0 B12R2.2786 C=C1CC2CCC1(C)C2(C)C Amb547612 [0,0,0,0,0,0|1,0,0]=1 1 B12R2.2786 C=C1CC2CCC1(N)C2(C)C Amb25311249 [0,0,0,0,0,0|2,0,0]=2 2 B12R2.2786 C=C1C[C@@H]2CC[C@@]1(N)C2(C)C Amb28057290 [0,0,0,0,0,0|2,0,0]=2 3 B12R2.2786 C=C1C[C@@H]2CC[C@@]1(O)C2(C)C Amb28130750 [0,0,0,0,0,0|2,0,0]=2 4 B12R2.2786 CC1(C)C2C=C(O)[C@]1(C)CC2 Amb28282789 [0,0,0,0,0,0|0,0,2]=2 5 B12R2.2786 CC1(C)C2C=C[C@@]1(C)C(=O)C2 Amb27409492 [0,0,0,0,0,0|0,0,2]=2 6 B12R2.2786 CC1(C)C2CCC1(Br)C(=O)C2 Amb9767485 [0,0,0,0,0,0|1,0,0]=1 7 B12R2.2786 CC1(C)C2CCC1(C)C(Br)C2 Amb2720830 [0,0,0,0,0,0|1,0,1]=2 8 B12R2.2786 CC1(C)C2CCC1(C)C(Cl)C2 Amb27862132 [0,0,0,0,0,0|1,0,1]=2 9 B12R2.2786 CC1(C)C2CCC1(C)C(N)C2 Amb10243212 [0,0,0,0,0,0|1,0,1]=2 10 B12R2.2786 CC1(C)C2CCC1(C)C(N)C2 Amb8517140 [0,0,0,0,0,0|1,0,1]=2 11 B12R2.2786 CC1(C)C2CCC1(C)C(O)C2 Amb1933831 [0,0,0,0,0,0|0,0,2]=2 12 B12R2.2786 CC1(C)C2CCC1(C)C(S)C2 Amb32788734 [0,0,0,0,0,0|0,1,1]=2 13 B12R2.2786 CC1(C)C2CCC1(C)[C@@H](Cl)C2 Amb27165786 [0,0,0,0,0,0|1,0,1]=2 14 B12R2.2786 CC1(C)C2CCC1(C)[C@@H](N)C2 Amb28365469 [0,0,0,0,0,0|1,0,1]=2 15 B12R2.2786 CC1(C)C2CCC1(C)[C@@H](O)C2 Amb27833696 [0,0,0,0,0,0|0,0,2]=2 16 B12R2.2786 CC1(C)C2CCC1(C)[C@H](N)C2 Amb26547323 [0,0,0,0,0,0|1,0,1]=2 17 B12R2.2786 CC1(C)C2CCC1(N)C(=O)C2 Amb24113259 [0,0,0,0,0,0|1,0,0]=1 18 B12R2.2786 CC1(C)C2CCC1(N)C(=O)C2 Amb33735057 [0,0,0,0,0,0|1,0,0]=1 19 B12R2.2786 CC1(C)C2CC[C@@]1(C)C(=O)C2 Amb10069624 [0,0,0,0,0,0|0,0,0]=0 20 B12R2.2786 CC1(C)C2CC[C@@]1(C)C(N)C2 Amb22225389 [0,0,0,0,0,0|1,0,1]=2 21 B12R2.2786 CC1(C)C2CC[C@@]1(C)[C@@H](N)C2 Amb28052012 [0,0,0,0,0,0|1,0,1]=2 22 B12R2.2786 CC1(C)C2CC[C@]1(C)C(=O)C2 Amb2780031 [0,0,0,0,0,0|0,0,0]=0 23 B12R2.2786 CC1(C)C2CC[C@]1(C)C(O)C2 Amb18511842 [0,0,0,0,0,0|0,0,2]=2 24 B12R2.2786 CC1(C)C2CC[C@]1(C)[C@@H](O)C2 Amb27186936 [0,0,0,0,0,0|0,0,2]=2 25 B12R2.2786 CC1(C)C2CC[C@]1(C)[C@H](Cl)C2 Amb27791797 [0,0,0,0,0,0|1,0,1]=2 26 B12R2.2786 CC1(C)[C@@H]2C=C[C@@]1(C)C(=O)C2 Amb27433146 [0,0,0,0,0,0|0,0,2]=2 27 B12R2.2786 CC1(C)[C@@H]2CC[C@@]1(C)C(=O)C2 Amb2718758 [0,0,0,0,0,0|0,0,0]=0 28 B12R2.2786 CC1(C)[C@@H]2CC[C@@]1(C)C(=S)C2 Amb22351710 [0,0,0,0,0,0|0,1,0]=1 29 B12R2.2786 CC1(C)[C@@H]2CC[C@@]1(C)C(O)C2 Amb26612671 [0,0,0,0,0,0|0,0,2]=2 30 B12R2.2786 CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](N)C2 Amb22388619 [0,0,0,0,0,0|1,0,1]=2 31 B12R2.2786 CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](O)C2 Amb6298379 [0,0,0,0,0,0|0,0,2]=2 32 B12R2.2786 CC1(C)[C@@H]2CC[C@@]1(C)[C@H](N)C2 Amb17779323 [0,0,0,0,0,0|1,0,1]=2 33 B12R2.2786 CC1(C)[C@@H]2CC[C@@]1(C)[C@H](N)C2 Amb27791760 [0,0,0,0,0,0|1,0,1]=2 34 B12R2.2786 CC1(C)[C@@H]2CC[C@@]1(C)[C@H](O)C2 Amb4605940 [0,0,0,0,0,0|0,0,2]=2 35 B12R2.2786 CC1(C)[C@@H]2CC[C@@]1(Cl)C(=O)C2 Amb28201074 [0,0,0,0,0,0|1,0,0]=1 36 B12R2.2786 CC1(C)[C@@H]2CC[C@]1(C)C(=O)C2 Amb10843535 [0,0,0,0,0,0|0,0,0]=0 37 B12R2.2786 CC1(C)[C@@H]2CC[C@]1(C)[C@@H](O)C2 Amb27628652 [0,0,0,0,0,0|0,0,2]=2 38 B12R2.2786 CC1(C)[C@@H]2CC[C@]1(C)[C@H](O)C2 Amb27964530 [0,0,0,0,0,0|0,0,2]=2 39 B12R2.2786 CC1(C)[C@H]2C=C[C@]1(C)C(=O)C2 Amb28052324 [0,0,0,0,0,0|0,0,2]=2 40 B12R2.2786 CC1(C)[C@H]2CCC1(C)[C@H](Br)C2 Amb28053373 [0,0,0,0,0,0|1,0,1]=2 41 B12R2.2786 CC1(C)[C@H]2CC[C@@]1(C)C(=O)C2 Amb25179677 [0,0,0,0,0,0|0,0,0]=0 42 B12R2.2786 CC1(C)[C@H]2CC[C@@]1(C)[C@H](N)C2 Amb27862444 [0,0,0,0,0,0|1,0,1]=2 43 B12R2.2786 CC1(C)[C@H]2CC[C@]1(C)C(=O)C2 Amb33524044 [0,0,0,0,0,0|0,0,0]=0 44 B12R2.2786 CC1(C)[C@H]2CC[C@]1(C)C(=O)N2 Amb27782413 [0,0,0,0,0,0|1,0,0]=1 45 B12R2.2786 CC1(C)[C@H]2CC[C@]1(C)C(N)C2 Amb28146051 [0,0,0,0,0,0|1,0,1]=2 46 B12R2.2786 CC1(C)[C@H]2CC[C@]1(C)C(O)C2 Amb6307433 [0,0,0,0,0,0|0,0,2]=2 47 B12R2.2786 CC1(C)[C@H]2CC[C@]1(C)[C@@H](Br)C2 Amb27654943 [0,0,0,0,0,0|1,0,1]=2 48 B12R2.2786 CC1(C)[C@H]2CC[C@]1(C)[C@@H](N)C2 Amb22800291 [0,0,0,0,0,0|1,0,1]=2 49 B12R2.2786 CC1(C)[C@H]2CC[C@]1(C)[C@@H](O)C2 Amb25176358 [0,0,0,0,0,0|0,0,2]=2 50 B12R2.2786 CC1(C)[C@H]2CC[C@]1(C)[C@H](O)C2 Amb4605971 [0,0,0,0,0,0|0,0,2]=2 51 B12R2.2786 CC1(C)[C@H]2CC[C@]1(N)C(=O)C2 Amb27201264 [0,0,0,0,0,0|1,0,0]=1 52 B12R2.2786 CC1(C)[C@H]2CC[C@]1(N)[C@@H](O)C2 Amb27434462 [0,0,0,0,0,0|1,0,2]=3 53 B12R2.2786 CC12C=CC(CC1=O)C2(C)C Amb27859412 [0,0,0,0,0,0|0,0,2]=2 54 B12R2.2786 CC12C=CC(NC1=O)C2(C)C Amb28068278 [0,0,0,0,0,0|1,0,2]=3 55 B12R2.2786 CC12CCC(CC1=N)C2(C)C Amb547632 [0,0,0,0,0,0|1,0,0]=1 56 B12R2.2786 CC12CCC(CC1=O)C2(C)C Amb9703087 [0,0,0,0,0,0|0,0,0]=0 57 B12R2.2786 CC12CCC(CC1=S)C2(C)C Amb2612430 [0,0,0,0,0,0|0,1,0]=1 58 B12R2.2786 CC12CCC(CC1=[NH2+])C2(C)C Amb2792549 [0,0,0,0,0,0|1,0,0]=1 59 B12R2.2786 CC12CCC(NC1=O)C2(C)C Amb27849846 [0,0,0,0,0,0|1,0,0]=1 60 B12R2.2786 CC12CCC(NC1=S)C2(C)C Amb28071023 [0,0,0,0,0,0|1,1,0]=2 61 B12R2.2786 CC12CC[C@@H](NC1=O)C2(C)C Amb27249595 [0,0,0,0,0,0|1,0,0]=1 62 B12R2.2786 CC1=C[C@@H]2CC[C@@]1(O)C2(C)C Amb27860201 [0,0,0,0,0,0|2,0,1]=3 63 B11R2.732 CC1(C)C2CCC1C(=O)C2 Amb24555284 [1,0,0,0,0,0|0,0,0]=1 64 B11R2.732 CC1(C)C2CCC1C(Br)C2 Amb28050020 [1,0,0,0,0,0|1,0,1]=3 65 B11R2.732 CC1(C)C2CCC1C(Cl)C2 Amb27475495 [1,0,0,0,0,0|1,0,1]=3 66 B11R2.732 CC1(C)C2CCC1C(N)C2 Amb27838119 [1,0,0,0,0,0|1,0,1]=3 67 B11R2.732 CC1(C)C2CCC1C(O)C2 Amb27220270 [1,0,0,0,0,0|0,0,2]=3 68 B11R2.732 CC1(C)[C@@H]2C=C[C@H]1CC2=O Amb27202533 [1,0,0,0,0,0|0,0,2]=3 69 B11R2.732 CC1(C)[C@@H]2CC[C@@H]1CC2N Amb27489162 [1,0,0,0,0,0|1,0,1]=3 70 B11R2.732 CC1(C)[C@@H]2CC[C@@H]1C[C@H]2Cl Amb27489066 [1,0,0,0,0,0|1,0,1]=3 71 B11R2.732 CC1(C)[C@@H]2CC[C@H]1[C@@H](N)C2 Amb27422030 [1,0,0,0,0,0|1,0,1]=3 72 B11R2.732 CC1(C)[C@@H]2CC[C@H]1[C@@H](O)C2 Amb27431361 [1,0,0,0,0,0|0,0,2]=3 73 B11R2.732 CC1(C)[C@@H]2CC[C@H]1[C@H](N)C2 Amb27473355 [1,0,0,0,0,0|1,0,1]=3 74 B11R2.732 CC1(C)[C@H]2CC[C@@H]1C(N)C2 Amb31291730 [1,0,0,0,0,0|1,0,1]=3 75 B11R2.732 CC1(C)[C@H]2CC[C@@H]1[C@@H](Cl)C2 Amb28436811 [1,0,0,0,0,0|1,0,1]=3 76 B11R2.732 CC1(C)[C@H]2CC[C@@H]1[C@H](Br)C2 Amb28130469 [1,0,0,0,0,0|1,0,1]=3 77 B11R2.732 CC1(C)[C@H]2CC[C@@H]1[C@H](O)C2 Amb28129650 [1,0,0,0,0,0|0,0,2]=3 78 B11R2.1775 CC1C2CCC1(C)C(=O)C2 Amb24614463 [1,0,0,0,0,0|0,0,0]=1 79 B11R2.1775 CC1[C@H]2CC[C@]1(C)[C@H](O)C2 Amb27456746 [1,0,0,0,0,0|0,0,2]=3 80 B11R2.1775 C[C@@H]1[C@H]2CC[C@]1(C)[C@@H](O)C2 Amb27427729 [1,0,0,0,0,0|0,0,2]=3 81 B11R2.2357 CC1(C)C2CCC1(N)CC2 Amb24379481 [1,0,0,0,0,0|1,0,1]=3 82 B11R2.2357 CC1(C)C2CCC1(N)CC2 Amb33456327 [1,0,0,0,0,0|1,0,1]=3 83 B11R2.2357 CC1(C)[C@@H]2C=C[C@@]1(C)CC2 Amb24699486 [1,0,0,0,0,0|0,0,1]=2 84 B11R2.2357 CC1(C)[C@H]2C=C[C@]1(C)CC2 Amb25208769 [1,0,0,0,0,0|0,0,1]=2 85 B11R2.2357 CC1(C)[C@H]2CC[C@]1(C)CN2 Amb27230219 [1,0,0,0,0,0|1,0,1]=3 86 B11R2.2357 CC12C=CC(CC1)C2(C)C Amb26491637 [1,0,0,0,0,0|0,0,1]=2 87 B11R2.2357 CC12CCC(CC1)C2(C)C Amb2685721 [1,0,0,0,0,0|0,0,1]=2 88 B11R2.2357 CC12CCC(CC1)C2(C)N Amb27831479 [1,0,0,0,0,0|1,0,1]=3 89 B13R2.6173 CC1(C)C2CCC1(C)C(C#N)C2 Amb28203545 [0,1,0,0,0,0|1,0,1]=3 90 B13R2.6173 CC1(C)C2CCC1(C)C(NN)C2 Amb33313481 [0,1,0,0,0,0|1,0,1]=3 91 B13R2.6173 CC1(C)C2CCC1(C)C(NN)C2 Amb6661458 [0,1,0,0,0,0|1,0,1]=3 92 B13R2.6173 CC1(C)C2CC[C@@]1(C)\C(=N\O)C2 Amb24571903 [0,1,0,0,0,0|0,0,1]=2 93 B13R2.6173 CC1(C)[C@@H]2CC[C@@]1(C)C(C=O)C2 Amb27873937 [0,1,0,0,0,0|0,0,1]=2 94 B13R2.6173 CC1(C)[C@@H]2CC[C@@]1(C)C(CCl)C2 Amb27984776 [0,1,0,0,0,0|1,0,1]=3 95 B13R2.6173 CC1(C)[C@@H]2CC[C@@]1(C)C(NN)C2 Amb27435394 [0,1,0,0,0,0|1,0,1]=3 96 B13R2.6173 CC1(C)[C@@H]2CC[C@@]1(C)[C@H](C=O)C2 Amb27620483 [0,1,0,0,0,0|0,0,1]=2 97 B13R2.6173 CC1(C)[C@@H]2CC[C@@]1(C)\C(=N\N)C2 Amb27420190 [0,1,0,0,0,0|1,0,0]=2 98 B13R2.6173 CC1(C)[C@@H]2CC[C@@]1(C)\C(=N\O)C2 Amb22388537 [0,1,0,0,0,0|0,0,1]=2 99 B13R2.6173 CC1(C)[C@H]2CC[C@]1(C)\C(=C\Cl)C2 Amb27484101 [0,1,0,0,0,0|1,0,0]=2 100 B13R2.6173 CC1(O)C2CCC1(C)C(CO)C2 Amb28244276 [0,1,0,0,0,0|1,0,2]=4 101 B13R2.6173 CC12CCC(C=C1C=O)C2(C)C Amb18646126 [0,1,0,0,0,0|0,0,1]=2 102 B13R2.6173 CC12CCC(C\C1=C/Cl)C2(C)C Amb27667075 [0,1,0,0,0,0|1,0,0]=2 103 B13R2.6173 CC12CCC(C\C1=N/O)C2(C)C Amb776711 [0,1,0,0,0,0|0,0,1]=2 104 B13R2.6173 CC12CCC(C\C1=N\N)C2(C)C Amb1645334 [0,1,0,0,0,0|1,0,0]=2 105 B13R2.6173 CC12CCC(C\C1=N\O)C2(C)C Amb6355767 [0,1,0,0,0,0|0,0,1]=2 106 B13R2.6173 CNC1CC2CCC1(C)C2(C)C Amb1121338 [0,1,0,0,0,0|1,0,1]=3 107 B13R2.6173 CNC1CC2CC[C@]1(C)C2(C)C Amb27651253 [0,1,0,0,0,0|1,0,1]=3 108 B13R2.6173 CNC1C[C@H]2CC[C@]1(C)C2(C)C Amb28198569 [0,1,0,0,0,0|1,0,1]=3 109 B13R2.6173 COC1CC2CCC1(C)C2(C)C Amb22348091 [0,1,0,0,0,0|0,0,2]=3 110 B13R2.6173 [C-]#[N+]C1CC2CCC1(C)C2(C)C Amb2235946 [0,1,0,0,0,0|1,0,1]=3 111 B13R2.11579 CC1(C)[C@@H]2CC[C@@]1(C)[C@](C)(O)C2 Amb22352033 [0,1,0,0,0,0|0,0,2]=3 112 B13R2.11579 CC1(O)CC2CCC1(C)C2(C)C Amb22730745 [0,1,0,0,0,0|0,0,2]=3 113 B13R2.12951 CC1(C)C2CC(=O)C1(C)C(Br)C2 Amb2792569 [0,1,0,0,0,0|0,0,0]=1 114 B13R2.12951 CC1(C)C2CC(Cl)C1(C)C(Cl)C2 Amb27754087 [0,1,0,0,0,0|1,0,1]=3 115 B13R2.12951 CC1(C)C2CC(O)C1(C)C(S)C2 Amb27416938 [0,1,0,0,0,0|0,0,2]=3 116 B13R2.12951 CC1(C)C2C[C@H](O)C1(C)[C@@H](O)C2 Amb27422362 [0,1,0,0,0,0|0,0,2]=3 117 B13R2.12951 CC1(C)[C@@H]2C[C@H](Cl)[C@@]1(C)[C@H](Cl)C2 Amb28053593 [0,1,0,0,0,0|1,0,1]=3 118 B13R2.12951 CC1(C)[C@@H]2C[C@H](O)[C@@]1(C)[C@H](O)C2 Amb27208253 [0,1,0,0,0,0|0,0,2]=3 119 B13R2.12951 CC1(C)[C@H]2CC(=O)[C@]1(C)[C@@H](O)C2 Amb27970148 [0,1,0,0,0,0|0,0,0]=1 120 B13R2.12951 CC1(C)[C@H]2C[C@H](Cl)[C@]1(C)[C@H](Cl)C2 Amb28053374 [0,1,0,0,0,0|1,0,1]=3 121 B13R2.12951 C[C@H]1CC2C[C@@H](O)C1(C)C2(C)C Amb27432286 [0,1,0,0,0,0|0,0,2]=3 122 B13R2.13409 C=C1C[C@@H]2[C@@H](Cl)C[C@@]1(C)C2(C)C Amb27984853 [0,1,0,0,0,0|1,0,0]=2 123 B13R2.13409 C=C1C[C@]2(C)C(=O)C[C@H]1C2(C)C Amb28141307 [0,1,0,0,0,0|0,0,1]=2 124 B13R2.13409 C=C1C[C@]2(C)[C@H](O)C[C@H]1C2(C)C Amb27484679 [0,1,0,0,0,0|0,0,3]=4 125 B13R2.13409 CC1(C)C2CC(O)C1(C)CC2=O Amb2792582 [0,1,0,0,0,0|0,0,3]=4 126 B13R2.13409 CC1(C)C2CC(O)C1(C)CC2N Amb27178091 [0,1,0,0,0,0|0,0,2]=3 127 B13R2.13409 CC1(C)C2CC(O)C1(C)CC2O Amb2792590 [0,1,0,0,0,0|0,0,2]=3 128 B13R2.13409 CC1(C)[C@@H]2CC(=O)[C@@]1(C)CC2O Amb27223206 [0,1,0,0,0,0|0,0,0]=1 129 B13R2.13409 CC1(C)[C@@H]2C[C@@H](O)[C@@]1(C)CC2N Amb27420075 [0,1,0,0,0,0|0,0,2]=3 130 B13R2.13409 CC1(C)[C@@H]2C[C@@H](O)[C@@]1(C)C[C@@H]2O Amb28385024 [0,1,0,0,0,0|0,0,2]=3 131 B13R2.13409 CC1(C)[C@@H]2C[C@@H](O)[C@@]1(C)C[C@H]2O Amb27197600 [0,1,0,0,0,0|0,0,2]=3 132 B13R2.13409 CC1(C)[C@H]2CC(O)[C@]1(C)CC2O Amb27435619 [0,1,0,0,0,0|0,0,2]=3 133 B13R2.13409 CC12CC(=O)C(CC1=O)C2(C)C Amb2792589 [0,1,0,0,0,0|0,0,1]=2 134 B13R2.13409 CC12CC(Br)C(CC1=O)C2(C)C Amb2616511 [0,1,0,0,0,0|0,0,0]=1 135 B13R2.13409 CC12CC(I)C(CC1=O)C2(C)C Amb9766934 [0,1,0,0,0,0|0,0,0]=1 136 B13R2.13409 CC12CC(O)C(CC1=O)C2(C)C Amb9767509 [0,1,0,0,0,0|0,0,0]=1 137 B13R2.16542 C=C1C(=O)C2(C)CCC1C2(C)C Amb2385787 [0,1,0,0,0,0|0,0,1]=2 138 B13R2.16542 C=C1C(=O)[C@@]2(C)CC[C@@H]1C2(C)C Amb28052511 [0,1,0,0,0,0|0,0,1]=2 139 B13R2.16542 C=C1C(=O)[C@H]2CC[C@]1(C)C2(C)C Amb27212475 [0,1,0,0,0,0|1,0,1]=3 140 B13R2.16542 C=C1C(=O)[C@]2(C)CC[C@H]1C2(C)C Amb27432659 [0,1,0,0,0,0|0,0,1]=2 141 B13R2.16542 C=C1[C@H](O)C2(C)CC[C@@H]1C2(C)C Amb27198102 [0,1,0,0,0,0|0,0,3]=4 142 B13R2.16542 CC1(C)C2CCC1(Br)C(=O)C2=O Amb9767487 [0,1,0,0,0,0|1,0,1]=3 143 B13R2.16542 CC1(C)C2CCC1(C)C(Cl)C2N Amb27484081 [0,1,0,0,0,0|1,0,1]=3 144 B13R2.16542 CC1(C)C2CCC1(C)C(N)C2N Amb17777962 [0,1,0,0,0,0|1,0,1]=3 145 B13R2.16542 CC1(C)C2CCC1(C)C(N)C2N Amb17843460 [0,1,0,0,0,0|1,0,1]=3 146 B13R2.16542 CC1(C)C2CCC1(C)C(N)C2N Amb21947908 [0,1,0,0,0,0|1,0,1]=3 147 B13R2.16542 CC1(C)C2CCC1(C)C(N)C2N Amb2385950 [0,1,0,0,0,0|1,0,1]=3 148 B13R2.16542 CC1(C)C2CCC1(C)C(N)C2O Amb28208480 [0,1,0,0,0,0|1,0,1]=3 149 B13R2.16542 CC1(C)C2CCC1(C)C(O)C2=O Amb23589713 [0,1,0,0,0,0|0,0,3]=4 150 B13R2.16542 CC1(C)C2CCC1(C)C(O)C2Cl Amb27392256 [0,1,0,0,0,0|0,0,2]=3 151 B13R2.16542 CC1(C)C2CCC1(C)C(O)C2N Amb9782746 [0,1,0,0,0,0|0,0,2]=3 152 B13R2.16542 CC1(C)C2CCC1(C)C(O)C2S Amb28061935 [0,1,0,0,0,0|0,0,2]=3 153 B13R2.16542 CC1(C)C2CCC1(C)C([NH3+])C2N Amb17777951 [0,1,0,0,0,0|1,0,1]=3 154 B13R2.16542 CC1(C)C2CCC1(C)C([NH3+])C2[NH3+] Amb17777952 [0,1,0,0,0,0|1,0,1]=3 155 B13R2.16542 CC1(C)C2CCC1(C)C([NH3+])C2[NH3+] Amb17843457 [0,1,0,0,0,0|1,0,1]=3 156 B13R2.16542 CC1(C)C2CCC1(O)C(O)C2O Amb27431287 [0,1,0,0,0,0|1,0,2]=4 157 B13R2.16542 CC1(C)C2CC[C@@]1(C)C(=O)C2=O Amb22224832 [0,1,0,0,0,0|0,0,1]=2 158 B13R2.16542 CC1(C)C2CC[C@@]1(C)C(=O)[C@@H]2O Amb27785486 [0,1,0,0,0,0|0,0,0]=1 159 B13R2.16542 CC1(C)[C@@H]2CCC1(C)[C@H](O)[C@@H]2O Amb27197211 [0,1,0,0,0,0|0,0,2]=3 160 B13R2.16542 CC1(C)[C@@H]2CC[C@@]1(Br)C(=O)C2=O Amb27801041 [0,1,0,0,0,0|1,0,1]=3 161 B13R2.16542 CC1(C)[C@@H]2CC[C@@]1(C)C(=O)C2=O Amb6298342 [0,1,0,0,0,0|0,0,1]=2 162 B13R2.16542 CC1(C)[C@@H]2CC[C@@]1(C)C(=O)C2Br Amb8627751 [0,1,0,0,0,0|0,0,0]=1 163 B13R2.16542 CC1(C)[C@@H]2CC[C@@]1(C)C(=O)C2Cl Amb27432920 [0,1,0,0,0,0|0,0,0]=1 164 B13R2.16542 CC1(C)[C@@H]2CC[C@@]1(C)C(=O)[C@H]2Br Amb8627752 [0,1,0,0,0,0|0,0,0]=1 165 B13R2.16542 CC1(C)[C@@H]2CC[C@@]1(C)C(=O)[C@H]2N Amb27443681 [0,1,0,0,0,0|0,0,0]=1 166 B13R2.16542 CC1(C)[C@@H]2CC[C@@]1(C)C(=O)[C@H]2O Amb28351674 [0,1,0,0,0,0|0,0,0]=1 167 B13R2.16542 CC1(C)[C@@H]2CC[C@@]1(C)C(N)C2N Amb27233382 [0,1,0,0,0,0|1,0,1]=3 168 B13R2.16542 CC1(C)[C@@H]2CC[C@@]1(C)C(O)[C@H]2N Amb27204907 [0,1,0,0,0,0|0,0,2]=3 169 B13R2.16542 CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](N)C2=O Amb27634895 [0,1,0,0,0,0|1,0,2]=4 170 B13R2.16542 CC1(C)[C@@H]2CC[C@@]1(C)[C@H](N)[C@@H]2N Amb27845602 [0,1,0,0,0,0|1,0,1]=3 171 B13R2.16542 CC1(C)[C@@H]2CC[C@@]1(C)[C@H](O)C2=O Amb27227088 [0,1,0,0,0,0|0,0,3]=4 172 B13R2.16542 CC1(C)[C@@H]2CC[C@@]1(C)[C@H](O)C2N Amb27790209 [0,1,0,0,0,0|0,0,2]=3 173 B13R2.16542 CC1(C)[C@@H]2CC[C@@]1(C)[C@H](O)[C@@H]2N Amb28052048 [0,1,0,0,0,0|0,0,2]=3 174 B13R2.16542 CC1(C)[C@@H]2CC[C@@]1(C)[C@H](O)[C@@H]2O Amb33524061 [0,1,0,0,0,0|0,0,2]=3 175 B13R2.16542 CC1(C)[C@@H]2CC[C@@]1(C)[C@H](O)[C@H]2N Amb28076661 [0,1,0,0,0,0|0,0,2]=3 176 B13R2.16542 CC1(C)[C@@H]2CC[C@]1(C)C(=O)C2=O Amb27204905 [0,1,0,0,0,0|0,0,1]=2 177 B13R2.16542 CC1(C)[C@@H]2CC[C@]1(C)C(=O)[C@@H]2N Amb27789948 [0,1,0,0,0,0|0,0,0]=1 178 B13R2.16542 CC1(C)[C@H]2CC[C@@]1(C)[C@H](O)C2=O Amb27880613 [0,1,0,0,0,0|0,0,3]=4 179 B13R2.16542 CC1(C)[C@H]2CC[C@@]1(C)[C@H](O)[C@@H]2O Amb34915015 [0,1,0,0,0,0|0,0,2]=3 180 B13R2.16542 CC1(C)[C@H]2CC[C@]1(C)C(=O)C2=O Amb8628131 [0,1,0,0,0,0|0,0,1]=2 181 B13R2.16542 CC1(C)[C@H]2CC[C@]1(C)C(=O)[C@@H]2Cl Amb28325091 [0,1,0,0,0,0|0,0,0]=1 182 B13R2.16542 CC1(C)[C@H]2CC[C@]1(C)C(=O)[C@@H]2F Amb27854680 [0,1,0,0,0,0|0,0,0]=1 183 B13R2.16542 CC1(C)[C@H]2CC[C@]1(C)C(O)C2N Amb27195763 [0,1,0,0,0,0|0,0,2]=3 184 B13R2.16542 CC1(C)[C@H]2CC[C@]1(C)[C@@H](O)[C@@H]2O Amb27969827 [0,1,0,0,0,0|0,0,2]=3 185 B13R2.16542 CC1(C)[C@H]2CC[C@]1(C)[C@@H](O)[C@H]2N Amb27666915 [0,1,0,0,0,0|0,0,2]=3 186 B13R2.16542 CC1(C)[C@H]2CC[C@]1(C)[C@@H](O)[C@H]2O Amb26892455 [0,1,0,0,0,0|0,0,2]=3 187 B13R2.16542 CC1(C)[C@H]2CC[C@]1(C)[C@H](Cl)[C@H]2Cl Amb28401411 [0,1,0,0,0,0|1,0,1]=3 188 B13R2.16542 CC1(C)[C@H]2CC[C@]1(C)[C@H](O)[C@@H]2O Amb27219065 [0,1,0,0,0,0|0,0,2]=3 189 B13R2.16542 CC1(C)[C@H]2CC[C@]1(C)[C@H](O)[C@H]2O Amb28069744 [0,1,0,0,0,0|0,0,2]=3 190 B13R2.16542 CC12CCC(C(=O)C1=O)C2(C)C Amb1152239 [0,1,0,0,0,0|0,0,1]=2 191 B13R2.16542 CC12CCC(C(Br)C1=O)C2(C)C Amb614189 [0,1,0,0,0,0|0,0,0]=1 192 B13R2.16542 CC12CCC(C(O)C1=O)C2(C)C Amb23589712 [0,1,0,0,0,0|0,0,0]=1 193 B13R2.16542 CC12CC[C@@H](C(Br)C1=O)C2(C)C Amb9786352 [0,1,0,0,0,0|0,0,0]=1 194 B13R2.16542 CC12CC[C@H]([C@H](Br)C1=O)C2(C)C Amb24639713 [0,1,0,0,0,0|0,0,0]=1 195 B13R2.16542 CC1C(=O)C2(C)CCC1C2(C)C Amb17843341 [0,1,0,0,0,0|0,0,0]=1 196 B13R2.16542 C[C@@H]1C(=O)[C@@]2(C)C=C[C@@H]1C2(C)C Amb27467780 [0,1,0,0,0,0|0,0,2]=3 197 B13R2.16542 C[C@H]1[C@H]2CC[C@@](C)([C@@H]1O)C2(C)C Amb27184502 [0,1,0,0,0,0|0,0,2]=3 198 B13R2.16844 C=C1CC2CCC1(CO)C2(C)C Amb28318480 [0,1,0,0,0,0|1,0,0]=2 199 B13R2.16844 C=C1C[C@H]2CC[C@]1(CO)C2(C)C Amb28345365 [0,1,0,0,0,0|1,0,0]=2 200 B13R2.16844 C=CC12CCC(CC1O)C2(C)C Amb27416763 [0,1,0,0,0,0|0,0,3]=4 201 B13R2.16844 CC1(C)C2CCC1(C#N)C(=O)C2 Amb9767484 [0,1,0,0,0,0|0,0,1]=2 202 B13R2.16844 CC1(C)C2CCC1(C=O)C(=O)C2 Amb9781761 [0,1,0,0,0,0|0,0,1]=2 203 B13R2.16844 CC1(C)C2CCC1(C=O)C(O)C2 Amb28199955 [0,1,0,0,0,0|0,0,3]=4 204 B13R2.16844 CC1(C)C2CCC1(CBr)C(=O)C2 Amb2537009 [0,1,0,0,0,0|0,0,0]=1 205 B13R2.16844 CC1(C)C2CCC1(CBr)C(O)C2 Amb23592161 [0,1,0,0,0,0|0,0,2]=3 206 B13R2.16844 CC1(C)C2CCC1(CCl)C(=O)C2 Amb25983805 [0,1,0,0,0,0|0,0,0]=1 207 B13R2.16844 CC1(C)C2CCC1(CCl)C(Cl)C2 Amb27226054 [0,1,0,0,0,0|1,0,1]=3 208 B13R2.16844 CC1(C)C2CCC1(CF)C(=O)C2 Amb23456130 [0,1,0,0,0,0|0,0,0]=1 209 B13R2.16844 CC1(C)C2CCC1(CI)C(=O)C2 Amb2792566 [0,1,0,0,0,0|0,0,0]=1 210 B13R2.16844 CC1(C)C2CCC1(CO)C(N)C2 Amb25804047 [0,1,0,0,0,0|1,0,1]=3 211 B13R2.16844 CC1(C)C2CCC1(CO)C(O)C2 Amb25972935 [0,1,0,0,0,0|0,0,2]=3 212 B13R2.16844 CC1(C)C2CCC1(CS)C(=O)C2 Amb28132978 [0,1,0,0,0,0|0,0,0]=1 213 B13R2.16844 CC1(C)C2CC[C@@]1(CCl)C(=O)C2 Amb25209569 [0,1,0,0,0,0|0,0,0]=1 214 B13R2.16844 CC1(C)C2CC[C@@]1(CS)[C@H](O)C2 Amb22233235 [0,1,0,0,0,0|0,0,2]=3 215 B13R2.16844 CC1(C)C2CC[C@]1(CS)C(O)C2 Amb27422004 [0,1,0,0,0,0|0,0,2]=3 216 B13R2.16844 CC1(C)C2CC[C@]1(CS)[C@H](O)C2 Amb28292687 [0,1,0,0,0,0|0,0,2]=3 217 B13R2.16844 CC1(C)[C@@H]2CC[C@@]1(C#N)C(=O)C2 Amb27420127 [0,1,0,0,0,0|0,0,1]=2 218 B13R2.16844 CC1(C)[C@@H]2CC[C@@]1(C=O)C(=O)C2 Amb27195818 [0,1,0,0,0,0|0,0,1]=2 219 B13R2.16844 CC1(C)[C@@H]2CC[C@@]1(CBr)C(=O)C2 Amb27963884 [0,1,0,0,0,0|0,0,0]=1 220 B13R2.16844 CC1(C)[C@@H]2CC[C@@]1(CCl)C(=O)C2 Amb25264105 [0,1,0,0,0,0|0,0,0]=1 221 B13R2.16844 CC1(C)[C@@H]2CC[C@@]1(CO)C(=O)C2 Amb28052344 [0,1,0,0,0,0|0,0,0]=1 222 B13R2.16844 CC1(C)[C@@H]2CC[C@@]1(CO)[C@@H](O)C2 Amb27420539 [0,1,0,0,0,0|0,0,2]=3 223 B13R2.16844 CC1(C)[C@@H]2CC[C@@]1(CS)[C@@H](O)C2 Amb26947997 [0,1,0,0,0,0|0,0,2]=3 224 B13R2.16844 CC1(C)[C@@H]2CC[C@@]1(CS)[C@H](O)C2 Amb22388542 [0,1,0,0,0,0|0,0,2]=3 225 B13R2.16844 CC1(C)[C@@H]2CC[C@]1(CO)[C@@H](O)C2 Amb27981953 [0,1,0,0,0,0|0,0,2]=3 226 B13R2.16844 CC1(C)[C@H]2CC[C@]1(C#N)[C@@H](O)C2 Amb28129848 [0,1,0,0,0,0|0,0,3]=4 227 B13R2.16844 CC1(C)[C@H]2CC[C@]1(CCl)C(=O)C2 Amb23401500 [0,1,0,0,0,0|0,0,0]=1 228 B13R2.16844 CC1(C)[C@H]2CC[C@]1(CN)C(N)C2 Amb27482590 [0,1,0,0,0,0|1,0,1]=3 229 B13R2.16844 CC1(C)[C@H]2CC[C@]1(CN)[C@@H](O)C2 Amb27477756 [0,1,0,0,0,0|0,0,2]=3 230 B13R2.16844 CC1(C)[C@H]2CC[C@]1(CO)C(=O)C2 Amb28202309 [0,1,0,0,0,0|0,0,0]=1 231 B13R2.16844 CC1(C)[C@H]2CC[C@]1(CS)[C@@H](O)C2 Amb25912614 [0,1,0,0,0,0|0,0,2]=3 232 B13R2.16844 CCC12CCC(CC1=O)C2(C)C Amb27176182 [0,1,0,0,0,0|0,0,0]=1 233 B13R2.16844 CCC12CCC(CC1Cl)C2(C)C Amb27793473 [0,1,0,0,0,0|1,0,1]=3 234 B13R2.16844 CCC12CCC(CC1O)C2(C)C Amb27651642 [0,1,0,0,0,0|0,0,2]=3 235 B13R2.16844 CC[C@@]12CC[C@@H](CC1=O)C2(C)C Amb28052402 [0,1,0,0,0,0|0,0,0]=1 236 B13R2.16844 CC[C@]12CC[C@H](CC1=O)C2(C)C Amb27854682 [0,1,0,0,0,0|0,0,0]=1 237 B13R2.18788 CC1(C#N)[C@H]2CC[C@]1(C)C(=O)C2 Amb27970129 [0,1,0,0,0,0|0,0,1]=2 238 B13R2.18788 CC1(C#N)[C@H]2CC[C@]1(C)[C@@H](O)C2 Amb27427899 [0,1,0,0,0,0|0,0,3]=4 239 B13R2.18788 CC1(CBr)[C@@H]2CC[C@@]1(C)C(=O)C2 Amb25984567 [0,1,0,0,0,0|0,0,0]=1 240 B13R2.18788 CC1(CO)[C@@H]2CC[C@]1(C)C(=O)C2 Amb27844302 [0,1,0,0,0,0|0,0,0]=1 241 B13R2.18788 CC12CCC(CC1=O)C2(C)CBr Amb2778579 [0,1,0,0,0,0|0,0,0]=1 242 B13R2.18788 CC12CCC(CC1=O)C2(C)CI Amb2792568 [0,1,0,0,0,0|0,0,0]=1 243 B13R2.18788 CC12CCC(CC1O)C2(C)CBr Amb2792591 [0,1,0,0,0,0|0,0,2]=3 244 B13R2.18788 CC12CCC(CC1O)C2(C)CCl Amb28198888 [0,1,0,0,0,0|0,0,2]=3 245 B13R2.18788 CC12CCC(CC1O)C2(C)CI Amb2792592 [0,1,0,0,0,0|0,0,2]=3 246 B13R2.18788 CC12CCC(CC1O)C2(C)CO Amb28325868 [0,1,0,0,0,0|0,0,2]=3 247 B13R2.18788 CC12CC[C@H](C[C@H]1O)C2(C)CO Amb27443604 [0,1,0,0,0,0|0,0,2]=3 248 B13R2.18788 CCC1(C)C2CCC1(C)C(O)C2 Amb28185184 [0,1,0,0,0,0|0,0,2]=3 249 B13R2.22580 CC1(C)[C@@]2(C)CC[C@]1(C)[C@H](O)C2 Amb28206067 [0,1,0,0,0,0|0,0,2]=3 250 B13R2.22580 CC1(C)[C@]2(C)CC[C@@]1(C)[C@@H](N)C2 Amb27781449 [0,1,0,0,0,0|1,0,1]=3 251 B13R2.22580 CC1(C)[C@]2(C)CC[C@@]1(C)[C@H](O)C2 Amb27797198 [0,1,0,0,0,0|0,0,2]=3 252 B13R2.22580 CC1(C)[C@]2(C)CC[C@@]1(Cl)C[C@@H]2Cl Amb28053375 [0,1,0,0,0,0|1,0,1]=3 253 B13R2.22580 CC1(C)[C@]2(C)CC[C@@]1(Cl)C[C@H]2Cl Amb27428369 [0,1,0,0,0,0|1,0,1]=3 254 B13R2.22580 CC1(C)[C@]2(C)CC[C@@]1(O)CC2=O Amb27427681 [0,1,0,0,0,0|0,0,0]=1 255 B13R2.22580 CC1(C)[C@]2(Cl)CC[C@@]1(C)[C@H](O)C2 Amb27969132 [0,1,0,0,0,0|0,0,2]=3 256 B13R2.22580 CC1(C)[C@]2(O)CC[C@@]1(C)C(=O)C2 Amb28246534 [0,1,0,0,0,0|0,0,0]=1 257 B13R2.22580 CC12CCC(Br)(CC1=O)C2(C)C Amb2796057 [0,1,0,0,0,0|0,0,0]=1 258 B13R2.22580 CC12CCC(C)(C(=O)C1)C2(C)C Amb2858997 [0,1,0,0,0,0|0,0,0]=1 259 B13R2.22580 CC12CCC(C)(C(O)C1)C2(C)C Amb2858998 [0,1,0,0,0,0|0,0,2]=3 260 B13R2.22580 CC12CCC(Cl)(CC1Cl)C2(C)C Amb28074017 [0,1,0,0,0,0|1,0,1]=3 261 B13R2.22580 CC12CCC(I)(CC1=O)C2(C)C Amb9766933 [0,1,0,0,0,0|0,0,0]=1 262 B13R2.22580 CC12CCC(N)(CC1=O)C2(C)C Amb5751268 [0,1,0,0,0,0|0,0,0]=1 263 B13R2.22580 CC12CCC(N)(CC1O)C2(C)C Amb23448461 [0,1,0,0,0,0|0,0,2]=3 264 B13R2.22580 CC12CCC(O)(CC1=O)C2(C)C Amb27176194 [0,1,0,0,0,0|0,0,0]=1 265 B11R1.21 C=C(C)C1CCC(C)C(=O)C1 Amb3940292 [0,0,1,0,0,0|0,0,2]=3 266 B11R1.21 C=C(C)[C@@H]1CC[C@@H](C)C(=O)C1 Amb26925649 [0,0,1,0,0,0|0,0,2]=3 267 B11R1.21 C=C(C)[C@H]1CCC(C)C(=O)C1 Amb27164605 [0,0,1,0,0,0|0,0,2]=3 268 B11R1.21 C=C(C)[C@H]1CC[C@H](C)C(=O)C1 Amb6600487 [0,0,1,0,0,0|0,0,2]=3 269 B11R1.21 C=C1CCC(C(C)C)CC1=O Amb27212483 [0,0,1,0,0,0|0,0,2]=3 270 B11R1.21 CC(=O)[C@H]1CC[C@H](C)C(=O)C1 Amb27447292 [0,0,1,0,0,0|1,0,1]=3 271 B11R1.21 CC(C)C1=CC(=O)C(C)CC1 Amb17593805 [0,0,1,0,0,0|0,0,2]=3 272 B11R1.21 CC(C)C1=CC(=O)[C@H](C)CC1 Amb26364571 [0,0,1,0,0,0|0,0,2]=3 273 B11R1.21 CC(C)C1=CC[C@@H](C)C(=O)C1 Amb26317264 [0,0,1,0,0,0|0,0,2]=3 274 B11R1.21 CC(C)C1=CC[C@H](C)C(=O)C1 Amb24707699 [0,0,1,0,0,0|0,0,2]=3 275 B11R1.21 CC(C)C1CCC(C)C(N)C1 Amb20670102 [0,0,1,0,0,0|1,0,1]=3 276 B11R1.21 CC(C)C1CCC(C)C(O)C1 Amb17777978 [0,0,1,0,0,0|0,0,2]=3 277 B11R1.21 CC(C)C1CCC(N)C(C)C1 Amb18796947 [0,0,1,0,0,0|2,0,1]=4 278 B11R1.21 CC(C)C1CCC(N)C(F)C1 Amb32656335 [0,0,1,0,0,0|2,0,1]=4 279 B11R1.21 CC(C)C1CCC(N)C(N)C1 Amb25275378 [0,0,1,0,0,0|2,0,1]=4 280 B11R1.21 CC(C)C1CCC(O)C(N)C1 Amb27863648 [0,0,1,0,0,0|2,0,1]=4 281 B11R1.21 CC(C)C1CC[C@@H](O)[C@H](N)C1 Amb32674507 [0,0,1,0,0,0|2,0,1]=4 282 B11R1.21 CC(C)C1CN(C)C(C)CN1 Amb18830697 [0,0,1,0,0,0|3,0,0]=4 283 B11R1.21 CC(C)C1CNC(C)C(N)C1 Amb33299146 [0,0,1,0,0,0|2,0,1]=4 284 B11R1.21 CC(C)N1CC[C@@H](C)[C@@H](N)C1 Amb30023506 [0,0,1,0,0,0|2,0,1]=4 285 B11R1.21 CC(C)[C@@H]1C=C[C@@H](C)C(=O)C1 Amb26937814 [0,0,1,0,0,0|0,0,2]=3 286 B11R1.21 CC(C)[C@@H]1CC[C@@H](C)C(O)C1 Amb27853789 [0,0,1,0,0,0|0,0,2]=3 287 B11R1.21 CC(C)[C@@H]1CC[C@@H](C)[C@H](N)C1 Amb27865578 [0,0,1,0,0,0|1,0,1]=3 288 B11R1.21 CC(C)[C@@H]1CC[C@H](C)C(=O)C1 Amb27428313 [0,0,1,0,0,0|0,0,0]=1 289 B11R1.21 CC(C)[C@@H]1CC[C@H](C)[C@@H](N)C1 Amb24692687 [0,0,1,0,0,0|1,0,1]=3 290 B11R1.21 CC(C)[C@@H]1CC[C@H](C)[C@@H](O)C1 Amb27422586 [0,0,1,0,0,0|0,0,2]=3 291 B11R1.21 CC(C)[C@@H]1CC[C@H](C)[C@H](Cl)C1 Amb28436924 [0,0,1,0,0,0|1,0,1]=3 292 B11R1.21 CC(C)[C@@H]1CC[C@H](C)[C@H](O)C1 Amb25935256 [0,0,1,0,0,0|0,0,2]=3 293 B11R1.21 CC(C)[C@@H]1CC[C@H](O)[C@@H](N)C1 Amb28399373 [0,0,1,0,0,0|2,0,1]=4 294 B11R1.21 CC(C)[C@H]1CC[C@@H](C)C(=O)C1 Amb28202189 [0,0,1,0,0,0|0,0,0]=1 295 B11R1.21 CC(C)[C@H]1CC[C@@H](C)[C@H](O)C1 Amb26562309 [0,0,1,0,0,0|0,0,2]=3 296 B11R1.21 CC(C)[C@H]1CC[C@H](C)C(=O)C1 Amb25912985 [0,0,1,0,0,0|0,0,0]=1 297 B11R1.21 CC(C)[C@H]1CC[C@H](C)[C@@H](O)C1 Amb26654505 [0,0,1,0,0,0|0,0,2]=3 298 B11R1.21 CC(C)[C@H]1CN(C)[C@@H](C)CN1 Amb27215996 [0,0,1,0,0,0|3,0,0]=4 299 B11R1.21 CC(Cl)C1CCC(C)C(C)C1 Amb27661620 [0,0,1,0,0,0|2,0,1]=4 300 B11R1.21 CC(O)C1CCC(C)N(C)C1 Amb27598586 [0,0,1,0,0,0|3,0,0]=4 301 B11R1.21 CC1=CCC(C(C)C)CC1=O Amb15693452 [0,0,1,0,0,0|0,0,2]=3 302 B11R1.21 CC1=CC[C@@H](C(C)C)CC1=O Amb28291424 [0,0,1,0,0,0|0,0,2]=3 303 B11R1.21 CC1=COC(C(C)C)CC1=O Amb27859376 [0,0,1,0,0,0|1,0,2]=4 304 B11R1.21 CC1CCC(C(C)C)CC1=O Amb8392546 [0,0,1,0,0,0|0,0,0]=1 305 B11R1.21 CC1CCN(C(C)C)CC1Br Amb27469332 [0,0,1,0,0,0|2,0,1]=4 306 B11R1.21 CC1CCN(C(C)C)CC1N Amb28322427 [0,0,1,0,0,0|2,0,1]=4 307 B11R1.21 CC1CCN(C(C)C)CC1O Amb27635156 [0,0,1,0,0,0|1,0,2]=4 308 B11R1.21 CC1CC[C@@H](C(C)C)CC1=O Amb19888152 [0,0,1,0,0,0|0,0,0]=1 309 B11R1.21 CC1CC[C@H](C(C)C)CC1=O Amb24485806 [0,0,1,0,0,0|0,0,0]=1 310 B11R1.21 CC1CC[C@H](C(C)C)C[C@@H]1N Amb27974230 [0,0,1,0,0,0|1,0,1]=3 311 B11R1.126 C=C1CCC(CC=O)C1(C)C Amb28398937 [0,0,1,0,0,0|0,0,2]=3 312 B11R1.126 C=CCN1CCC(O)C1(C)C Amb27456236 [0,0,1,0,0,0|3,0,0]=4 313 B11R1.126 CC1(C)C(N)CCC1CCN Amb23560231 [0,0,1,0,0,0|2,0,1]=4 314 B11R1.126 CC1(C)C(N)CCC1CCO Amb28323139 [0,0,1,0,0,0|1,0,2]=4 315 B11R1.126 CC1=CCC(CC=O)C1(C)C Amb1033012 [0,0,1,0,0,0|0,0,2]=3 316 B11R1.126 CC1=CC[C@@H](CC=O)C1(C)C Amb27481675 [0,0,1,0,0,0|0,0,2]=3 317 B11R1.126 CC1CCC(CCO)C1(C)C Amb23589637 [0,0,1,0,0,0|0,0,2]=3 318 B11R1.126 CC1OCC(CCO)C1(C)C Amb28127233 [0,0,1,0,0,0|1,0,2]=4 319 B11R1.126 CNCC1CCN(C)C1(C)C Amb19516928 [0,0,1,0,0,0|3,0,0]=4 320 B11R1.126 C[C@@H]1CC[C@H](CCN)C1(C)C Amb28348404 [0,0,1,0,0,0|1,0,1]=3 321 B11R1.370 C=C1CC(CO)C(C)(C)C1C Amb27972464 [0,0,1,0,0,0|2,0,0]=3 322 B11R1.370 C=C1C[C@@H](CO)C(C)(C)C1C Amb27650520 [0,0,1,0,0,0|2,0,0]=3 323 B11R1.370 C=C1C[C@@H](CO)C(C)(C)[C@@H]1C Amb27455051 [0,0,1,0,0,0|2,0,0]=3 324 B11R1.370 C=C1C[C@H](CO)C(C)(C)[C@H]1C Amb28064104 [0,0,1,0,0,0|2,0,0]=3 325 B11R1.370 C=C[C@H]1CC(=O)[C@@H](C)C1(C)C Amb27844203 [0,0,1,0,0,0|0,0,2]=3 326 B11R1.370 CC1=C(C)C(C)(C)C(CO)C1 Amb27970518 [0,0,1,0,0,0|2,0,1]=4 327 B11R1.370 CC1=C[C@@H](CO)C(C)(C)[C@@H]1C Amb25366524 [0,0,1,0,0,0|2,0,1]=4 328 B11R1.370 CCC1CC(=O)C(C)C1(C)C Amb32640334 [0,0,1,0,0,0|0,0,0]=1 329 B11R1.370 CCC1CC(N)C(C)C1(C)C Amb32640336 [0,0,1,0,0,0|1,0,1]=3 330 B11R1.370 CCC1CC(O)C(C)C1(C)C Amb32640335 [0,0,1,0,0,0|0,0,2]=3 331 B11R1.370 CCC1OC(=O)C(O)C1(C)O Amb27972356 [0,0,1,0,0,0|3,0,0]=4 332 B11R1.370 CC[C@H]1OC(=O)[C@@H](O)[C@@]1(C)O Amb28138774 [0,0,1,0,0,0|3,0,0]=4 333 B11R1.370 C[C@H]1[C@H](O)C[C@@H](CO)C1(C)C Amb27792972 [0,0,1,0,0,0|1,0,2]=4 334 B11R1.491 C=C1CC(O)C(C)(C)C1(C)C Amb28065365 [0,0,1,0,0,0|2,0,0]=3 335 B11R1.491 C=C1NC(=O)C(C)(C)C1(C)C Amb27647703 [0,0,1,0,0,0|1,0,2]=4 336 B11R1.491 CC1(C)C(=O)NC(=O)C1(C)C Amb22524416 [0,0,1,0,0,0|2,0,1]=4 337 B11R1.491 CC1(C)C(=O)OC(=O)C1(C)C Amb6412494 [0,0,1,0,0,0|2,0,1]=4 338 B11R1.491 CC1CC(=O)C(C)(C)C1(C)C Amb27972998 [0,0,1,0,0,0|0,0,0]=1 339 B11R1.520 C=C1CCCCC1(C)C(C)=O Amb17593810 [0,0,1,0,0,0|2,0,1]=4 340 B11R1.520 CC(=O)C1(C)CCCCC1=O Amb17593849 [0,0,1,0,0,0|1,0,1]=3 341 B11R1.520 CC(C)C1(C)CCCNC1=O Amb33070953 [0,0,1,0,0,0|1,0,0]=2 342 B11R1.520 CC(C)C1(O)CCCCC1C Amb9675950 [0,0,1,0,0,0|2,0,1]=4 343 B11R1.520 CC(C)C1(O)CCCCC1Cl Amb27793295 [0,0,1,0,0,0|2,0,1]=4 344 B11R1.520 CC(C)[C@@]1(O)CCCC[C@@H]1Cl Amb28325654 [0,0,1,0,0,0|2,0,1]=4 345 B11R1.520 CC(O)C1(C)CCCCC1=O Amb28313009 [0,0,1,0,0,0|1,0,0]=2 346 B11R1.520 CC(O)C1(C)CCCCC1N Amb35741180 [0,0,1,0,0,0|2,0,1]=4 347 B11R1.520 CC(O)C1(C)CCCCC1O Amb27430596 [0,0,1,0,0,0|1,0,2]=4 348 B11R1.520 CC(O)C1(C)SCCCS1=O Amb27972463 [0,0,1,0,0,0|3,0,0]=4 349 B11R1.520 CC1(C(=O)Cl)CCCCC1=O Amb28250160 [0,0,1,0,0,0|2,0,1]=4 350 B11R1.520 CC1(C(=O)O)CCCCC1=O Amb24487822 [0,0,1,0,0,0|2,0,1]=4 351 B11R1.520 CC1(C(Cl)Cl)CCCCC1=O Amb28285404 [0,0,1,0,0,0|2,0,0]=3 352 B11R1.520 C[C@@H](O)[C@@]1(C)CCCCC1=O Amb27199129 [0,0,1,0,0,0|1,0,0]=2 353 B11R1.520 C[C@H](O)[C@@]1(C)CCCCC1=O Amb27855022 [0,0,1,0,0,0|1,0,0]=2 354 B11R1.1186 CC1(C)CNC(=O)C1(C)C#N Amb18125450 [0,0,1,0,0,0|2,0,1]=4 355 B11R1.1186 COC1(O)C(=O)CCC1(C)O Amb26873790 [0,0,1,0,0,0|3,0,0]=4 356 B11R1.1186 COC1(O)C(=O)CC[C@@]1(C)O Amb25808593 [0,0,1,0,0,0|3,0,0]=4 357 B11R1.1186 CO[C@]1(O)C(=O)CC[C@@]1(C)O Amb26557701 [0,0,1,0,0,0|3,0,0]=4 358 B11R1.1191 CC1(C)[C@@H](N)CC[C@@]1(C)CO Amb27814238 [0,0,1,0,0,0|1,0,2]=4 359 B11R1.1191 CC1CCC(C)(C=O)C1(C)C Amb18644692 [0,0,1,0,0,0|0,0,0]=1 360 B11R1.1191 CC1CCC(C)(CBr)C1(C)C Amb28251081 [0,0,1,0,0,0|1,0,1]=3 361 B11R1.1191 CC1CCC(C)(CCl)C1(C)C Amb35588896 [0,0,1,0,0,0|1,0,1]=3 362 B11R1.1191 CC1CCC(C)(CN)C1(C)C Amb26873297 [0,0,1,0,0,0|1,0,1]=3 363 B11R1.1191 CC1CCC(C)(CN)C1(C)C Amb32665251 [0,0,1,0,0,0|1,0,1]=3 364 B11R1.1191 CC1CCC(C)(CO)C1(C)C Amb17777994 [0,0,1,0,0,0|0,0,2]=3 365 B11R1.1191 C[C@@H]1CC[C@](C)(C#N)C1(C)C Amb35672532 [0,0,1,0,0,0|1,0,1]=3 366 B11R1.1191 C[C@@H]1CC[C@](C)(C=O)C1(C)C Amb35672620 [0,0,1,0,0,0|0,0,0]=1 367 B11R1.1191 C[C@@H]1CC[C@](C)(CBr)C1(C)C Amb35588898 [0,0,1,0,0,0|1,0,1]=3 368 B11R1.1191 C[C@@H]1CC[C@](C)(CCl)C1(C)C Amb35588897 [0,0,1,0,0,0|1,0,1]=3 369 B11R1.1191 C[C@@H]1CC[C@](C)(CN)C1(C)C Amb35670874 [0,0,1,0,0,0|1,0,1]=3 370 B11R1.1191 C[C@@H]1CC[C@](C)(CN)C1(C)C Amb35745793 [0,0,1,0,0,0|1,0,1]=3 371 B11R1.1191 C[C@@H]1CC[C@](C)(CO)C1(C)C Amb24651863 [0,0,1,0,0,0|0,0,2]=3 372 B11R1.1191 C[C@H]1CC[C@@](C)(C=O)C1(C)C Amb23452539 [0,0,1,0,0,0|0,0,0]=1 373 B11R1.1191 C[C@H]1CC[C@@](C)(CBr)C1(C)C Amb23452544 [0,0,1,0,0,0|1,0,1]=3 374 B11R1.1191 C[C@H]1CC[C@@](C)(CN)C1(C)C Amb23452543 [0,0,1,0,0,0|1,0,1]=3 375 B11R1.1191 C[C@H]1CC[C@@](C)(CN)C1(C)C Amb32666905 [0,0,1,0,0,0|1,0,1]=3 376 B11R1.1191 C[C@H]1CC[C@@](C)(CO)C1(C)C Amb23452542 [0,0,1,0,0,0|0,0,2]=3 377 B11R1.1386 C=C(C)C1(C)CCCC1(C)O Amb33213441 [0,0,1,0,0,0|2,0,0]=3 378 B11R1.1386 CC(=O)C1(C)CC=CC1(C)C Amb27164585 [0,0,1,0,0,0|0,0,2]=3 379 B11R1.1386 CC(=O)C1(C)CCCC1(C)C Amb28365381 [0,0,1,0,0,0|0,0,0]=1 380 B11R1.1386 CC(=O)C1(C)CCCC1(C)O Amb32950103 [0,0,1,0,0,0|1,0,0]=2 381 B11R1.1386 CC(=O)[C@]1(C)C=CCC1(C)C Amb27948708 [0,0,1,0,0,0|0,0,2]=3 382 B11R1.1386 CC(=O)[C@]1(C)CCCC1(C)C Amb28200610 [0,0,1,0,0,0|0,0,0]=1 383 B11R1.1386 CC(C)C1(N)CCCC1(C)C Amb27261500 [0,0,1,0,0,0|2,0,1]=4 384 B11R1.1386 CC(C)C1(O)CCCC1(C)C Amb27198712 [0,0,1,0,0,0|2,0,1]=4 385 B11R1.1386 CC(N)C1(C)CCCC1(C)O Amb35606720 [0,0,1,0,0,0|2,0,1]=4 386 B11R1.1386 CC1(C(=O)O)CCCC1(F)F Amb25223204 [0,0,1,0,0,0|3,0,0]=4 387 B11R1.1386 CC1(C)C=CCC1(C)C(=O)Cl Amb25151411 [0,0,1,0,0,0|1,0,2]=4 388 B11R1.1386 CC1(C)C=CCC1(C)C(=O)O Amb18644655 [0,0,1,0,0,0|1,0,2]=4 389 B11R1.1386 CC1(C)C=CC[C@@]1(C)C(N)=O Amb25697082 [0,0,1,0,0,0|1,0,2]=4 390 B11R1.1386 CC1(C)CCCC1(C)C(=O)O Amb25806188 [0,0,1,0,0,0|1,0,0]=2 391 B11R1.1386 CC1(C)CCCC1(N)C(=O)O Amb2695714 [0,0,1,0,0,0|2,0,0]=3 392 B11R1.1386 CC1(C)CCCC1(O)C(=O)O Amb28202508 [0,0,1,0,0,0|2,0,0]=3 393 B11R1.1386 CC1(C)CNCC1(F)C(=O)O Amb27768500 [0,0,1,0,0,0|3,0,0]=4 394 B11R1.1386 CC1(C)COCC1(N)C(=O)O Amb27944406 [0,0,1,0,0,0|3,0,0]=4 395 B11R1.1386 CC1(C)COCC1(O)C(N)=O Amb27822632 [0,0,1,0,0,0|3,0,0]=4 396 B11R1.1386 CC1(C)OCCC1(C)C(=O)O Amb32654899 [0,0,1,0,0,0|2,0,0]=3 397 B11R1.1386 CC1(C)OCCC1(N)C(=O)O Amb27822912 [0,0,1,0,0,0|3,0,0]=4 398 B11R1.1386 CC1(O)CCCC1(C)C(=O)O Amb18126142 [0,0,1,0,0,0|2,0,0]=3 399 B11R1.1386 CC1(O)CCCC1(C)C(N)=S Amb27407232 [0,0,1,0,0,0|2,1,0]=4 400 B13R3.4088 CC12COC3CC1CCC32C Amb2779918 [0,0,0,1,0,0|0,0,2]=3 401 B13R3.11442 CC1(C)C2[C@@H]3C[C@@]1(C)[C@@H](O)[C@H]23 Amb27876156 [0,0,0,1,0,0|0,0,2]=3 402 B13R3.11442 CC1(C)[C@@H]2[C@@H]3C[C@@]1(C)C(=O)[C@@H]32 Amb27434241 [0,0,0,1,0,0|0,0,0]=1 403 B13R3.11442 CC1(C)[C@H]2[C@H]3C[C@]1(C)C(Cl)[C@@H]23 Amb28346915 [0,0,0,1,0,0|1,0,1]=3 404 B13R3.11442 CC12CC3C(C1=O)C3C2(C)C Amb27599407 [0,0,0,1,0,0|0,0,0]=1 405 B13R3.13590 CC12CC3CC1CC(O)C32C Amb28294119 [0,0,0,1,0,0|0,0,2]=3 406 B13R3.13590 CC12C[C@@H]3C[C@H]1CC(=O)[C@@]32C Amb27212476 [0,0,0,1,0,0|0,0,0]=1 407 B13R3.13590 C[C@]12C[C@@H]3CC1CC(=O)[C@@]32C Amb28052537 [0,0,0,1,0,0|0,0,0]=1 408 B13R3.23441 CC12CCC3C(CC31C)C2=O Amb2476994 [0,0,0,1,0,0|0,0,0]=1 409 B13R3.23441 C[C@@]12C[C@H]3C(=O)[C@]1(C)CC[C@H]32 Amb27203987 [0,0,0,1,0,0|0,0,0]=1 410 B11R2.1734 CC1(C)C2CCC1(C)C2N Amb23590731 [0,0,0,0,1,0|1,0,1]=3 411 B11R2.1734 CC1(C)[C@H]2CC[C@]1(C)[C@H]2O Amb28429632 [0,0,0,0,1,0|0,0,2]=3 412 B13R2.10768 CC1(C)NC2(C)CCC1CC2O Amb28364315 [0,0,0,0,0,1|0,0,2]=3 413 B13R2.10768 CC1(C)OC2(C)CCC1CC2Cl Amb27477814 [0,0,0,0,0,1|1,0,1]=3 414 B13R2.10768 CC1(C)OC2(C)CCC1CC2N Amb27657733 [0,0,0,0,0,1|1,0,1]=3 415 B13R2.10768 CC1(C)OC2(C)CCC1CC2O Amb25317512 [0,0,0,0,0,1|0,0,2]=3 416 B13R2.10768 CC1(C)O[C@@]2(C)CCC1CC2O Amb27598605 [0,0,0,0,0,1|0,0,2]=3 417 B13R2.10768 CC1(C)O[C@@]2(C)CCC1C[C@H]2O Amb27978429 [0,0,0,0,0,1|0,0,2]=3 418 B13R2.10768 CC1(C)O[C@@]2(C)CC[C@@H]1CC2=O