1,0,1]=4 74 B5R0.2 [C-]#[N+]CCCC DB01826 [2,0,0,0,0,0|2,0,0]=4 75 B5R0.2 [NH3+]CCCCO DB02541 [2,0,0,0,0,0|1,0,1]=4 76 B5R0.3 O=C[C@H](O)CO DB02536 [2,0,0,0,0,0|2,0,0]=4 77 B5R0.5 CC(=O)[C@@H](C)O DB04364 [2,0,0,0,0,0|2,0,0]=4 78 B5R0.5 CC(=O)[C@H](C)O DB02788 [2,0,0,0,0,0|2,0,0]=4 79 B5R0.5 CC(C)C(=O)O DB02531 [2,0,0,0,0,0|0,0,0]=2 80 B5R0.5 C[C@@H](N)C(=O)O DB01786 [2,0,0,0,0,0|1,0,0]=3 81 B5R0.5 C[C@@H](O)C(=O)O DB03066 [2,0,0,0,0,0|1,0,0]=3 82 B7R0.3 CCCCC(O)CO DB14108 [1,1,0,0,0,0|1,0,1]=4 83 B7R0.3 [C@@H](N)(C=O)CCCC DB03241 [1,1,0,0,0,0|1,0,0]=3 84 B7R0.13 CC[C@@](C)(N)C(=O)O DB04171 [1,1,0,0,0,0|0,0,0]=2 85 B7R0.15 C\C=C(/NC)C(=O)O DB04225 [1,1,0,0,0,0|0,0,2]=4 86 B7R0.15 [C@H](CN)(CO)C(=O)O DB02904 [1,1,0,0,0,0|1,0,0]=3 87 B7R0.16 CC(=O)[C@H](N)C(=O)O DB03915 [1,1,0,0,0,0|1,0,1]=4 88 B7R0.16 CC(C(=O)O)C(=O)O DB04183 [1,1,0,0,0,0|1,0,1]=4 89 B7R0.16 CC(C)C(=O)C(=O)O DB04074 [1,1,0,0,0,0|1,0,1]=4 90 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O DB03700 [1,1,0,0,0,0|1,0,0]=3 91 B7R0.16 [C@@H](N)(C(=O)O)[C@@H](C)N DB04804 [1,1,0,0,0,0|1,0,0]=3 92 B7R0.16 [C@H](C)(C(=O)O)N(C)C DB02167 [1,1,0,0,0,0|1,0,0]=3 93 B7R0.16 [C@H](C)(N)[C@@H](N)C(=O)O DB04802 [1,1,0,0,0,0|1,0,0]=3 94 B7R0.4 O=C(O)CCCCO DB04781 [1,1,0,0,0,0|0,0,0]=2 95 B7R0.4 [NH3+]CCCCC(=O)O DB02068 [1,1,0,0,0,0|0,0,0]=2 96 B7R0.6 CC(=O)CCC(=O)O DB02239 [1,1,0,0,0,0|0,0,1]=3 97 B7R0.6 CC(=O)CCC(=O)[O-] DB13800 [1,1,0,0,0,0|0,0,2]=4 98 B7R0.6 CC(=O)NCC(=O)O DB02713 [1,1,0,0,0,0|1,0,1]=4 99 B7R0.6 CC(C)CCC(=O)O DB03993 [1,1,0,0,0,0|0,0,0]=2 100 B7R0.8 CCCCP(=O)(O)O DB03999 [1,1,0,0,0,0|1,0,0]=3 101 B9R0.58 C[C@@](O)(CCO)CC(=O)O DB03518 [0,1,0,0,0,1|1,0,0]=3 102 B9R0.27 O=C(CO)[C@@H](O)[C@@H](O)CO DB03947 [0,2,0,0,0,0|2,0,0]=4 103 B9R0.32 CC[C@@](C)(O)[C@@H](O)C(=O)O DB03675 [0,2,0,0,0,0|1,0,0]=3 104 B9R0.79 CC(C)[C@H](O)[C@H](N)C(=O)O DB02978 [0,2,0,0,0,0|1,0,0]=3 105 B9R0.79 C[C@H](C(=O)O)[C@@H](N)C(=O)O DB04313 [0,2,0,0,0,0|1,0,1]=4 106 B9R0.79 [C@@H](C)(C(=O)O)[C@H](N)C(=O)O DB04538 [0,2,0,0,0,0|1,0,1]=4 