Amb28054011 [0,0,0,0,0,1|0,0,0]=1 419 B13R2.10768 CC1(C)O[C@@]2(C)CC[C@@H]1C[C@@H]2O Amb24570002 [0,0,0,0,0,1|0,0,2]=3 420 B13R2.10768 CC1(C)O[C@@]2(C)CC[C@@H]1C[C@H]2O Amb28428399 [0,0,0,0,0,1|0,0,2]=3 421 B13R2.10768 CC1(C)O[C@]2(C)CC[C@@H]1C[C@H]2O Amb27452459 [0,0,0,0,0,1|0,0,2]=3 422 B13R2.10768 CC1(C)O[C@]2(C)CC[C@H]1C[C@H]2Cl Amb28138005 [0,0,0,0,0,1|1,0,1]=3 423 B13R2.10768 CC12C=CC(CC1=O)C(C)(C)C2 Amb28144227 [0,0,0,0,0,1|0,0,2]=3 424 B13R2.10768 CC12CCC(CC1=O)C(C)(C)C2 Amb28246523 [0,0,0,0,0,1|0,0,0]=1 425 B13R2.10768 CC12CCC(CC1=O)C(C)(C)N2 Amb27882847 [0,0,0,0,0,1|0,0,0]=1 426 B13R2.10768 CC12CCC(NC1=O)C(C)(C)O2 Amb27798256 [0,0,0,0,0,1|1,0,0]=2 427 B13R2.10768 CC12CC[C@H](C[C@@H]1N)C(C)(C)O2 Amb28325032 [0,0,0,0,0,1|1,0,1]=3 428 B13R2.10846 CC1(C)[C@@H]2CC[C@@]1(C)CC(=O)C2 Amb28422750 [0,0,0,0,0,1|0,0,0]=1 429 B13R2.10846 CC12CCC(CC(=O)C1)C2(C)C Amb27770116 [0,0,0,0,0,1|0,0,0]=1 430 B13R2.11657 CC1(C)C2CCC(O)C1(C)CC2 Amb27661126 [0,0,0,0,0,1|0,0,2]=3 431 B13R2.11657 CC1(C)C2CC[C@@]1(C)C(=O)NC2 Amb27248262 [0,0,0,0,0,1|0,0,0]=1 432 B13R2.11657 CC1(C)C2CC[C@]1(C)C(=O)NC2 Amb28068871 [0,0,0,0,0,1|0,0,0]=1 433 B13R2.11657 CC1(C)[C@@H]2CC[C@@H](O)[C@@]1(C)CC2 Amb27456659 [0,0,0,0,0,1|0,0,2]=3 434 B13R2.11657 CC1(C)[C@@H]2CC[C@H](O)[C@@]1(C)CC2 Amb28069759 [0,0,0,0,0,1|0,0,2]=3 435 B13R2.11657 CC1(C)[C@H]2CC[C@H](O)[C@]1(C)CC2 Amb27184501 [0,0,0,0,0,1|0,0,2]=3 436 B13R2.11657 CC1(C)[C@H]2CC[C@]1(C)C(=O)NC2 Amb27439047 [0,0,0,0,0,1|0,0,0]=1 437 B13R2.11657 CC1(C)[C@H]2CC[C@]1(C)[C@@H](O)OC2 Amb27208198 [0,0,0,0,0,1|0,0,2]=3 438 B13R2.11657 CC12CCC(C=CC1=O)C2(C)C Amb17843520 [0,0,0,0,0,1|0,0,1]=2 439 B13R2.11657 CC12CCC(CCC1=O)C2(C)C Amb17843523 [0,0,0,0,0,1|0,0,0]=1 440 B13R2.11657 CC12CCC(CNC1=O)C2(C)C Amb17843455 [0,0,0,0,0,1|0,0,0]=1 441 B13R2.11657 CC12CCC(COC1=O)C2(C)C Amb17843456 [0,0,0,0,0,1|0,0,0]=1 442 B10R1.13 CC(C)C1CCC(Br)CC1 Amb24476828 [1,0,1,0,0,0|1,0,1]=4 443 B10R1.13 CC(C)C1CCC(N)CC1 Amb18948125 [1,0,1,0,0,0|1,0,1]=4 444 B10R1.13 CC(C)C1CCC(O)CC1 Amb2720950 [1,0,1,0,0,0|1,0,1]=4 445 B10R1.13 CC(C)C1CCC(S)CC1 Amb18797490 [1,0,1,0,0,0|1,0,1]=4 446 B10R1.13 CC(C)[C@@H]1C=C[C@H](O)CC1 Amb27849826 [1,0,1,0,0,0|1,0,1]=4 447 B10R1.13 CC(C)[C@@H]1CO[C@H](C)SC1 Amb26562981 [1,0,1,0,0,0|2,0,0]=4 448 B10R1.13 CC(C)[C@H]1CC[C@@H](C)CC1 Amb22230417 [1,0,1,0,0,0|0,0,1]=3 449 B10R1.13 CC(C)[C@H]1CC[C@@H](N)CC1 Amb26439509 [1,0,1,0,0,0|1,0,1]=4 450 B10R1.13 CC(C)[C@H]1CC[C@@H](N)CC1 Amb33483215 [1,0,1,0,0,0|1,0,1]=4 451 B10R1.13 CC(C)[C@H]1CC[C@@H](O)CC1 Amb27642106 [1,0,1,0,0,0|1,0,1]=4 452 B10R1.13 CC(C)[C@H]1CC[C@H](C)CC1 Amb22231657 [1,0,1,0,0,0|0,0,1]=3 453 B10R1.13 CC(C)[C@H]1CC[C@H](N)CC1 Amb25067421 [1,0,1,0,0,0|1,0,1]=4 454 B10R1.13 CC(C)[C@H]1CO[C@H](C)SC1 Amb24601778 [1,0,1,0,0,0|2,0,0]=4 455 B10R1.13 CC1=CCC(C(C)C)CC1 Amb22224798 [1,0,1,0,0,0|0,0,1]=3 456 B10R1.13 CC1=CCC(C(C)O)CC1 Amb27604267 [1,0,1,0,0,0|1,0,1]=4 457 B10R1.13 CC1=CC[C@H](C(C)C)CC1 Amb22369396 [1,0,1,0,0,0|0,0,1]=3 458 B10R1.13 CC1C=CC(C(C)C)CC1 Amb25350290 [1,0,1,0,0,0|0,0,1]=3 459 B10R1.13 CC1CCC(C(C)Br)CC1 Amb27406445 [1,0,1,0,0,0|1,0,1]=4 460 B10R1.13 CC1CCC(C(C)Br)CO1 Amb35679308 [1,0,1,0,0,0|2,0,0]=4 461 B10R1.13 CC1CCC(C(C)C)CC1 Amb2721192 [1,0,1,0,0,0|0,0,1]=3 462 B10R1.13 CC1CCC(C(C)C)CN1 Amb27753482 [1,0,1,0,0,0|1,0,0]=3 463 B10R1.13 CC1CCC(C(C)Cl)CO1 Amb35679307 [1,0,1,0,0,0|2,0,0]=4 464 B10R1.13 CC1CCC(C(C)N)CC1 Amb18946301 [1,0,1,0,0,0|1,0,1]=4 465 B10R1.13 CC1CCC(C(C)N)CO1 Amb35686966 [1,0,1,0,0,0|2,0,0]=4 466 B10R1.13 CC1CCC(C(C)O)CC1 Amb28247007 [1,0,1,0,0,0|1,0,1]=4 467 B10R1.13 CC1CCC(C(C)O)CN1 Amb35740956 [1,0,1,0,0,0|2,0,0]=4 468 B10R1.13 CC1CCC(C(C)O)CO1 Amb35678926 [1,0,1,0,0,0|2,0,0]=4 469 B10R1.13 CC1CCC(N(C)C)CC1 Amb27402840 [1,0,1,0,0,0|1,0,1]=4 470 B10R1.13 CC1CCC(N(C)C)CN1 Amb23589914 [1,0,1,0,0,0|2,0,0]=4 471 B10R1.13 CC1CCC([C@@H](C)N)CC1 Amb28369514 [1,0,1,0,0,0|1,0,1]=4 472 B10R1.13 CC1CCC([C@@H](C)O)CC1 Amb26502796 [1,0,1,0,0,0|1,0,1]=4 473 B10R1.13 CC1CCC([C@H](C)N)CC1 Amb25048061 [1,0,1,0,0,0|1,0,1]=4 474 B10R1.13 CC1CCC([C@H](C)O)CC1 Amb27946489 [1,0,1,0,0,0|1,0,1]=4 475 B10R1.13 CC1CCN(C(C)C)CC1 Amb9173385 [1,0,1,0,0,0|1,0,1]=4 476 B10R1.13 CC1CNC(C(C)C)CN1 Amb17578116 [1,0,1,0,0,0|2,0,0]=4 477 B10R1.13 CC1NCC(C(C)C)CO1 Amb33194043 [1,0,1,0,0,0|2,0,0]=4 478 B10R1.13 CN(C)[C@H]1CC[C@H](C)CC1 Amb35825294 [1,0,1,0,0,0|1,0,1]=4 479 B10R1.113 C=C(C)C1CCCC(=O)C1 Amb17593503 [1,0,1,0,0,0|0,0,2]=4 480 B10R1.113 C=C(C)[C@H]1CCCC(=O)C1 Amb27262989 [1,0,1,0,0,0|0,0,2]=4 481 B10R1.113 CC(=O)[C@@H]1CCCC(=O)C1 Amb27974638 [1,0,1,0,0,0|1,0,1]=4 482 B10R1.113 CC(C)C1=CC(=O)CCC1 Amb24387042 [1,0,1,0,0,0|0,0,2]=4 483 B10R1.113 CC(C)C1CC(=O)CCN1 Amb18831681 [1,0,1,0,0,0|1,0,0]=3 484 B10R1.113 CC(C)C1CC(=O)CCO1 Amb22304819 [1,0,1,0,0,0|1,0,0]=3 485 B10R1.113 CC(C)C1CC=CC(=O)C1 Amb28201136 [1,0,1,0,0,0|0,0,2]=4 486 B10R1.113 CC(C)C1CCCC(=O)C1 Amb4034784 [1,0,1,0,0,0|0,0,0]=2 487 B10R1.113 CC(C)C1CCCC(=O)N1 Amb27816909 [1,0,1,0,0,0|1,0,0]=3 488 B10R1.113 CC(C)C1CCCC(=O)O1 Amb31031119 [1,0,1,0,0,0|1,0,0]=3 489 B10R1.113 CC(C)C1CCCC(N)C1 Amb19514780 [1,0,1,0,0,0|1,0,1]=4 490 B10R1.113 CC(C)C1CCCC(S)C1 Amb28187985 [1,0,1,0,0,0|0,1,1]=4 491 B10R1.113 CC(C)C1CCCN(N)C1 Amb25675492 [1,0,1,0,0,0|2,0,0]=4 492 B10R1.113 CC(C)C1CCNC(=O)N1 Amb24473142 [1,0,1,0,0,0|2,0,0]=4 493 B10R1.113 CC(C)C1CCOC(=O)C1 Amb27411880 [1,0,1,0,0,0|1,0,0]=3 494 B10R1.113 CC(C)C1CNCC(=O)N1 Amb24351593 [1,0,1,0,0,0|2,0,0]=4 495 B10R1.113 CC(C)C1CNCC(=O)N1 Amb32410674 [1,0,1,0,0,0|2,0,0]=4 496 B10R1.113 CC(C)C1COCC(=O)N1 Amb21864801 [1,0,1,0,0,0|2,0,0]=4 497 B10R1.113 CC(C)C1CS(=O)CCN1 Amb27175005 [1,0,1,0,0,0|2,0,0]=4 498 B10R1.113 CC(C)N1CCCC(=O)C1 Amb19957709 [1,0,1,0,0,0|1,0,0]=3 499 B10R1.113 CC(C)[C@@H]1CC(=O)CCN1 Amb28326111 [1,0,1,0,0,0|1,0,0]=3 500 B10R1.113 CC(C)[C@@H]1CCCC(N)C1 Amb28423963 [1,0,1,0,0,0|1,0,1]=4 501 B10R1.113 CC(C)[C@@H]1CCC[C@@H](N)C1 Amb27467103 [1,0,1,0,0,0|1,0,1]=4 502 B10R1.113 CC(C)[C@@H]1CCC[C@@H](O)C1 Amb28069430 [1,0,1,0,0,0|0,0,2]=4 503 B10R1.113 CC(C)[C@@H]1CCNC(=O)C1 Amb27262324 [1,0,1,0,0,0|1,0,0]=3 504 B10R1.113 CC(C)[C@@H]1CCOC(=O)C1 Amb26398880 [1,0,1,0,0,0|1,0,0]=3 505 B10R1.113 CC(C)[C@@H]1CNCC(=O)N1 Amb27615026 [1,0,1,0,0,0|2,0,0]=4 506 B10R1.113 CC(C)[C@H]1CC=CC(=O)C1 Amb28049897 [1,0,1,0,0,0|0,0,2]=4 507 B10R1.113 CC(C)[C@H]1CCC[C@H](N)C1 Amb27245403 [1,0,1,0,0,0|1,0,1]=4 508 B10R1.113 CC(C)[C@H]1CCOC(=O)N1 Amb28042606 [1,0,1,0,0,0|2,0,0]=4 509 B10R1.113 CC(O)C1CCNC(=O)C1 Amb25137865 [1,0,1,0,0,0|2,0,0]=4 510 B10R1.113 CN(C)C1CCCC(=O)C1 Amb25344066 [1,0,1,0,0,0|1,0,0]=3 511 B10R1.113 CN(C)C1CCCC(=O)C1 Amb33313456 [1,0,1,0,0,0|1,0,0]=3 512 B10R1.113 CS(=O)C1CCCC(=O)C1 Amb27839040 [1,0,1,0,0,0|2,0,0]=4 513 B10R1.113 O=C1CCCC(C(Cl)Cl)C1 Amb27983732 [1,0,1,0,0,0|2,0,0]=4 514 B10R1.113 O=C1CCCC(C(F)F)C1 Amb24743635 [1,0,1,0,0,0|2,0,0]=4 515 B10R1.176 CC1CCC(CCl)NC1=O Amb27481484 [1,0,1,0,0,0|2,0,0]=4 516 B10R1.176 CC1CCC(CO)CC1=O Amb27433532 [1,0,1,0,0,0|1,0,0]=3 517 B10R1.176 CC1CCC(CO)NC1=O Amb27828134 [1,0,1,0,0,0|2,0,0]=4 518 B10R1.176 CC1CCC(CO)OC1=O Amb27772597 [1,0,1,0,0,0|2,0,0]=4 519 B10R1.176 CCC1CC=C(C)C(=O)C1 Amb27861254 [1,0,1,0,0,0|0,0,2]=4 520 B10R1.176 CCC1CCC(=O)C(=O)C1 Amb26873237 [1,0,1,0,0,0|1,0,1]=4 521 B10R1.176 CCC1CSC(C)C(=O)N1 Amb27243813 [1,0,1,0,0,0|2,0,0]=4 522 B10R1.176 CC[C@@H]1CC=C(C)C(=O)C1 Amb27802792 [1,0,1,0,0,0|0,0,2]=4 523 B10R1.176 CC[C@@H]1CC[C@@H](C)C(=O)C1 Amb28351646 [1,0,1,0,0,0|0,0,0]=2 524 B10R1.176 CC[C@@H]1CC[C@@H](C)N(N)C1 Amb30028030 [1,0,1,0,0,0|2,0,0]=4 525 B10R1.176 CC[C@H]1CC[C@@H](C)N(C)C1 Amb27982481 [1,0,1,0,0,0|2,0,0]=4 526 B10R1.176 CN1CCC(CBr)CC1=O Amb24481231 [1,0,1,0,0,0|2,0,0]=4 527 B10R1.176 CN1CCC(CN)CC1=O Amb18908367 [1,0,1,0,0,0|2,0,0]=4 528 B10R1.176 CN1CCC(CN)CC1=O Amb23439152 [1,0,1,0,0,0|2,0,0]=4 529 B10R1.176 CN1CCC(CN)CC1=O Amb28555569 [1,0,1,0,0,0|2,0,0]=4 530 B10R1.176 CN1CCC(CO)CC1=O Amb21960396 [1,0,1,0,0,0|2,0,0]=4 531 B10R1.176 CNC1CCN(C)C(=O)C1 Amb25185404 [1,0,1,0,0,0|2,0,0]=4 532 B10R1.94 C=CCC1CCC(Cl)C1C Amb28182452 [1,0,1,0,0,0|2,0,0]=4 533 B10R1.94 CC1CCN(CC=O)C1C Amb27453752 [1,0,1,0,0,0|1,0,0]=3 534 B10R1.94 CC1OCC(NC=O)C1C Amb29856406 [1,0,1,0,0,0|2,0,0]=4 535 B10R1.133 C=CCN1CCCC1(C)C Amb28125462 [1,0,1,0,0,0|2,0,0]=4 536 B10R1.133 CC1(C)CCCC1CCN Amb27267328 [1,0,1,0,0,0|1,0,1]=4 537 B10R1.133 CC1(C)CCCC1N=C=O Amb27476722 [1,0,1,0,0,0|1,0,1]=4 538 B10R1.133 CC1(C)CCCC1NC=O Amb27837782 [1,0,1,0,0,0|1,0,0]=3 539 B10R1.133 CC1(C)CCC[C@H]1CC=O Amb27614903 [1,0,1,0,0,0|0,0,0]=2 540 B10R1.133 CC1(C)OCCC1NC=O Amb27948879 [1,0,1,0,0,0|2,0,0]=4 541 B10R1.133 CC1(C)SCCC1CC=O Amb33339527 [1,0,1,0,0,0|1,0,0]=3 542 B10R1.259 CC1=CCC(CN)C1(C)C Amb27185560 [1,0,1,0,0,0|1,0,1]=4 543 B10R1.259 CC1=CCC(CO)C1(C)C Amb22500358 [1,0,1,0,0,0|1,0,1]=4 544 B10R1.259 CC1=CC[C@H](CN)C1(C)C Amb27272607 [1,0,1,0,0,0|1,0,1]=4 545 B10R1.259 CC1C=CC(CO)C1(C)C Amb28045624 [1,0,1,0,0,0|1,0,1]=4 546 B10R1.259 CC1CCC(C=O)C1(C)C Amb18643638 [1,0,1,0,0,0|0,0,0]=2 547 B10R1.259 CC1CCC(CBr)C1(C)C Amb27768838 [1,0,1,0,0,0|1,0,0]=3 548 B10R1.259 CC1CCC(CN)C1(C)C Amb28314784 [1,0,1,0,0,0|1,0,0]=3 549 B10R1.259 C[C@H]1CC[C@@H](CO)C1(C)C Amb27207427 [1,0,1,0,0,0|0,0,1]=3 550 B10R1.34 CC1C(=O)NC(CO)C1C Amb27965795 [1,0,1,0,0,0|2,0,0]=4 551 B10R1.34 CCC1OC(=O)C(O)C1C Amb27978237 [1,0,1,0,0,0|2,0,0]=4 552 B10R1.34 CC[C@@H]1OC(=O)[C@@H](N)[C@@H]1C Amb27235698 [1,0,1,0,0,0|2,0,0]=4 553 B10R1.339 CC1=CC(=O)C(C)(C)C1C Amb27470175 [1,0,1,0,0,0|0,0,2]=4 554 B10R1.339 CC1=CC(=O)C(C)(C)[C@@H]1C Amb27437817 [1,0,1,0,0,0|0,0,2]=4 555 B10R1.339 CC1C(=O)CC(O)C1(C)C Amb27859397 [1,0,1,0,0,0|1,0,0]=3 556 B10R1.339 CC1CC(=O)C(C)C1(C)C Amb28131970 [1,0,1,0,0,0|0,0,0]=2 557 B10R1.339 CC1CC(O)C(C)C1(C)C Amb28050643 [1,0,1,0,0,0|0,0,2]=4 558 B10R1.339 CC1OC(=O)C(C)(C)C1O Amb28050652 [1,0,1,0,0,0|2,0,0]=4 559 B10R1.339 CC1OC(=O)C(O)C1(C)C Amb27461781 [1,0,1,0,0,0|2,0,0]=4 560 B10R1.339 C[C@@H]1OC(=O)C(C)(C)[C@@H]1O Amb27428349 [1,0,1,0,0,0|2,0,0]=4 561 B10R1.339 C[C@@H]1OC(=O)C(C)(C)[C@H]1O Amb27653024 [1,0,1,0,0,0|2,0,0]=4 562 B10R1.339 C[C@H]1CC(=O)C(C)(C)[C@H]1C Amb28054010 [1,0,1,0,0,0|0,0,0]=2 563 B10R1.339 C[C@H]1CC(=O)[C@H](C)C1(C)C Amb28411205 [1,0,1,0,0,0|0,0,0]=2 564 B10R1.444 CC1(C)CC(=O)CC1C=O Amb28141256 [1,0,1,0,0,0|1,0,1]=4 565 B10R1.444 CC1(C)CC(=O)NC1CI Amb32650190 [1,0,1,0,0,0|2,0,0]=4 566 B10R1.444 CC1(C)CC(=O)NC1CN Amb31252160 [1,0,1,0,0,0|2,0,0]=4 567 B10R1.444 CC1(C)CC(=O)NC1CO Amb27188929 [1,0,1,0,0,0|2,0,0]=4 568 B10R1.444 CC1(C)CC(=O)OC1CBr Amb27794793 [1,0,1,0,0,0|2,0,0]=4 569 B10R1.444 CC1(C)CC(=O)OC1CI Amb33309472 [1,0,1,0,0,0|2,0,0]=4 570 B10R1.444 CC1(C)CC(=O)OC1CN Amb31156384 [1,0,1,0,0,0|2,0,0]=4 571 B10R1.444 CC1(C)CC(=O)OC1CN Amb33494308 [1,0,1,0,0,0|2,0,0]=4 572 B10R1.444 CC1(C)CC(=O)OC1CO Amb4018992 [1,0,1,0,0,0|2,0,0]=4 573 B10R1.444 CC1(C)NC(=O)CC1CN Amb33483622 [1,0,1,0,0,0|2,0,0]=4 574 B10R1.444 CC1(C)NC(=O)CC1CO Amb27782126 [1,0,1,0,0,0|2,0,0]=4 575 B10R1.444 CC1(C)OC(=O)CC1CO Amb27763871 [1,0,1,0,0,0|2,0,0]=4 576 B10R1.444 CCC1CC(=O)CC1(C)C Amb27861292 [1,0,1,0,0,0|0,0,0]=2 577 B10R1.444 CCC1CC(=O)NC1(C)C Amb28050911 [1,0,1,0,0,0|1,0,0]=3 578 B10R1.444 CCC1NC(=O)CC1(C)O Amb28385665 [1,0,1,0,0,0|2,0,0]=4 579 B10R1.444 CCC1OC(=O)NC1(C)C Amb28072937 [1,0,1,0,0,0|2,0,0]=4 580 B10R1.444 CC[C@@H]1NC(=O)C[C@]1(C)O Amb27440838 [1,0,1,0,0,0|2,0,0]=4 581 B10R1.444 CC[C@H]1CC(=O)CC1(C)C Amb27434279 [1,0,1,0,0,0|0,0,0]=2 582 B10R1.444 CC[C@H]1OC(=O)NC1(C)C Amb27977045 [1,0,1,0,0,0|2,0,0]=4 583 B10R1.471 CC1(C)CNC(=O)C1(C)C Amb22524667 [1,0,1,0,0,0|1,0,0]=3 584 B10R1.471 CC1(C)OOC(=O)C1(C)C Amb2389753 [1,0,1,0,0,0|2,0,0]=4 585 B10R1.471 CC1(C)[C@H](N)CC[C@]1(C)N Amb5751248 [1,0,1,0,0,0|2,0,0]=4 586 B10R1.471 CC1(O)CCC(O)C1(C)C Amb27982806 [1,0,1,0,0,0|1,0,1]=4 587 B10R1.471 CC1CCC(C)(Br)C1(C)C Amb27237333 [1,0,1,0,0,0|1,0,0]=3 588 B10R1.471 CC1CCC(C)(N)C1(C)C Amb26328510 [1,0,1,0,0,0|1,0,0]=3 589 B10R1.471 C[C@@H]1CCC(C)(C)C1(C)C Amb28288071 [1,0,1,0,0,0|0,0,1]=3 590 B10R1.471 C[C@@H]1CC[C@](C)(N)C1(C)C Amb35672433 [1,0,1,0,0,0|1,0,0]=3 591 B10R1.471 C[C@H]1CC[C@@](C)(N)C1(C)C Amb23452531 [1,0,1,0,0,0|1,0,0]=3 592 B10R1.61 C=C1CCCCC1C(C)O Amb28043697 [1,0,1,0,0,0|2,0,0]=4 593 B10R1.61 CC(=O)C1CCCCC1=O Amb422729 [1,0,1,0,0,0|1,0,1]=4 594 B10R1.61 CC(C)=C1CCCCC1=O Amb27966736 [1,0,1,0,0,0|0,0,2]=4 595 B10R1.61 CC(C)C1CCC=CC1=O Amb17593509 [1,0,1,0,0,0|0,0,2]=4 596 B10R1.61 CC(C)C1CCCCC1=O Amb20241147 [1,0,1,0,0,0|0,0,0]=2 597 B10R1.61 CC(C)C1CCCCC1N Amb18946313 [1,0,1,0,0,0|1,0,1]=4 598 B10R1.61 CC(C)C1CCCCC1O Amb33530995 [1,0,1,0,0,0|0,0,2]=4 599 B10R1.61 CC(C)C1CCCCC1S Amb27217833 [1,0,1,0,0,0|0,1,1]=4 600 B10R1.61 CC(C)C1CCCNC1=O Amb27865211 [1,0,1,0,0,0|1,0,0]=3 601 B10R1.61 CC(C)C1CNCCC1=O Amb18202676 [1,0,1,0,0,0|1,0,0]=3 602 B10R1.61 CC(C)C1CNCCC1=O Amb31307715 [1,0,1,0,0,0|1,0,0]=3 603 B10R1.61 CC(C)C1COCCC1=O Amb25865083 [1,0,1,0,0,0|1,0,0]=3 604 B10R1.61 CC(C)C1CSCCC1=O Amb27164561 [1,0,1,0,0,0|1,0,0]=3 605 B10R1.61 CC(C)C1NCCNC1=O Amb10607752 [1,0,1,0,0,0|2,0,0]=4 606 B10R1.61 CC(C)C1OCCCC1=O Amb28126811 [1,0,1,0,0,0|1,0,0]=3 607 B10R1.61 CC(C)C1OCCOC1=O Amb33484059 [1,0,1,0,0,0|2,0,0]=4 608 B10R1.61 CC(C)N1CCCCC1=N Amb27222079 [1,0,1,0,0,0|2,0,0]=4 609 B10R1.61 CC(C)N1CCCNC1=O Amb27973180 [1,0,1,0,0,0|2,0,0]=4 610 B10R1.61 CC(C)N1CCCOC1=O Amb27755994 [1,0,1,0,0,0|2,0,0]=4 611 B10R1.61 CC(C)N1CCNCC1=O Amb22728333 [1,0,1,0,0,0|2,0,0]=4 612 B10R1.61 CC(C)N1CCNCC1=O Amb33544967 [1,0,1,0,0,0|2,0,0]=4 613 B10R1.61 CC(C)[C@@H]1CCCCC1=O Amb27802767 [1,0,1,0,0,0|0,0,0]=2 614 B10R1.61 CC(C)[C@@H]1CCCC[C@@H]1N Amb27447249 [1,0,1,0,0,0|1,0,1]=4 615 B10R1.61 CC(C)[C@@H]1CCCC[C@H]1N Amb27461156 [1,0,1,0,0,0|1,0,1]=4 616 B10R1.61 CC(C)[C@@H]1CCCC[C@H]1O Amb27664233 [1,0,1,0,0,0|0,0,2]=4 617 B10R1.61 CC(C)[C@H]1CCC=CC1=O Amb28461218 [1,0,1,0,0,0|0,0,2]=4 618 B10R1.61 CC(C)[C@H]1CCCC[C@@H]1O Amb17779717 [1,0,1,0,0,0|0,0,2]=4 619 B10R1.61 CC(C)[C@H]1CCCC[C@H]1O Amb28053556 [1,0,1,0,0,0|0,0,2]=4 620 B10R1.61 CC(C)[C@H]1NCCNC1=O Amb27788281 [1,0,1,0,0,0|2,0,0]=4 621 B10R1.61 CN(C)C1CCCCC1=O Amb2616745 [1,0,1,0,0,0|1,0,0]=3 622 B10R1.61 CN(C)C1COCCC1=O Amb26353698 [1,0,1,0,0,0|2,0,0]=4 623 B10R1.61 CS(=O)C1CCCCC1=O Amb27753893 [1,0,1,0,0,0|2,0,0]=4 624 B10R1.61 C[C@@H](O)[C@@H]1CCCCC1=O Amb27219086 [1,0,1,0,0,0|1,0,0]=3 625 B10R1.61 O=C1CCCCC1C(F)F Amb24572424 [1,0,1,0,0,0|2,0,0]=4 626 B10R1.230 C#CC1(C)CCCCC1=O Amb26624857 [1,0,1,0,0,0|0,0,2]=4 627 B10R1.230 C=CC1(C)CCCCC1=O Amb27261477 [1,0,1,0,0,0|0,0,2]=4 628 B10R1.230 CC1(C#N)CCCCC1=O Amb22755387 [1,0,1,0,0,0|1,0,1]=4 629 B10R1.230 CC1(CN)CCCNC1=O Amb25127604 [1,0,1,0,0,0|2,0,0]=4 630 B10R1.230 CC1(CO)CCCCC1=O Amb22365292 [1,0,1,0,0,0|1,0,0]=3 631 B10R1.230 CC1(CO)CCCNC1=O Amb28040741 [1,0,1,0,0,0|2,0,0]=4 632 B10R1.230 CC1(NO)CCCCC1=O Amb577960 [1,0,1,0,0,0|2,0,0]=4 633 B10R1.230 CC1([NH2+]O)CCCCC1=O Amb4237312 [1,0,1,0,0,0|2,0,0]=4 634 B10R1.230 CCC1(C)CCCCC1=O Amb27614469 [1,0,1,0,0,0|0,0,0]=2 635 B10R1.230 CCC1(C)CCCNC1=O Amb24466397 [1,0,1,0,0,0|1,0,0]=3 636 B10R1.230 CCC1(C)CCNCC1=O Amb27843668 [1,0,1,0,0,0|1,0,0]=3 637 B10R1.230 CCC1(C)COCCC1=O Amb33338742 [1,0,1,0,0,0|1,0,0]=3 638 B10R1.230 CCC1(C)NCCNC1=O Amb9833689 [1,0,1,0,0,0|2,0,0]=4 639 B10R1.230 CCC1(C)NCCOC1=O Amb5781649 [1,0,1,0,0,0|2,0,0]=4 640 B10R1.230 CNC1(C)CCCCC1=O Amb18643762 [1,0,1,0,0,0|1,0,0]=3 641 B10R1.230 CSC1(C)CCCCC1=O Amb27945530 [1,0,1,0,0,0|1,0,0]=3 642 B10R1.230 O=C1CCCCC1(O)CBr Amb27759295 [1,0,1,0,0,0|2,0,0]=4 643 B10R1.230 O=C1CCCC[C@]1(F)CO Amb25794578 [1,0,1,0,0,0|2,0,0]=4 644 B10R1.230 O=C1CCCC[C@]1(O)CO Amb28074748 [1,0,1,0,0,0|2,0,0]=4 645 B10R1.363 CC(C)C1(C)CCCCN1 Amb28318104 [1,0,1,0,0,0|1,0,0]=3 646 B10R1.363 CC(C)C1(C)CCCNC1 Amb27847828 [1,0,1,0,0,0|1,0,1]=4 647 B10R1.363 CC(C)C1(C)CCNCC1 Amb27640899 [1,0,1,0,0,0|1,0,1]=4 648 B10R1.363 CC(C)C1(C)CCNCC1 Amb33553051 [1,0,1,0,0,0|1,0,1]=4 649 B10R1.363 CC(C)C1(C)COCCN1 Amb25953634 [1,0,1,0,0,0|2,0,0]=4 650 B10R1.363 CC(C)C1(N)CCCCC1 Amb9676114 [1,0,1,0,0,0|1,0,1]=4 651 B10R1.363 CC(C)C1(O)CCCCC1 Amb9675858 [1,0,1,0,0,0|1,0,1]=4 652 B10R1.363 CC(C)[C@@]1(C)NCCCO1 Amb27881713 [1,0,1,0,0,0|2,0,0]=4 653 B10R1.363 CC(N)C1(C)CCCCC1 Amb25966508 [1,0,1,0,0,0|1,0,1]=4 654 B10R1.363 CC(O)C1(C)CCCCN1 Amb35586964 [1,0,1,0,0,0|2,0,0]=4 655 B10R1.363 C[C@@H](N)C1(C)CCCCC1 Amb27142687 [1,0,1,0,0,0|1,0,1]=4 656 B10R1.363 C[C@@H](O)C1(C)CCCCC1 Amb25042143 [1,0,1,0,0,0|1,0,1]=4 657 B10R1.363 C[C@@H](O)C1(C)CCCCO1 Amb27837806 [1,0,1,0,0,0|2,0,0]=4 658 B10R1.363 C[C@H](N)C1(C)CCCCC1 Amb26847321 [1,0,1,0,0,0|1,0,1]=4 659 B10R1.363 C[C@H](N)C1(C)CCCCO1 Amb28194332 [1,0,1,0,0,0|2,0,0]=4 660 B10R1.363 C[C@H](O)C1(C)CCCCC1 Amb24415006 [1,0,1,0,0,0|1,0,1]=4 661 B10R1.43 CCC1C(=O)C=CC1(C)C Amb27945527 [1,0,1,0,0,0|0,0,2]=4 662 B10R1.43 CCN1C(=O)CNC1(C)C Amb27456198 [1,0,1,0,0,0|2,0,0]=4 663 B10R1.43 COC1C(=O)OCC1(C)C Amb27650190 [1,0,1,0,0,0|2,0,0]=4 664 B10R1.43 CON1C(=O)CCC1(C)C Amb27240761 [1,0,1,0,0,0|2,0,0]=4 665 B10R1.479 C=CC1(C)CCCC1(C)O Amb32944568 [1,0,1,0,0,0|1,0,1]=4 666 B10R1.479 C=CC1(O)CCCC1(C)C Amb27837781 [1,0,1,0,0,0|1,0,1]=4 667 B10R1.479 CC1(C)C=CC[C@@]1(C)C=O Amb27452689 [1,0,1,0,0,0|0,0,2]=4 668 B10R1.479 CC1(C)CC=CC1(C)CO Amb28398982 [1,0,1,0,0,0|1,0,1]=4 669 B10R1.479 CC1(C)CCCC1(C)CO Amb28190029 [1,0,1,0,0,0|0,0,2]=4 670 B10R1.479 CC1(C)CCC[C@@]1(C)C=O Amb26493166 [1,0,1,0,0,0|0,0,0]=2 671 B10R1.479 CC1(C=O)CCOC1(C)C Amb32943541 [1,0,1,0,0,0|1,0,0]=3 672 B10R1.479 CCC1(C)CCCC1(C)O Amb24446626 [1,0,1,0,0,0|1,0,1]=4 673 B10R1.479 CNC1(C)CCCC1(C)O Amb27229078 [1,0,1,0,0,0|2,0,0]=4 674 B10R1.479 CSC1(C)CCCC1(C)O Amb27232188 [1,0,1,0,0,0|2,0,0]=4 675 B10R1.520 C[C@@]1(CO)C(=O)CC[C@@H]1O Amb27855034 [1,0,1,0,0,0|2,0,0]=4 676 B10R1.236 CC1CCC(C)(C=O)C1=O Amb25311371 [1,0,1,0,0,0|1,0,1]=4 677 B10R1.236 C[C@@H]1CC[C@](C)(C=O)[C@@H]1O Amb28287662 [1,0,1,0,0,0|1,0,0]=3 678 B10R1.236 C[C@H]1CC[C@](C)(C=O)[C@@H]1O Amb27215385 [1,0,1,0,0,0|1,0,0]=3 679 B10R1.128 C=C(C)[C@H]1CNCC1(C)C Amb27253633 [1,0,1,0,0,0|2,0,0]=4 680 B10R1.128 CC(=O)C1CCOC1(C)O Amb27802699 [1,0,1,0,0,0|2,0,0]=4 681 B10R1.128 CC(=O)C1CCSC1(C)C Amb32732495 [1,0,1,0,0,0|1,0,0]=3 682 B10R1.128 CC(=O)C1CNCC1(C)C Amb33307971 [1,0,1,0,0,0|1,0,0]=3 683 B10R1.128 CC(=O)C1N=NCC1(C)C Amb27945523 [1,0,1,0,0,0|2,0,0]=4 684 B10R1.128 CC(=O)N1CCCC1(C)C Amb27761987 [1,0,1,0,0,0|1,0,0]=3 685 B10R1.128 CC(N)C1CCCC1(C)C Amb27837780 [1,0,1,0,0,0|1,0,1]=4 686 B10R1.128 CC1(C)CCCC1C(=O)O Amb33544581 [1,0,1,0,0,0|1,0,0]=3 687 B10R1.128 CC1(C)CCCC1C(N)=O Amb27765000 [1,0,1,0,0,0|1,0,0]=3 688 B10R1.128 CC1(C)CCCN1C(=O)Cl Amb26964163 [1,0,1,0,0,0|2,0,0]=4 689 B10R1.128 CC1(C)CCNC1C(=O)O Amb23589281 [1,0,1,0,0,0|2,0,0]=4 690 B10R1.128 CC1(C)CCNC1C(=O)O Amb28555537 [1,0,1,0,0,0|2,0,0]=4 691 B10R1.128 CC1(C)CCNC1C(N)=O Amb27250633 [1,0,1,0,0,0|2,0,0]=4 692 B10R1.128 CC1(C)CCN[C@@H]1C(=O)O Amb25147411 [1,0,1,0,0,0|2,0,0]=4 693 B10R1.128 CC1(C)CCN[C@@H]1C(N)=O Amb27165633 [1,0,1,0,0,0|2,0,0]=4 694 B10R1.128 CC1(C)CNCC1C(=O)O Amb19957714 [1,0,1,0,0,0|2,0,0]=4 695 B10R1.128 CC1(C)CNCC1C(=O)O Amb2696099 [1,0,1,0,0,0|2,0,0]=4 696 B10R1.128 CC1(C)CNC[C@@H]1C(=O)O Amb22748069 [1,0,1,0,0,0|2,0,0]=4 697 B10R1.128 CC1(C)CNC[C@H]1C(=O)O Amb24691530 [1,0,1,0,0,0|2,0,0]=4 698 B10R1.128 CC1(C)NCCC1C(=O)O Amb23589282 [1,0,1,0,0,0|2,0,0]=4 699 B10R1.128 CC1(C)NCCC1C(=O)O Amb33804151 [1,0,1,0,0,0|2,0,0]=4 700 B10R1.128 CC1(C)NCCC1C(N)=O Amb27442041 [1,0,1,0,0,0|2,0,0]=4 701 B10R1.128 CC1(C)OCCC1C(=O)O Amb27413536 [1,0,1,0,0,0|2,0,0]=4 702 B10R1.128 CC1(C)SCCC1C(=O)O Amb18199358 [1,0,1,0,0,0|2,0,0]=4 703 B10R1.128 CC1(N)CCCC1C(=O)O Amb27668891 [1,0,1,0,0,0|2,0,0]=4 704 B10R1.128 CC1(O)CCCC1C(=O)O Amb27617025 [1,0,1,0,0,0|2,0,0]=4 705 B10R1.128 C[C@@]1(N)CCC[C@@H]1C(=O)O Amb1993790 [1,0,1,0,0,0|2,0,0]=4 706 B10R1.128 C[C@@]1(N)CCC[C@@H]1C(=O)O Amb1993898 [1,0,1,0,0,0|2,0,0]=4 707 B10R1.128 C[C@]1(N)CCC[C@H]1C(=O)O Amb26926411 [1,0,1,0,0,0|2,0,0]=4 708 B10R1.128 C[N+]1(C)CCCC1C(=O)[O-] Amb10845209 [1,0,1,0,0,0|2,0,0]=4 709 B10R1.128 C[N+]1(C)CCCC1C(=O)[O-] Amb8629111 [1,0,1,0,0,0|2,0,0]=4 710 B10R1.128 C[N+]1(C)CCC[C@@H]1C(=O)[O-] Amb18511510 [1,0,1,0,0,0|2,0,0]=4 711 B10R1.128 C[N+]1(C)CCC[C@@H]1C(=O)[O-] Amb24288689 [1,0,1,0,0,0|2,0,0]=4 712 B10R1.128 C[N+]1(C)CCC[C@H]1C(=O)[O-] Amb16182640 [1,0,1,0,0,0|2,0,0]=4 713 B10R1.128 C[N+]1(C)CCC[C@H]1C(=O)[O-] Amb2709443 [1,0,1,0,0,0|2,0,0]=4 714 B10R1.291 CC(=O)C1(C)CCCC1N Amb27859716 [1,0,1,0,0,0|1,0,0]=3 715 B10R1.291 CC(=O)C1(C)CNCC1C Amb33307609 [1,0,1,0,0,0|1,0,0]=3 716 B10R1.291 CC(=O)C1(C)COCC1N Amb24586865 [1,0,1,0,0,0|2,0,0]=4 717 B10R1.291 CC(=O)[C@]1(C)CNC[C@H]1C Amb33307616 [1,0,1,0,0,0|1,0,0]=3 718 B10R1.291 CC1(C(=O)O)CCCC1N Amb18643994 [1,0,1,0,0,0|2,0,0]=4 719 B10R1.291 CC1(C(=O)O)CCCC1N Amb32693462 [1,0,1,0,0,0|2,0,0]=4 720 B10R1.291 CC1(C(=O)O)CCCC1O Amb18644145 [1,0,1,0,0,0|2,0,0]=4 721 B10R1.291 CC1CCCC1(C)C(=O)O Amb33545081 [1,0,1,0,0,0|1,0,0]=3 722 B10R1.291 CC1CCCC1(C)C(N)=O Amb26588946 [1,0,1,0,0,0|1,0,0]=3 723 B10R1.291 CC1CCCC1(N)C(=O)O Amb2695736 [1,0,1,0,0,0|2,0,0]=4 724 B10R1.291 CC1CCCC1(N)C(=O)O Amb31156300 [1,0,1,0,0,0|2,0,0]=4 725 B10R1.291 CC1CCCC1(N)C(N)=O Amb33547798 [1,0,1,0,0,0|2,0,0]=4 726 B10R1.291 CC1OCCC1(C)C(=O)O Amb26591045 [1,0,1,0,0,0|2,0,0]=4 727 B10R1.291 CC1OCCC1(C)C(N)=O Amb27757001 [1,0,1,0,0,0|2,0,0]=4 728 B10R1.291 CN1CCC[C@@]1(C)C(=O)O Amb25068442 [1,0,1,0,0,0|2,0,0]=4 729 B10R1.291 CN1CCC[C@]1(C)C(=O)O Amb26930260 [1,0,1,0,0,0|2,0,0]=4 730 B10R1.291 C[C@@H]1CCC[C@@]1(N)C(=O)O Amb26580738 [1,0,1,0,0,0|2,0,0]=4 731 B10R1.291 