107 B9R0.3 CCCC[C@H](N)P(=O)(O)O DB02088 [0,2,0,0,0,0|2,0,0]=4 108 B9R0.3 CSCC[C@H](N)P(=O)(O)O DB02151 [0,2,0,0,0,0|2,0,0]=4 109 B9R0.7 CC(=O)OC[C@H](N)C(=O)O DB01837 [0,2,0,0,0,0|1,0,1]=4 110 B9R0.7 C[S@@](=O)CC[C@H](N)C(=O)O DB02235 [0,2,0,0,0,0|1,0,0]=3 111 B9R0.7 C[S@](=O)CC[C@H](N)C(=O)O DB02467 [0,2,0,0,0,0|1,0,0]=3 112 B9R0.7 NC(=O)CC[C@@H](N)C(=O)O DB02174 [0,2,0,0,0,0|1,0,1]=4 113 B9R0.7 N[C@H](CCC(=O)O)C(=O)O DB02517 [0,2,0,0,0,0|1,0,1]=4 114 B9R0.7 [C@H](N)(CCC(C)=O)C(=O)O DB04296 [0,2,0,0,0,0|1,0,0]=3 115 B9R0.7 [C@H](N)(CC[Se](C)=O)C(=O)O DB02958 [0,2,0,0,0,0|1,0,0]=3 116 B9R0.7 [C@H](N)(CSC(C)=O)C(=O)O DB02039 [0,2,0,0,0,0|1,0,1]=4 117 B9R0.7 [C@H](N)(CS[As](C)C)C(=O)O DB03963 [0,2,0,0,0,0|2,0,0]=4 118 B9R0.42 C[C@H](CF)C[C@H](N)C(=O)O DB02542 [0,2,0,0,0,0|1,0,0]=3 119 B9R0.47 NC(=O)[C@@H](N)CCCC[NH3+] DB03988 [0,2,0,0,0,0|2,0,0]=4 120 B9R0.47 NCCCC[C@@H](N)C(=O)O DB03252 [0,2,0,0,0,0|1,0,0]=3 121 B9R0.47 N[C@@H](CCCC=O)C(=O)O DB02571 [0,2,0,0,0,0|1,0,0]=3 122 B9R0.47 N[C@@H](CCCCO)C(=O)O DB03412 [0,2,0,0,0,0|1,0,0]=3 123 B9R0.47 N[C@@H](CSCCO)C(=O)O DB02413 [0,2,0,0,0,0|1,0,0]=3 124 B9R0.47 [C@@H](N)(CCCCO)C(=O)O DB02233 [0,2,0,0,0,0|1,0,0]=3 125 B9R0.11 CC(C)C[C@](C)(N)C(=O)O DB04063 [0,2,0,0,0,0|0,0,0]=2 126 B9R0.10 CC(C)C[C@H](N)P(=O)(O)O DB02386 [0,2,0,0,0,0|2,0,0]=4 127 B9R0.15 CCCC(CCC)C(N)=O DB04165 [0,2,0,0,0,0|1,0,0]=3 128 B9R0.39 CC(=O)N[C@@H](CO)C(=O)O DB02340 [0,2,0,0,0,0|1,0,1]=4 129 B9R0.39 CN[C@H](CC(C)C)C(=O)O DB04487 [0,2,0,0,0,0|0,0,0]=2 130 B9R0.39 [C@H](CS)(CC(C)C)C(=O)O DB02996 [0,2,0,0,0,0|0,0,0]=2 131 B7R1.4 N[C@@H]1CCOC1=O DB02624 [1,0,0,1,0,0|2,0,0]=4 132 B7R1.19 NC1(C(=O)O)CC1 DB02085 [1,0,0,1,0,0|1,0,0]=3 133 B9R1.6 O=C(O)C1=CCCNC1 DB08848 [0,1,0,1,0,0|0,0,2]=4 134 B9R1.35 O=C(O)[C@@H]1C[C@@H](O)CN1 DB08847 [0,1,0,1,0,0|1,0,0]=3 135 B9R1.112 [C@H]1(C[C@H](N)C(=O)O)CO1 DB03191 [0,1,0,1,0,0|1,0,0]=3 136 B9R1.163 NC1(C(=O)O)CCCC1 DB04620 [0,1,0,1,0,0|0,0,0]=2 137 B9R2.39 [C@H]12CC[C@H](C1)C(=O)C2 DB03540 [0,0,0,2,0,0|1,0,0]=3