C[C@@H]1CCC[C@@]1(N)C(N)=O Amb27420226 [1,0,1,0,0,0|2,0,0]=4 732 B10R1.291 C[C@@H]1CCC[C@]1(C)C(N)=O Amb27261999 [1,0,1,0,0,0|1,0,0]=3 733 B10R1.291 C[C@@H]1CCC[C@]1(N)C(=O)O Amb24562232 [1,0,1,0,0,0|2,0,0]=4 734 B10R1.291 C[C@@H]1CNC[C@@]1(C)C(=O)O Amb28287365 [1,0,1,0,0,0|2,0,0]=4 735 B10R1.291 C[C@@H]1CNC[C@@]1(C)C(=O)O Amb31156310 [1,0,1,0,0,0|2,0,0]=4 736 B10R1.291 C[C@@]1(C(=O)O)CCC[C@@H]1N Amb22504290 [1,0,1,0,0,0|2,0,0]=4 737 B10R1.291 C[C@H]1CCC[C@@]1(N)C(=O)O Amb27786907 [1,0,1,0,0,0|2,0,0]=4 738 B10R1.291 C[C@H]1CCC[C@@]1(N)C(N)=O Amb27960295 [1,0,1,0,0,0|2,0,0]=4 739 B10R1.291 C[C@H]1CCC[C@]1(N)C(N)=O Amb27420225 [1,0,1,0,0,0|2,0,0]=4 740 B10R1.291 C[C@]1(C(=O)O)CCC[C@@H]1N Amb24580091 [1,0,1,0,0,0|2,0,0]=4 741 B10R1.291 C[C@]1(C(=O)O)CCC[C@@H]1O Amb28058141 [1,0,1,0,0,0|2,0,0]=4 742 B10R1.291 C[C@]1(C(=O)O)CCC[C@H]1N Amb27767841 [1,0,1,0,0,0|2,0,0]=4 743 B10R2.20 CN1C2CCC1C(=O)C2 Amb24732607 [2,0,0,0,0,0|1,0,0]=3 744 B10R2.20 C[C@@H]1[C@H]2C=C[C@@H]1C(=O)C2 Amb28202195 [2,0,0,0,0,0|0,0,2]=4 745 B10R2.20 C[C@@H]1[C@H]2CC[C@@H]1[C@@H](O)C2 Amb28428420 [2,0,0,0,0,0|0,0,2]=4 746 B10R2.20 C[C@@H]1[C@H]2CC[C@@H]1[C@H](O)C2 Amb27978232 [2,0,0,0,0,0|0,0,2]=4 747 B10R2.20 C[C@H]1[C@H]2C=C[C@@H]1CC2=O Amb27427690 [2,0,0,0,0,0|0,0,2]=4 748 B10R2.20 C[C@H]1[C@H]2CC[C@@H]1[C@@H](O)C2 Amb28198890 [2,0,0,0,0,0|0,0,2]=4 749 B10R2.20 O=C1CC2CCC1C2=O Amb27838650 [2,0,0,0,0,0|1,0,1]=4 750 B10R2.20 O=C1CC2CCC1C2F Amb27232099 [2,0,0,0,0,0|1,0,0]=3 751 B10R2.20 O=C1C[C@@H]2CC[C@H]1[C@H]2F Amb27198509 [2,0,0,0,0,0|1,0,0]=3 752 B10R2.20 O=C1C[C@H]2CC[C@@H]1[C@H]2Br Amb27484047 [2,0,0,0,0,0|1,0,0]=3 753 B10R2.19 CC12CCC(CC1=O)O2 Amb27838720 [2,0,0,0,0,0|1,0,0]=3 754 B10R2.19 CC12CCC(CC1Cl)C2 Amb27974197 [2,0,0,0,0,0|1,0,1]=4 755 B10R2.19 CC12CCC(CC1N)C2 Amb24561428 [2,0,0,0,0,0|1,0,1]=4 756 B10R2.19 CC12CCN(CC1=O)C2 Amb25145956 [2,0,0,0,0,0|1,0,0]=3 757 B10R2.19 CC12CCN(CC1=O)C2 Amb32679844 [2,0,0,0,0,0|1,0,0]=3 758 B10R2.19 CC12CC[C@@H](C[C@@H]1O)C2 Amb27853127 [2,0,0,0,0,0|0,0,2]=4 759 B10R2.19 CC12CC[C@@H](C[C@H]1O)C2 Amb27198484 [2,0,0,0,0,0|0,0,2]=4 760 B10R2.19 C[C@@]12CC[C@@H](C[C@H]1N)C2 Amb28346423 [2,0,0,0,0,0|1,0,1]=4 761 B10R2.19 C[C@@]12CC[C@@H](C[C@H]1O)C2 Amb27197472 [2,0,0,0,0,0|0,0,2]=4 762 B10R2.19 C[C@@]12CC[C@H](CC1=O)C2 Amb27800039 [2,0,0,0,0,0|0,0,0]=2 763 B10R2.19 C[C@@]12CC[C@H](C[C@H]1O)C2 Amb28139727 [2,0,0,0,0,0|0,0,2]=4 764 B10R2.19 C[C@]12C=C[C@H](CC1=O)C2 Amb27267054 [2,0,0,0,0,0|0,0,2]=4 765 B10R2.19 C[C@]12CC[C@H](C[C@@H]1Cl)C2 Amb27966807 [2,0,0,0,0,0|1,0,1]=4 766 B10R2.19 C[C@]12CC[C@H](C[C@@H]1N)C2 Amb25912027 [2,0,0,0,0,0|1,0,1]=4 767 B10R2.19 C[C@]12CC[C@H](C[C@H]1Cl)C2 Amb27488935 [2,0,0,0,0,0|1,0,1]=4 768 B10R2.19 C[C@]12CC[C@H](C[C@H]1N)C2 Amb27634382 [2,0,0,0,0,0|1,0,1]=4 769 B10R2.19 NC12CCC(CC1=O)C2 Amb23580751 [2,0,0,0,0,0|1,0,0]=3 770 B10R2.19 N[C@]12CC[C@H](CC1=O)C2 Amb27795818 [2,0,0,0,0,0|1,0,0]=3 771 B10R2.19 O=C1C[C@H]2CC[C@]1(Cl)C2 Amb28129673 [2,0,0,0,0,0|1,0,0]=3 772 B10R2.19 O=C1C[C@H]2CC[C@]1(O)C2 Amb27427692 [2,0,0,0,0,0|1,0,0]=3 773 B10R2.276 CC12CCC(CC1)C2N Amb18642342 [2,0,0,0,0,0|1,0,1]=4 774 B10R2.276 CC12CCC(CC1)C2O Amb27472522 [2,0,0,0,0,0|1,0,1]=4 775 B12R1.23 CC(C)(C)C1CCC(O)C(=O)C1 Amb28381230 [0,1,1,0,0,0|1,0,0]=3 776 B12R1.23 CC(C)(C)[C@@H]1CC[C@@H](Cl)C(=O)C1 Amb27489060 [0,1,1,0,0,0|1,0,0]=3 777 B12R1.23 CC(C)(C)[C@H]1CCC(Cl)C(=O)C1 Amb28325689 [0,1,1,0,0,0|1,0,0]=3 778 B12R1.23 CC(C)(C)[C@H]1CC[C@@H](Cl)C(=O)C1 Amb28057558 [0,1,1,0,0,0|1,0,0]=3 779 B12R1.23 CC1=C(C)CC(C(C)(C)O)CC1 Amb27961780 [0,1,1,0,0,0|1,0,1]=4 780 B12R1.23 CC1=CCC(C(C)(C)C)CC1=O Amb27802921 [0,1,1,0,0,0|0,0,2]=4 781 B12R1.23 CC1=CCC(C(C)(C)O)CC1=O Amb25718379 [0,1,1,0,0,0|0,0,2]=4 782 B12R1.23 CC1=CC[C@@H](C(C)(C)O)CC1=O Amb27778048 [0,1,1,0,0,0|0,0,2]=4 783 B12R1.23 CC1CC=C(C(C)(C)O)CC1=O Amb27212544 [0,1,1,0,0,0|0,0,2]=4 784 B12R1.23 CC1CCC(C(C)(C)Br)CC1C Amb33347694 [0,1,1,0,0,0|1,0,1]=4 785 B12R1.23 CC1CCC(C(C)(C)Cl)CC1C Amb33347671 [0,1,1,0,0,0|1,0,1]=4 786 B12R1.23 CC1CCC(C(C)(C)Cl)CC1N Amb28122930 [0,1,1,0,0,0|1,0,1]=4 787 B12R1.23 CC1CCC(C(C)(C)N)CC1C Amb25760246 [0,1,1,0,0,0|1,0,1]=4 788 B12R1.23 CC1CCC(C(C)(C)O)=CC1=O Amb27267190 [0,1,1,0,0,0|0,0,2]=4 789 B12R1.23 CC1CCC(C(C)(C)O)CC1O Amb2232672 [0,1,1,0,0,0|0,0,2]=4 790 B12R1.23 CC1CCN(C(C)(C)C)CC1=O Amb1017307 [0,1,1,0,0,0|1,0,0]=3 791 B12R1.23 CC1CCN(C(C)(C)C)CC1=O Amb22283798 [0,1,1,0,0,0|1,0,0]=3 792 B12R1.23 CC1CC[C@H](C(C)(C)C)CC1=O Amb28122385 [0,1,1,0,0,0|0,0,0]=2 793 B12R1.23 CC1CNC(C(C)(C)C)CS1=O Amb27798170 [0,1,1,0,0,0|2,0,0]=4 794 B12R1.23 C[C@@H]1CC[C@@H](C(C)(C)C)C[C@@H]1O Amb28077876 [0,1,1,0,0,0|0,0,2]=4 795 B12R1.23 C[C@@H]1CC[C@@H](C(C)(C)O)C[C@@H]1O Amb27253035 [0,1,1,0,0,0|0,0,2]=4 796 B12R1.23 C[C@@H]1CC[C@H](C(C)(C)C)C[C@@H]1O Amb27970576 [0,1,1,0,0,0|0,0,2]=4 797 B12R1.23 C[C@@H]1CC[C@H](C(C)(C)O)C[C@H]1O Amb27218529 [0,1,1,0,0,0|0,0,2]=4 798 B12R1.23 C[C@H]1CC[C@@H](C(C)(C)C)C[C@@H]1O Amb27206005 [0,1,1,0,0,0|0,0,2]=4 799 B12R1.23 C[C@H]1CC[C@H](C(C)(C)C)C[C@H]1O Amb27213843 [0,1,1,0,0,0|0,0,2]=4 800 B12R1.23 C[C@H]1CC[C@H](C(C)(C)O)C[C@@H]1O Amb27428299 [0,1,1,0,0,0|0,0,2]=4 801 B12R1.48 CC(C)C1CCC(CN)C(C)C1 Amb28456218 [0,1,1,0,0,0|1,0,1]=4 802 B12R1.48 CCC1NCC(C(C)C)NC1=O Amb27481635 [0,1,1,0,0,0|2,0,0]=4 803 B12R1.48 CCN1CCN(C(C)C)CC1=O Amb28064909 [0,1,1,0,0,0|2,0,0]=4 804 B12R1.48 CC[C@@H]1NC[C@@H](C(C)C)NC1=O Amb27779148 [0,1,1,0,0,0|2,0,0]=4 805 B12R1.48 CC[C@H]1NC[C@@H](C(C)C)NC1=O Amb27619720 [0,1,1,0,0,0|2,0,0]=4 806 B12R1.56 CC(C)C1CCC(C)C(CN)C1 Amb27975395 [0,1,1,0,0,0|1,0,1]=4 807 B12R1.56 CC(C)[C@H]1C=C(CCl)[C@H](C)CC1 Amb28458366 [0,1,1,0,0,0|1,0,1]=4 808 B12R1.56 CC1CCC(C(C)C)C=C1C=O Amb28434633 [0,1,1,0,0,0|0,0,1]=3 809 B12R1.56 CC1CCC(C(C)C)C=C1CO Amb28244318 [0,1,1,0,0,0|0,0,2]=4 810 B12R1.56 CC1CC[C@@H](C(C)C)CC1CO Amb28453518 [0,1,1,0,0,0|0,0,2]=4 811 B12R1.232 C=C(C)C1CC(=O)C(C)CC1O Amb24646678 [0,1,1,0,0,0|0,0,2]=4 812 B12R1.232 CC(C)N1CC(=O)N(C)CC1C Amb28188142 [0,1,1,0,0,0|2,0,0]=4 813 B12R1.232 CC(C)[C@H]1C[C@@H](O)[C@H](C)C[C@@H]1O Amb28053689 [0,1,1,0,0,0|0,0,2]=4 814 B12R1.232 CC(C)[C@H]1C[C@@H](O)[C@H](C)C[C@H]1O Amb27980481 [0,1,1,0,0,0|0,0,2]=4 815 B12R1.232 CC(C)[C@H]1C[C@H](O)[C@@H](C)C[C@@H]1O Amb28369957 [0,1,1,0,0,0|0,0,2]=4 816 B12R1.232 CC1=C[C@@H](O)[C@H](C(C)C)CC1=O Amb28202355 [0,1,1,0,0,0|0,0,2]=4 817 B12R1.232 CC1=C[C@H](O)[C@H](C(C)C)CC1=O Amb25272969 [0,1,1,0,0,0|0,0,2]=4 818 B12R1.232 CC1CC(=O)C(C(C)C)CC1=O Amb26984789 [0,1,1,0,0,0|0,0,1]=3 819 B12R1.367 C=C[C@@H](C)[C@H]1CCC(C)C(=O)C1 Amb28131980 [0,1,1,0,0,0|0,0,1]=3 820 B12R1.367 CC(CO)[C@@H]1CC[C@@H](C)[C@H](O)C1 Amb27665242 [0,1,1,0,0,0|0,0,2]=4 821 B12R1.367 CC(CO)[C@@H]1CC[C@H](C)[C@H](O)C1 Amb28435673 [0,1,1,0,0,0|0,0,2]=4 822 B12R1.367 CC(CO)[C@H]1CC[C@H](C)C(=O)C1 Amb28321965 [0,1,1,0,0,0|0,0,0]=2 823 B12R1.367 CC1CCC(C(C)C=O)CC1=O Amb27827359 [0,1,1,0,0,0|0,0,1]=3 824 B12R1.367 CC1CCC(C(C)CN)CC1C Amb28248392 [0,1,1,0,0,0|1,0,1]=4 825 B12R1.367 CC1CCC(C(C)CS)CC1S Amb4005669 [0,1,1,0,0,0|0,1,1]=4 826 B12R1.367 CCC(C)[C@H]1CO[C@H](C)C(=O)N1 Amb27469833 [0,1,1,0,0,0|2,0,0]=4 827 B12R1.367 CNC(C)C1CCC(C)C(C)C1 Amb27749875 [0,1,1,0,0,0|1,0,1]=4 828 B12R1.367 COC(C)C1CCC(C)C(=O)C1 Amb28461138 [0,1,1,0,0,0|0,0,0]=2 829 B12R1.367 C[C@H](CO)[C@@H]1CC[C@@H](C)[C@@H](O)C1 Amb27472672 [0,1,1,0,0,0|0,0,2]=4 830 B12R1.367 C[C@H]1CC[C@H]([C@H](C)CO)C[C@@H]1O Amb28320001 [0,1,1,0,0,0|0,0,2]=4 831 B12R1.893 C=C1C(=O)C(C(C)C)CCC1C Amb17777878 [0,1,1,0,0,0|1,0,1]=4 832 B12R1.893 C=C1C(=O)[C@@H](C)CC[C@@H]1C(C)C Amb28052266 [0,1,1,0,0,0|0,0,1]=3 833 B12R1.893 C=C1[C@@H](O)[C@H](C(C)C)CC[C@H]1C Amb27422230 [0,1,1,0,0,0|1,0,0]=3 834 B12R1.893 CC(C)C1=C(O)C(=O)C(C)CC1 Amb27878495 [0,1,1,0,0,0|0,0,2]=4 835 B12R1.893 CC(C)C1CCC(C)C(C)C1O Amb27587622 [0,1,1,0,0,0|1,0,1]=4 836 B12R1.893 CC(C)C1CCC(C)[C@@H](O)[C@H]1O Amb27631949 [0,1,1,0,0,0|0,0,2]=4 837 B12R1.893 CC(C)C1CCC(C)[C@H](O)[C@H]1O Amb27651826 [0,1,1,0,0,0|0,0,2]=4 838 B12R1.893 CC(C)[C@@H]1CC[C@@H](C)[C@H](O)[C@H]1O Amb25174923 [0,1,1,0,0,0|0,0,2]=4 839 B12R1.893 CC(C)[C@@H]1CN[C@H](C)C(=O)N1C Amb28429182 [0,1,1,0,0,0|2,0,0]=4 840 B12R1.893 CC(C)[C@H]1CC[C@@H](C)[C@@H](O)[C@H]1O Amb28053339 [0,1,1,0,0,0|0,0,2]=4 841 B12R1.893 CC(C)[C@H]1CC[C@H](C)C(O)C1O Amb27422245 [0,1,1,0,0,0|0,0,2]=4 842 B12R1.893 CC(C)[C@H]1CC[C@H](C)[C@@H](O)[C@@H]1O Amb27213867 [0,1,1,0,0,0|0,0,2]=4 843 B12R1.893 CC(C)[C@H]1CC[C@H](C)[C@@H](O)[C@H]1O Amb28198825 [0,1,1,0,0,0|0,0,2]=4 844 B12R1.893 CC1=CCC(C(C)C)C(O)C1=O Amb28070859 [0,1,1,0,0,0|0,0,2]=4 845 B12R1.893 CC1=CC[C@@H](C(C)C)[C@H](O)C1=O Amb27439846 [0,1,1,0,0,0|0,0,2]=4 846 B12R1.893 CC1CCC(C(C)C)C(=O)C1=O Amb4407478 [0,1,1,0,0,0|0,0,1]=3 847 B12R1.1005 C=C(C)C1CC(=O)C(C)C(O)C1 Amb28461148 [0,1,1,0,0,0|0,0,2]=4 848 B12R1.1005 C=C(C)[C@@H]1CC(=O)C(C)[C@@H](C)C1 Amb27440407 [0,1,1,0,0,0|0,0,2]=4 849 B12R1.1005 C=C(C)[C@H]1CC(=O)C(C)C(C)C1 Amb28253647 [0,1,1,0,0,0|0,0,2]=4 850 B12R1.1005 C=C(C)[C@H]1CC(=O)C(C)[C@H](C)C1 Amb27818167 [0,1,1,0,0,0|0,0,2]=4 851 B12R1.1005 C=C(C)[C@H]1CC(=O)[C@H](C)[C@H](O)C1 Amb25976157 [0,1,1,0,0,0|0,0,2]=4 852 B12R1.1005 CC(C)[C@@H]1C[C@H](O)[C@H](C)C(=O)O1 Amb28350305 [0,1,1,0,0,0|1,0,0]=3 853 B12R1.1005 CC1=C(C)C(=O)C[C@H](C(C)C)C1 Amb25299315 [0,1,1,0,0,0|0,0,2]=4 854 B12R1.1005 CC1CC(C(C)C)CC(=O)C1=O Amb27749817 [0,1,1,0,0,0|1,0,1]=4 855 B12R1.1274 C=C(C)C1CCC(C)(F)C(=O)C1 Amb27177516 [0,1,1,0,0,0|0,0,2]=4 856 B12R1.1274 CC(C)C1=CC(=O)C(C)(O)CC1 Amb28074724 [0,1,1,0,0,0|0,0,2]=4 857 B12R1.1274 CC(C)C1=CC(=O)[C@@](C)(O)CC1 Amb27614793 [0,1,1,0,0,0|0,0,2]=4 858 B12R1.1274 CC(C)C1C=CC(C)(C)C(=O)C1 Amb27178037 [0,1,1,0,0,0|0,0,2]=4 859 B12R1.1274 CC(C)C1CCC(C)(Cl)C(O)C1 Amb28127752 [0,1,1,0,0,0|0,0,2]=4 860 B12R1.1274 CC(C)C1CCC(C)(F)C(=O)C1 Amb27597069 [0,1,1,0,0,0|0,0,0]=2 861 B12R1.1274 CC(C)C1CCC(C)(N)C(O)C1 Amb27816386 [0,1,1,0,0,0|0,0,2]=4 862 B12R1.1274 CC(C)C1CCC(C)(O)C(Cl)C1 Amb27873290 [0,1,1,0,0,0|1,0,1]=4 863 B12R1.1274 CC(C)C1CCC(C)(O)C(N)C1 Amb26964765 [0,1,1,0,0,0|1,0,1]=4 864 B12R1.1274 CC(C)C1CCC(C)(O)C(O)C1 Amb24565823 [0,1,1,0,0,0|0,0,2]=4 865 B12R1.1274 CC(C)C1CC[C@@](C)(O)[C@H](O)C1 Amb27439081 [0,1,1,0,0,0|0,0,2]=4 866 B12R1.1274 CC(C)C1CNC(C)(C)C(=O)N1 Amb27437951 [0,1,1,0,0,0|2,0,0]=4 867 B12R1.1274 CC(C)[C@@H]1CCC(C)(C)C(=O)C1 Amb27409591 [0,1,1,0,0,0|0,0,0]=2 868 B12R1.1274 CC(C)[C@@H]1CCC(C)(O)C(N)C1 Amb27770004 [0,1,1,0,0,0|1,0,1]=4 869 B12R1.1274 CC(C)[C@@H]1CC[C@@](C)(O)[C@H](O)C1 Amb27844347 [0,1,1,0,0,0|0,0,2]=4 870 B12R1.1274 CC(C)[C@@H]1CC[C@](C)(F)C(=O)C1 Amb27460500 [0,1,1,0,0,0|0,0,0]=2 871 B12R1.1274 CC(C)[C@@H]1CC[C@](C)(N)[C@@H](O)C1 Amb28142303 [0,1,1,0,0,0|0,0,2]=4 872 B12R1.1274 CC(C)[C@@H]1CC[C@](C)(O)C(=O)C1 Amb27818184 [0,1,1,0,0,0|0,0,0]=2 873 B12R1.1274 CC(C)[C@@H]1CC[C@](C)(O)[C@@H](N)C1 Amb27261909 [0,1,1,0,0,0|1,0,1]=4 874 B12R1.1274 CC(C)[C@@H]1CC[C@](C)(O)[C@H](N)C1 Amb27420074 [0,1,1,0,0,0|1,0,1]=4 875 B12R1.1274 CC(C)[C@H]1CCC(C)(O)C(O)C1 Amb25073140 [0,1,1,0,0,0|0,0,2]=4 876 B12R1.1274 CC(C)[C@H]1CC[C@@](C)(Cl)[C@H](O)C1 Amb27213822 [0,1,1,0,0,0|0,0,2]=4 877 B12R1.1274 CC(C)[C@H]1CC[C@@](C)(O)[C@@H](N)C1 Amb27620430 [0,1,1,0,0,0|1,0,1]=4 878 B12R1.1274 CC(C)[C@H]1CC[C@@](C)(O)[C@H](N)C1 Amb24107554 [0,1,1,0,0,0|1,0,1]=4 879 B12R1.1274 CC(C)[C@H]1CC[C@@](C)(O)[C@H](O)C1 Amb28053657 [0,1,1,0,0,0|0,0,2]=4 880 B12R1.1274 CC(C)[C@H]1CC[C@](C)(O)[C@@H](N)C1 Amb24107555 [0,1,1,0,0,0|1,0,1]=4 881 B12R1.1645 C=C(C)C1(O)CCC(C)C(=O)C1 Amb28321919 [0,1,1,0,0,0|0,0,2]=4 882 B12R1.1645 CC1=CC[C@@](O)(C(C)C)CC1=O Amb28076083 [0,1,1,0,0,0|0,0,2]=4 883 B12R1.1645 CC1CCC(C)(C(C)C)CC1O Amb27604481 [0,1,1,0,0,0|0,0,2]=4 884 B12R1.1645 CC1CCC(Cl)(C(C)C)CC1Cl Amb27966672 [0,1,1,0,0,0|1,0,1]=4 885 B12R1.1645 CC1CCC(O)(C(C)C)CC1O Amb28244191 [0,1,1,0,0,0|0,0,2]=4 886 B12R1.898 C=C1CCC(CC(=O)O)C1(C)C Amb9767513 [0,1,1,0,0,0|0,0,2]=4 887 B12R1.898 C=C1CCC(CC(N)=O)C1(C)C Amb27873269 [0,1,1,0,0,0|0,0,2]=4 888 B12R1.898 CC(N)CC1CCC(C)C1(C)C Amb27791819 [0,1,1,0,0,0|1,0,1]=4 889 B12R1.898 CC1(C)C(=O)CCC1CC(=O)O Amb23536050 [0,1,1,0,0,0|1,0,1]=4 890 B12R1.898 CC1(C)C(=O)CC[C@H]1CC(=O)O Amb27389241 [0,1,1,0,0,0|1,0,1]=4 891 B12R1.898 CC1(C)C(N)CCN1CC(N)=O Amb28382903 [0,1,1,0,0,0|2,0,0]=4 892 B12R1.898 CC1(C)C(O)CCN1CC(=O)O Amb27485813 [0,1,1,0,0,0|2,0,0]=4 893 B12R1.898 CC1(C)C(O)CCN1CC(N)=O Amb28349576 [0,1,1,0,0,0|2,0,0]=4 894 B12R1.898 CC1=CCC(CC(=O)O)C1(C)C Amb9783247 [0,1,1,0,0,0|0,0,2]=4 895 B12R1.898 CC1=CC[C@H](CC(=O)O)C1(C)C Amb27657686 [0,1,1,0,0,0|0,0,2]=4 896 B12R1.898 CC1CCC(CC(=O)O)C1(C)C Amb18647416 [0,1,1,0,0,0|0,0,0]=2 897 B12R1.898 CC1CC[C@H](CC(=O)O)C1(C)C Amb27801705 [0,1,1,0,0,0|0,0,0]=2 898 B12R1.1094 CC1CC(O)C(CCO)C1(C)C Amb27589000 [0,1,1,0,0,0|0,0,2]=4 899 B12R1.1129 CC1(C)C(CC=O)CCS1(=O)=O Amb33480761 [0,1,1,0,0,0|2,0,0]=4 900 B12R1.1426 CC1C(=O)CC(CC=O)C1(C)C Amb27166077 [0,1,1,0,0,0|0,0,1]=3 901 B12R1.1426 CC1C(O)CC(CCO)C1(C)C Amb28061943 [0,1,1,0,0,0|0,0,2]=4 902 B12R1.1455 CC1(C)C(CCl)=CCC1CC=O Amb28342225 [0,1,1,0,0,0|0,0,2]=4 903 B12R1.1455 CCC1CCC(CC=O)C1(C)C Amb27267169 [0,1,1,0,0,0|0,0,0]=2 904 B12R1.1455 CC[C@@H]1CC[C@H](CC=O)C1(C)C Amb27428387 [0,1,1,0,0,0|0,0,0]=2 905 B12R1.1702 CC(C=O)N1CCC(O)C1(C)C Amb35640857 [0,1,1,0,0,0|2,0,0]=4 906 B12R1.1702 CC1=CCC(C(C)C=O)C1(C)C Amb27614809 [0,1,1,0,0,0|0,0,2]=4 907 B12R1.3295 CC1CCC(C)(CNN)C1(C)C Amb35630209 [0,1,1,0,0,0|2,0,0]=4 908 B12R1.3295 CNCC1(C)CCC(C)C1(C)C Amb35588900 [0,1,1,0,0,0|2,0,0]=4 909 B12R1.3295 CNC[C@@]1(C)CC[C@@H](C)C1(C)C Amb35588929 [0,1,1,0,0,0|2,0,0]=4 910 B12R1.3295 C[C@@H]1CC[C@](C)(CNN)C1(C)C Amb35630210 [0,1,1,0,0,0|2,0,0]=4 911 B12R1.3295 C[C@@H]1CC[C@](C)(N=C=O)C1(C)C Amb35588997 [0,1,1,0,0,0|1,0,1]=4 912 B12R1.601 CCC1NC(=O)C(C)C1(C)CC Amb28056571 [0,1,1,0,0,0|1,0,0]=3 913 B12R1.601 CCN1CC(=O)N(C)C1(C)CC Amb28070330 [0,1,1,0,0,0|2,0,0]=4 914 B12R1.602 CCN1CC(=O)N(CC)C1(C)C Amb27853068 [0,1,1,0,0,0|2,0,0]=4 915 B12R1.603 CCC1CC(N)C(C)(N)C1(C)C Amb32640331 [0,1,1,0,0,0|1,0,1]=4 916 B12R1.603 CCC1CC(O)C(C)(N)C1(C)C Amb32640333 [0,1,1,0,0,0|0,0,2]=4 917 B12R1.2566 CCC1C(=O)C(=O)C(C)C1(C)C Amb32640339 [0,1,1,0,0,0|0,0,1]=3 918 B12R1.2566 CCC1C(Br)C(=O)C(C)C1(C)C Amb32640347 [0,1,1,0,0,0|0,0,0]=2 919 B12R1.3037 CC(C)C1CC(=O)C(C)C1(C)O Amb27176166 [0,1,1,0,0,0|1,0,0]=3 920 B12R1.3037 CC(C)C1OC(=O)C(O)C1(C)C Amb27615567 [0,1,1,0,0,0|2,0,0]=4 921 B12R1.668 CC(C)C1(CN)CCCNC1=O Amb27495571 [0,1,1,0,0,0|1,0,0]=3 922 B12R1.904 CC(C)(C)C1(C)CCCCC1=O Amb28246515 [0,1,1,0,0,0|0,0,0]=2 923 B12R1.904 CC(C)(C)C1(O)CCCCC1=O Amb27262886 [0,1,1,0,0,0|1,0,0]=3 924 B12R1.904 CC(C)(C)[C@]1(C)CCCC[C@H]1O Amb27457915 [0,1,1,0,0,0|0,0,2]=4 925 B12R1.904 CC(C)(O)C1(C)CCC=CC1=O Amb27770121 [0,1,1,0,0,0|0,0,2]=4 926 B12R1.904 CC(C)(O)C1(C)CCCCC1=O Amb27802734 [0,1,1,0,0,0|0,0,0]=2 927 B12R1.904 CC(C)(O)C1(C)CCCCC1O Amb27396906 [0,1,1,0,0,0|0,0,2]=4 928 B12R1.904 CC(C)(O)[C@]1(C)CCCC[C@H]1O Amb27219023 [0,1,1,0,0,0|0,0,2]=4 929 B12R1.911 CC(C)[C@]1(C)CC[C@@H](C)CC1O Amb28069773 [0,1,1,0,0,0|0,0,2]=4 930 B12R1.911 CC(C)[C@]1(O)CC[C@H](C)CC1=O Amb27818166 [0,1,1,0,0,0|1,0,0]=3 931 B12R1.911 CC1=CC(=O)C(C)(C(C)C)CC1 Amb27176167 [0,1,1,0,0,0|0,0,2]=4 932 B12R1.911 CC1CCC(N)(C(C)C)C(=O)C1 Amb27858822 [0,1,1,0,0,0|1,0,0]=3 933 B12R1.911 CC1CCC(O)(C(C)C)C(=O)C1 Amb27270866 [0,1,1,0,0,0|1,0,0]=3 934 B12R1.1018 CC(=O)C1(C)C(=O)CCCC1C Amb27974637 [0,1,1,0,0,0|1,0,1]=4 935 B12R1.1018 CC(C)C1(C)C(=N)NCCC1=O Amb27393518 [0,1,1,0,0,0|1,0,1]=4 936 B12R1.1018 CC(C)C1(C)C(=O)CCCC1=O Amb25117920 [0,1,1,0,0,0|0,0,1]=3 937 B12R1.1018 CC(O)C1(O)C(=O)CCCC1Cl Amb27237630 [0,1,1,0,0,0|2,0,0]=4 938 B12R1.1018 CC(O)C1(O)C(=O)CCCC1O Amb27855041 [0,1,1,0,0,0|2,0,0]=4 939 B12R1.1281 CC(C)C1(C)CC(=O)CNC1=O Amb33329630 [0,1,1,0,0,0|1,0,1]=4 940 B12R1.1729 C=CC(C)C1(C)CCCCC1=O Amb27176050 [0,1,1,0,0,0|0,0,1]=3 941 B12R1.1729 C=C[C@@H](C)[C@@]1(C)CCCCC1=O Amb28052299 [0,1,1,0,0,0|0,0,1]=3 942 B12R1.1729 COC(=O)C1(C)CCCCC1=O Amb24058253 [0,1,1,0,0,0|1,0,1]=4 943 B12R1.1729 COC(=O)[C@@]1(C)CCCCC1=O Amb27177909 [0,1,1,0,0,0|1,0,1]=4 944 B12R1.1729 COC(C)C1(C)NCCNC1=O Amb28246709 [0,1,1,0,0,0|2,0,0]=4 945 B12R1.2451 C=C1CC[C@@](C)(CO)[C@]1(C)CBr Amb2537070 [0,1,1,0,0,0|2,0,0]=4 946 B12R1.3889 C=C1CCC(C)(C(=O)O)C1(C)C Amb28193727 [0,1,1,0,0,0|0,0,2]=4 947 B12R1.3889 CC(=O)C1(C)CCC(C)C1(C)C Amb25860101 [0,1,1,0,0,0|0,0,0]=2 948 B12R1.3889 CC(=O)C1(C)CCC(C)C1(C)O Amb27176200 [0,1,1,0,0,0|1,0,0]=3 949 B12R1.3889 CC(=O)[C@@]1(C)CC[C@@H](C)C1(C)C Amb35672524 [0,1,1,0,0,0|0,0,0]=2 950 B12R1.3889 CC(N)[C@@]1(C)CC[C@@H](C)C1(C)C Amb35630197 [0,1,1,0,0,0|1,0,1]=4 951 B12R1.3889 CC(O)[C@@]1(C)CC[C@@H](C)C1(C)C Amb35672422 [0,1,1,0,0,0|0,0,2]=4 952 B12R1.3889 CC1(C(=O)O)CCC(N)C1(C)C Amb9767514 [0,1,1,0,0,0|1,0,0]=3 953 B12R1.3889 CC1(C)[C@@H](O)CC[C@@]1(C)C(=O)O Amb28070454 [0,1,1,0,0,0|1,0,0]=3 954 B12R1.3889 CC1(C)[C@H](O)CC[C@@]1(C)C(=O)O Amb28052098 [0,1,1,0,0,0|1,0,0]=3 955 B12R1.3889 CC1(C)[C@H](O)CC[C@]1(C)C(=O)O Amb27983742 [0,1,1,0,0,0|1,0,0]=3 956 B12R1.3889 CC1CCC(C)(C(=O)Cl)C1(C)C Amb29856047 [0,1,1,0,0,0|0,0,0]=2 957 B12R1.3889 CC1CCC(C)(C(=O)O)C1(C)C Amb21947922 [0,1,1,0,0,0|0,0,0]=2 958 B12R1.3889 CC1CCC(C)(C(C)N)C1(C)C Amb29856036 [0,1,1,0,0,0|1,0,1]=4 959 B12R1.3889 CC1CCC(O)(C(=O)O)C1(C)C Amb27411891 [0,1,1,0,0,0|1,0,0]=3 960 B12R1.3889 C[C@@H]1CC[C@](C)(C(=O)Cl)C1(C)C Amb29856048 [0,1,1,0,0,0|0,0,0]=2 961 B12R1.3889 C[C@@H]1CC[C@](C)(C(N)=O)C1(C)C Amb35672707 [0,1,1,0,0,0|0,0,0]=2 962 B12R1.3889 C[C@H]1CC[C@@](C)(C(=O)O)C1(C)C Amb23452530 [0,1,1,0,0,0|0,0,0]=2 963 B12R1.4227 C=C[C@]1(C)CC[C@H](CO)C1(C)C Amb27635786 [0,1,1,0,0,0|1,0,0]=3 964 B12R1.4227 CC1(C#N)CCC(CO)C1(C)C Amb27972367 [0,1,1,0,0,0|1,0,1]=4 965 B12R1.4227 CC1(C)[C@@H](C=O)CC[C@@]1(C)C=O Amb27463383 [0,1,1,0,0,0|0,0,1]=3 966 B12R1.4227 CC1(C)[C@H](CO)CC[C@]1(C)CO Amb28053694 [0,1,1,0,0,0|0,0,2]=4 967 B12R1.4227 CC1(CO)CCC(CO)C1(C)C Amb9753184 [0,1,1,0,0,0|0,0,2]=4 968 B12R1.2692 C=C1CC(C)(O)C(C)(C(C)=O)C1 Amb25110086 [0,1,1,0,0,0|1,0,1]=4 969 B12R1.2692 CC(=O)C1(C)CC(=O)CC1(C)C Amb27616868 [0,1,1,0,0,0|0,0,1]=3 970 B12R1.2692 CC(=O)C1(C)CC(O)CC1(C)C Amb27948700 [0,1,1,0,0,0|0,0,0]=2 971 B12R1.2692 CC(=O)[C@@]1(C)C[C@@H](O)CC1(C)C Amb24745739 [0,1,1,0,0,0|0,0,0]=2 972 B12R1.2692 CC1(C)C[C@H](O)C[C@@]1(C)C(=O)O Amb27477952 [0,1,1,0,0,0|1,0,0]=3 973 B12R1.2692 CC1(C)C[C@H](O)C[C@]1(C)C(=O)O Amb28385614 [0,1,1,0,0,0|1,0,0]=3 974 B12R1.3446 CC1(C)CCCC1(C)C(=O)CO Amb28200058 [0,1,1,0,0,0|0,0,0]=2 975 B12R1.3446 COC(=O)C1(F)CNCC1(C)C Amb30016624 [0,1,1,0,0,0|2,0,0]=4 976 B12R1.3446 COC(=O)C1(N)CCCC1(C)C Amb25242308 [0,1,1,0,0,0|1,0,0]=3 977 B12R1.3446 COC(=O)C1(N)CCOC1(C)C Amb27877207 [0,1,1,0,0,0|2,0,0]=4 978 B12R1.3446 COC(=O)C1(N)COCC1(C)C Amb27232107 [0,1,1,0,0,0|2,0,0]=4 979 B12R1.3446 COC(=O)C1(O)CCCC1(C)C Amb27247851 [0,1,1,0,0,0|1,0,0]=3 980 B12R1.3846 CC1(C)OCCC1(CN)C(=O)O Amb29887892 [0,1,1,0,0,0|2,0,0]=4 981 B12R1.3846 CC1(C)OCCC1(CO)C(=O)O Amb35644642 [0,1,1,0,0,0|2,0,0]=4 982 B12R1.3846 CCC1(C(=O)O)CCOC1(C)C Amb35644640 [0,1,1,0,0,0|2,0,0]=4 983 B12R1.3846 CNC1(C(=O)O)CCCC1(C)C Amb28124273 [0,1,1,0,0,0|1,0,0]=3 984 B12R1.3846 CNC1(C(=O)O)COCC1(C)C Amb27455194 [0,1,1,0,0,0|2,0,0]=4 985 B12R1.3846 CNC1(C(N)=O)COCC1(C)C Amb27944451 [0,1,1,0,0,0|2,0,0]=4 986 B12R2.508 CC1(C)C2CCC1C(Br)C2=O Amb26352510 [1,1,0,0,0,0|0,0,0]=2 987 B12R2.508 CC1(C)C2CCC1N(O)C2=O Amb27402130 [1,1,0,0,0,0|1,0,0]=3 988 B12R2.508 CC1(C)[C@@H]2CC[C@H]1C(=O)C2=O Amb15691925 [1,1,0,0,0,0|0,0,1]=3 989 B12R2.508 CC1(C)[C@@H]2CC[C@H]1[C@H](O)[C@@H]2N Amb25933578 [1,1,0,0,0,0|0,0,2]=4 990 B12R2.508 CC1C(=O)C2CCC1C2(C)C Amb28461254 [1,1,0,0,0,0|0,0,0]=2 991 B12R2.570 CC1(C)C2CCC1C(F)(F)C2 Amb25725265 [1,1,0,0,0,0|1,0,1]=4 992 B12R2.570 CC1(N)C[C@H]2CC[C@@H]1C2(C)C Amb27983640 [1,1,0,0,0,0|1,0,1]=4 993 B12R2.1137 CC1(C)C2CC(=O)C1C(=O)C2 Amb28320347 [1,1,0,0,0,0|0,0,1]=3 994 B12R2.1278 CC1(C)C2CC(Cl)C1CC2=O Amb27823133 [1,1,0,0,0,0|0,0,0]=2 995 B12R2.1278 CC1(C)C2CC(O)C1OC2=O Amb27853063 [1,1,0,0,0,0|1,0,0]=3 996 B12R2.1278 CC1(C)C2C[C@H](O)C1C[C@@H]2O Amb27422358 [1,1,0,0,0,0|0,0,2]=4 997 B12R2.1834 CC1(C)C2C=C(C=O)C1CC2 Amb18644441 [1,1,0,0,0,0|0,0,1]=3 998 B12R2.1834 CC1(C)C2C=C(CCl)C1CC2 Amb27955824 [1,1,0,0,0,0|1,0,1]=4 999 B12R2.1834 CC1(C)C2CCC1C(NN)C2 Amb28208292 [1,1,0,0,0,0|1,0,1]=4 1000 B12R2.1834 CC1(C)[C@@H]2CC[C@H]1[C@H](NN)C2 Amb28132677 [1,1,0,0,0,0|1,0,1]=4 1001 B12R2.1834 CC1(C)[C@H]2CC[C@@H]1C(C=O)C2 Amb26455697 [1,1,0,0,0,0|0,0,1]=3 1002 B12R2.1834 CC1(C)[C@H]2CC[C@@H]1C[C@@H]2C=O Amb27265868 [1,1,0,0,0,0|0,0,1]=3 1003 B12R2.1834 CC1(C)[C@H]2CC[C@@H]1C[C@H]2C=O Amb27420178 [1,1,0,0,0,0|0,0,1]=3 1004 B12R2.1834 CC1(C)[C@H]2CC[C@@H]1[C@@H](C=O)C2 Amb26935632 [1,1,0,0,0,0|0,0,1]=3 1005 B12R2.1834 CC1(C)[C@H]2CC[C@@H]1[C@H](C=O)C2 Amb25973647 [1,1,0,0,0,0|0,0,1]=3 1006 B12R2.1834 CC1(C)[C@H]2CC[C@@H]1[C@H](CO)C2 Amb27490852 [1,1,0,0,0,0|0,0,2]=4 1007 B12R2.2825 CC1(C)[C@@H]2CC[C@@]1(C)C[C@@H]2N Amb27620435 [1,1,0,0,0,0|1,0,1]=4 1008 B12R2.2825 CC1(C)[C@@H]2CC[C@@]1(C)C[C@H]2O Amb26407642 [1,1,0,0,0,0|0,0,2]=4 1009 B12R2.2825 CC1(C)[C@@H]2CC[C@@]1(C)NC2=O Amb27206153 [1,1,0,0,0,0|1,0,0]=3 1010 B12R2.2825 CC1(C)[C@@H]2CC[C@]1(C)C[C@H]2N Amb27983679 [1,1,0,0,0,0|1,0,1]=4 1011 B12R2.2825 CC1(C)[C@@H]2CC[C@]1(C)C[C@H]2O Amb28053598 [1,1,0,0,0,0|0,0,2]=4 1012 B12R2.2825 CC1(C)[C@H]2CC[C@]1(C)CC2N Amb27208946 [1,1,0,0,0,0|1,0,1]=4 1013 B12R2.2825 CC1(C)[C@H]2CC[C@]1(C)C[C@@H]2O Amb28053347 [1,1,0,0,0,0|0,0,2]=4 1014 B12R2.2825 CC1(C)[C@H]2CC[C@]1(C)C[C@H]2N Amb27878676 [1,1,0,0,0,0|1,0,1]=4 1015 B12R2.2825 CC12CCC(C(=O)C1)C2(C)C Amb28201067 [1,1,0,0,0,0|0,0,0]=2 1016 B12R2.2825 CC12CCC(C(=S)C1)C2(C)C Amb2609082 [1,1,0,0,0,0|0,1,0]=3 1017 B12R2.2825 CC12CCC(C(=S)N1)C2(C)C Amb27600004 [1,1,0,0,0,0|1,1,0]=4 1018 B12R2.2825 CC12CCC(C(Cl)C1)C2(C)C Amb27878666 [1,1,0,0,0,0|1,0,1]=4 1019 B12R2.2825 CC12CCC(C(O)C1)C2(C)C Amb27472115 [1,1,0,0,0,0|0,0,2]=4 1020 B12R2.2825 CC12CCC([C@@H](O)C1)C2(C)C Amb27978283 [1,1,0,0,0,0|0,0,2]=4 1021 B12R2.2841 CC1C2(C)CCC1(C)C(=O)C2 Amb27973087 [1,1,0,0,0,0|0,0,0]=2 1022 B12R2.2841 CC1C2(C)CCC1(C)C(Cl)C2 Amb27974217 [1,1,0,0,0,0|1,0,1]=4 1023 B12R2.2841 CC1C2(C)CCC1(C)C(O)C2 Amb27233108 [1,1,0,0,0,0|0,0,2]=4 1024 B12R2.5891 C[C@H]1[C@@H]2CC[C@@]1(C)C(=O)C2=O Amb28194581 [1,1,0,0,0,0|0,0,1]=3 1025 B12R2.6284 CC1C2CCC1(C)C(C)(O)C2 Amb28251059 [1,1,0,0,0,0|0,0,2]=4 1026 B12R2.6284 C[C@H]1[C@H]2CC[C@]1(C)[C@@](C)(O)C2 Amb27639466 [1,1,0,0,0,0|0,0,2]=4 1027 B12R2.7738 CCC1[C@H]2CC[C@]1(C)C(=O)C2 Amb27854621 [1,1,0,0,0,0|0,0,0]=2 1028 B12R2.6004 CC12CCC(N)(CC1)C2(C)C Amb23580642 [1,1,0,0,0,0|0,0,1]=3 1029 B12R2.7125 CC1(C)C2CCC1(C=O)CC2 Amb32675284 [1,1,0,0,0,0|0,0,2]=4 1030 B12R2.7125 CC1(C)C2CCC1(CBr)CC2 Amb33495663 [1,1,0,0,0,0|0,0,1]=3 1031 B12R2.7125 CC1(C)C2CCC1(CCl)CC2 Amb33495662 [1,1,0,0,0,0|0,0,1]=3 1032 B12R2.7125 CC1(C)C2CCC1(CN)CC2 Amb25185277 [1,1,0,0,0,0|0,0,1]=3 1033 B12R2.7125 CC1(C)C2CCC1(CN)CC2 Amb31188216 [1,1,0,0,0,0|0,0,1]=3 1034 B12R2.7125 CC1(C)C2CCC1(CO)CC2 Amb24502092 [1,1,0,0,0,0|0,0,1]=3 1035 B12R2.7125 CNC12CCC(CC1)C2(C)C Amb26372968 [1,1,0,0,0,0|0,0,1]=3 1036 B12R2.7737 CC1(C)C2CCC1(C)C2CO Amb23541086 [0,1,0,0,1,0|0,0,2]=4 1037 B12R2.7737 CC1(C)[C@H]2CC[C@]1(C)[C@@H]2C=O Amb27437905 [0,1,0,0,1,0|0,0,1]=3 1038 B12R2.7737 CC1(C)[C@H]2CC[C@]1(C)[C@H]2C=O Amb28287362 [0,1,0,0,1,0|0,0,1]=3 1039 B12R2.7737 CC1(C)[C@H]2CC[C@]1(C)[C@H]2CO Amb28345391 [0,1,0,0,1,0|0,0,2]=4 1040 B14R2.9028 CC1(C)O[C@@]2(C)C[C@@H](O)[C@@H]1C[C@H]2O Amb27799841 [0,1,0,0,0,1|0,0,2]=4 1041 B14R2.9028 CC1=C[C@@]2(C)CC(C)(C)[C@@H]1CC2=O Amb28074698 [0,1,0,0,0,1|0,0,2]=4 1042 B14R2.13406 CC1(C)OC2(C)[C@@H](O)C[C@@H]1C[C@H]2O Amb27764802 [0,1,0,0,0,1|0,0,2]=4 1043 B14R2.13406 CC1(C)OC2(C)[C@H](O)CC1C[C@H]2O Amb27184341 [0,1,0,0,0,1|0,0,2]=4 1044 B14R2.13406 CC1(C)O[C@@]2(C)[C@@H](O)C[C@@H]1C[C@H]2O Amb27431337 [0,1,0,0,0,1|0,0,2]=4 1045 B14R2.13406 CC12OC(C)(C)[C@H](CC1=O)C[C@@H]2Cl Amb27782394 [0,1,0,0,0,1|0,0,0]=2 1046 B14R2.17280 CC12CCC(CC1O)C(C)(CO)O2 Amb28294207 [0,1,0,0,0,1|0,0,2]=4 1047 B14R2.17280 COC1(C)CC2(C)C=CC1CC2=O Amb24526605 [0,1,0,0,0,1|0,0,2]=4 1048 B14R2.17280 C[C@@]1(CO)O[C@]2(C)CC[C@H]1C[C@H]2O Amb27184318 [0,1,0,0,0,1|0,0,2]=4 1049 B14R2.17280 C[C@]12CC[C@H](C[C@@H]1O)[C@](C)(CO)O2 Amb27208231 [0,1,0,0,0,1|0,0,2]=4 1050 B14R2.38421 CC1(C)N[C@@]2(C)CC[C@@H]1C\C2=N/O Amb27614297 [0,1,0,0,0,1|0,0,1]=3 1051 B14R2.38421 CC12CCC(C\C1=N/O)C(C)(C)N2 Amb28047274 [0,1,0,0,0,1|0,0,1]=3 1052 B14R2.59745 CC1(C)C(=O)[C@@]2(C)CC[C@@H]1C[C@H]2O Amb28053732 [0,1,0,0,0,1|0,0,2]=4 1053 B14R2.79469 CC1(C)OC2(C)CCC1C(O)C2O Amb27864009 [0,1,0,0,0,1|0,0,2]=4 1054 B14R2.79469 CC1(C)O[C@@]2(C)CC[C@@H]1C(O)C2O Amb25179024 [0,1,0,0,0,1|0,0,2]=4 1055 B14R2.79469 CC1(C)O[C@@]2(C)CC[C@@H]1[C@H](O)[C@@H]2O Amb27422432 [0,1,0,0,0,1|0,0,2]=4 1056 B14R2.79469 CC1(C)O[C@]2(C)CC[C@H]1[C@H](O)[C@@H]2O Amb27443627 [0,1,0,0,0,1|0,0,2]=4 1057 B14R2.79469 CC1(C)O[C@]2(C)CC[C@H]1[C@H](O)[C@H]2O Amb27854205 [0,1,0,0,0,1|0,0,2]=4 1058 B14R2.79469 CC12CCC(C(O)C1=O)C(C)(C)O2 Amb28048365 [0,1,0,0,0,1|0,0,0]=2 1059 B14R2.40685 CC1(C)[C@@H]2CC[C@@]1(C)OC(=O)[C@@H]2N Amb27881772 [0,1,0,0,0,1|0,0,0]=2 1060 B14R2.42089 CC1(C)C2CCC1(CI)OC(=O)C2 Amb2792554 [0,1,0,0,0,1|0,0,0]=2 1061 B14R2.59741 CC1(C)C2CCC1(C)C(N)C(O)C2 Amb27654082 [0,1,0,0,0,1|0,0,2]=4 1062 B14R2.59741 CC1(C)[C@@H]2CC[C@@]1(C)C(=O)[C@@H](O)C2 Amb27420332 [0,1,0,0,0,1|0,0,2]=4 1063 B14R2.59741 CC1(C)[C@@H]2CC[C@@]1(C)C(=O)[C@H](O)C2 Amb27206128 [0,1,0,0,0,1|0,0,2]=4 1064 B14R2.59741 CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](N)[C@@H](O)C2 Amb27624486 [0,1,0,0,0,1|0,0,2]=4 1065 B14R2.80483 CC1(C)[C@H]2CC(=O)O[C@]1(C)C[C@H]2O Amb27630476 [0,1,0,0,0,1|0,0,0]=2 1066 B14R2.12179 CC12CCC(C=C\C1=N/O)C2(C)C Amb17778062 [0,1,0,0,0,1|0,0,2]=4 1067 B14R2.12179 CC12CCC(CC\C1=N/O)C2(C)C Amb17778061 [0,1,0,0,0,1|0,0,1]=3 1068 B14R2.12179 CC12CCC(CN=C1NN)C2(C)C Amb18128949 [0,1,0,0,0,1|1,0,0]=3 1069 B14R2.27718 CC1(C)C2CCC1(N)C(=O)NC2=O Amb28385548 [0,1,0,0,0,1|1,0,1]=4 1070 B14R2.27718 CC1(C)[C@@H]2CC[C@@]1(C)C(=N)NC2=O Amb27841343 [0,1,0,0,0,1|1,0,1]=4 1071 B14R2.27718 CC1(C)[C@@H]2CC[C@@]1(C)C(=O)C=C2N Amb27983639 [0,1,0,0,0,1|0,0,1]=3 1072 B14R2.27718 CC1(C)[C@@H]2CC[C@@]1(C)C(=O)NC2=N Amb27628354 [0,1,0,0,0,1|0,0,1]=3 1073 B14R2.27718 CC1(C)[C@@H]2CC[C@@]1(C)C(=O)NC2=S Amb27784940 [0,1,0,0,0,1|0,0,1]=3 1074 B14R2.27718 CC1(C)[C@H]2CC[C@]1(C)C(=O)C[C@@H]2O Amb27443234 [0,1,0,0,0,1|0,0,0]=2 1075 B14R2.27718 CC1(C)[C@H]2CC[C@]1(C)C(=S)NC2=S Amb28058904 [0,1,0,0,0,1|0,1,1]=4 1076 B14R2.27718 CC12CCC(C(=N)NC1=O)C2(C)C Amb27667121 [0,1,0,0,0,1|0,0,1]=3 1077 B14R2.27718 CC12CCC(C(=O)CC1=O)C2(C)C Amb23589731 [0,1,0,0,0,1|0,0,0]=2 1078 B14R2.27718 CC12CCC(C(=O)NC1=N)C2(C)C Amb17777972 [0,1,0,0,0,1|1,0,1]=4 1079 B14R2.27718 CC12CCC(C(=O)NC1=O)C2(C)C Amb1150485 [0,1,0,0,0,1|0,0,1]=3 1080 B14R2.27718 CC12CCC(C(=O)OC1=O)C2(C)C Amb2717491 [0,1,0,0,0,1|0,0,1]=3 1081 B14R2.27718 CC12CCC(C(O)CC1=O)C2(C)C Amb27972387 [0,1,0,0,0,1|0,0,0]=2 1082 B14R2.27718 CC1=CC(=O)C2(C)CCC1C2(C)C Amb28202201 [0,1,0,0,0,1|0,0,1]=3 1083 B14R2.18694 CC1(C)C2CCC1(C)C(C=O)C2=O Amb27792046 [0,2,0,0,0,0|0,0,2]=4 1084 B14R2.18694 CC1(C)C2CCC1(C)N(N=O)C2=O Amb4014582 [0,2,0,0,0,0|1,0,1]=4 1085 B14R2.18694 CC1(C)[C@@H]2CC[C@@]1(C)\C(=N\O)C2O Amb27457718 [0,2,0,0,0,0|0,0,1]=3 1086 B14R2.18694 CC1(C)[C@H]2CC[C@]1(C)\C(=N\O)[C@@H]2O Amb27662151 [0,2,0,0,0,0|0,0,1]=3 1087 B14R2.18694 CC12CCC(C(O)\C1=N/O)C2(C)C Amb27764950 [0,2,0,0,0,0|0,0,1]=3 1088 B14R2.18694 CNC1C(O)C2CCC1(C)C2(C)C Amb27224030 [0,2,0,0,0,0|1,0,1]=4 1089 B14R2.18694 CN[C@@H]1[C@H](O)[C@@H]2CC[C@@]1(C)C2(C)C Amb27252300 [0,2,0,0,0,0|1,0,1]=4 1090 B14R2.18694 CN[C@@H]1[C@H](O)[C@H]2CC[C@]1(C)C2(C)C Amb28052180 [0,2,0,0,0,0|1,0,1]=4 1091 B14R2.27073 CC1(C)C2CCC1(C)C(N=C=S)C2 Amb27443924 [0,2,0,0,0,0|0,1,1]=4 1092 B14R2.27073 CC1(C)C2CCC1(C)C(NC#N)C2 Amb27868463 [0,2,0,0,0,0|1,0,1]=4 1093 B14R2.27073 CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](N=C=O)C2 Amb28053408 [0,2,0,0,0,0|0,0,1]=3 1094 B14R2.27073 CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](NC=O)C2 Amb28251285 [0,2,0,0,0,0|0,0,1]=3 1095 B14R2.27073 CC1(C)[C@@H]2CC[C@@]1(C)\C(=C\C=O)C2 Amb27777288 [0,2,0,0,0,0|0,0,0]=2 1096 B14R2.27073 CC1(C)[C@@H]2CC[C@@]1(C)\C(=C\CO)C2 Amb28435730 [0,2,0,0,0,0|0,0,1]=3 1097 B14R2.27073 CC1(C)[C@H]2CC[C@]1(C)[C@@H](NC#N)C2 Amb28321476 [0,2,0,0,0,0|1,0,1]=4 1098 B14R2.27073 CC1(C)[C@H]2CC[C@]1(C)[C@@H](OC=O)C2 Amb27858461 [0,2,0,0,0,0|0,0,1]=3 1099 B14R2.27073 CC1(C)[C@H]2CC[C@]1(C)[C@H](N=C=O)C2 Amb28075483 [0,2,0,0,0,0|0,0,1]=3 1100 B14R2.27073 CC1(C)[C@H]2CC[C@]1(C)[C@H](NC#N)C2 Amb27853857 [0,2,0,0,0,0|1,0,1]=4 1101 B14R2.27073 CC12CCC(C=C1CCO)C2(C)C Amb27397027 [0,2,0,0,0,0|0,0,2]=4 1102 B14R2.27073 CC12CC[C@H](C[C@@H]1NC=O)C2(C)C Amb28208498 [0,2,0,0,0,0|0,0,1]=3 1103 B14R2.27073 CCN[C@@H]1C[C@H]2CC[C@]1(C)C2(C)C Amb27461919 [0,2,0,0,0,0|1,0,1]=4 1104 B14R2.37899 CC1(C)C2C\C(=N/O)C1(C)C(Cl)C2 Amb27797250 [0,2,0,0,0,0|0,0,1]=3 1105 B14R2.37899 CC1(C)[C@H]2C[C@H](Cl)[C@]1(C)[C@H](CO)C2 Amb27224859 [0,2,0,0,0,0|0,0,2]=4 1106 B14R2.37899 CC1(C)[C@H]2C\C(=N/O)[C@@]1(C)[C@@H](Cl)C2 Amb28133398 [0,2,0,0,0,0|0,0,1]=3 1107 B14R2.38413 CC1(C)C2CCC1(CBr)\C(=N\O)C2 Amb2792738 [0,2,0,0,0,0|0,0,1]=3 1108 B14R2.38413 CC1(C)C2CCC1(CO)\C(=N\O)C2 Amb28294200 [0,2,0,0,0,0|0,0,1]=3 1109 B14R2.38413 CC1(C)[C@@H]2CC[C@@]1(CCl)\C(=N\O)C2 Amb27863897 [0,2,0,0,0,0|0,0,1]=3 1110 B14R2.38414 CC1(CBr)C2CC[C@]1(C)\C(=N\O)C2 Amb24113249 [0,2,0,0,0,0|0,0,1]=3 1111 B14R2.38414 CC1(CBr)[C@H]2CC[C@]1(C)\C(=N\O)C2 Amb27841524 [0,2,0,0,0,0|0,0,1]=3 1112 B14R2.38414 CC12CCC(C\C1=N/O)C2(C)CBr Amb2792396 [0,2,0,0,0,0|0,0,1]=3 1113 B14R2.44166 C#CC1(O)CC2CCC1(C)C2(C)C Amb1787044 [0,2,0,0,0,0|0,0,2]=4 1114 B14R2.44166 C#CC1(O)C[C@@H]2CC[C@@]1(C)C2(C)C Amb33189409 [0,2,0,0,0,0|0,0,2]=4 1115 B14R2.44166 C#CC1(O)C[C@H]2CC[C@]1(C)C2(C)C Amb33189410 [0,2,0,0,0,0|0,0,2]=4 1116 B14R2.44166 CC1(C)C2CCC1(C)C(N)(C#N)C2 Amb1133447 [0,2,0,0,0,0|1,0,1]=4 1117 B14R2.44166 CC1(C)C2CCC1(C)C(O)(CN)C2 Amb27608574 [0,2,0,0,0,0|0,0,2]=4 1118 B14R2.44166 CC1(C)C2CCC1(C)C(O)(CO)C2 Amb27598447 [0,2,0,0,0,0|0,0,2]=4 1119 B14R2.44166 CC1(C)C2CC[C@@]1(C)[C@](O)(C=O)C2 Amb28074619 [0,2,0,0,0,0|0,0,1]=3 1120 B14R2.44166 CC1(C)[C@@H]2CC[C@@]1(C)C(O)(CO)C2 Amb28455089 [0,2,0,0,0,0|0,0,2]=4 1121 B14R2.44166 CC1(C)[C@@H]2CC[C@@]1(C)[C@@](O)(CN)C2 Amb27420068 [0,2,0,0,0,0|0,0,2]=4 1122 B14R2.44166 CC1(C)[C@@H]2CC[C@@]1(C)[C@](O)(CN)C2 Amb27851406 [0,2,0,0,0,0|0,0,2]=4 1123 B14R2.62291 CC(N)[C@H]1CC2CCC1(C)C2(C)C Amb27400384 [0,2,0,0,0,0|1,0,1]=4 1124 B14R2.62291 CC1(C)C2C=C(B(O)O)[C@]1(C)CC2 Amb10072046 [0,2,0,0,0,0|0,0,2]=4 1125 B14R2.62291 CC1(C)C2CCC1(C)C(C(=O)O)C2 Amb21953658 [0,2,0,0,0,0|0,0,1]=3 1126 B14R2.62291 CC1(C)C2CC[C@@]1(C)C(C(=O)O)C2 Amb22224859 [0,2,0,0,0,0|0,0,1]=3 1127 B14R2.62291 CC1(C)C2CC[C@@]1(C)C(C(N)=O)C2 Amb22224861 [0,2,0,0,0,0|0,0,1]=3 1128 B14R2.62291 CC1(C)C2CC[C@]1(C)[C@H](C(=O)O)C2 Amb27858904 [0,2,0,0,0,0|0,0,1]=3 1129 B14R2.62291 CC1(C)[C@H]2C=C(B(O)O)[C@]1(C)CC2 Amb22388541 [0,2,0,0,0,0|0,0,2]=4 1130 B14R2.62291 CC12CCC(C=C1B(O)O)C2(C)C Amb28121928 [0,2,0,0,0,0|0,0,2]=4 1131 B14R2.62291 CC12CCC(C=C1C(=O)O)C2(C)C Amb28207501 [0,2,0,0,0,0|0,0,1]=3 1132 B14R2.67754 CC12CCC(Br)(C\C1=N/O)C2(C)C Amb23448447 [0,2,0,0,0,0|0,0,1]=3 1133 B14R2.67754 CNC1CC2(C)CCC1(C)C2(C)C Amb27389970 [0,2,0,0,0,0|1,0,1]=4 1134 B14R2.28397 CC1(O)CC2C(O)CC1(C)C2(C)C Amb22055474 [0,2,0,0,0,0|0,0,2]=4 1135 B14R2.40386 CC1(O)CC2CC(O)C1(C)C2(C)C Amb22055475 [0,2,0,0,0,0|0,0,2]=4 1136 B14R2.58166 CC1(C)C2CCC1(C)C(C)(O)C2O Amb22055473 [0,2,0,0,0,0|0,0,2]=4 1137 B14R2.28398 CC1(C)C2CC(Br)C1(C)C(=O)C2=O Amb9766931 [0,2,0,0,0,0|0,0,1]=3 1138 B14R2.28398 CC1(C)[C@H]2C[C@H](Cl)[C@]1(C)C(=O)C2=O Amb28053596 [0,2,0,0,0,0|0,0,1]=3 1139 B14R2.41056 CC1(CBr)C2CC(=O)C1(C)C(Br)C2 Amb2779920 [0,2,0,0,0,0|0,0,0]=2 1140 B14R2.7796 CC12CC(Br)C(C(=O)C1=O)C2(C)C Amb9766932 [0,2,0,0,0,0|0,0,1]=3 1141 B14R2.7796 CC12CC(O)C(C(N)C1=O)C2(C)C Amb27225945 [0,2,0,0,0,0|0,0,0]=2 1142 B14R2.38040 CC1(C)C2CC(O)C1(C)CC2CO Amb27665408 [0,2,0,0,0,0|0,0,2]=4 1143 B14R2.38040 CC1(C)[C@@H]2C[C@@H](O)[C@@]1(C)C[C@@H]2CO Amb27788520 [0,2,0,0,0,0|0,0,2]=4 1144 B14R2.17233 CC1(C#N)[C@@H]2CC[C@@]1(C)C(=O)C2=O Amb27861287 [0,2,0,0,0,0|0,0,2]=4 1145 B14R2.17233 CC1(CBr)C2CC[C@]1(C)C(=O)C2Br Amb24113258 [0,2,0,0,0,0|0,0,0]=2 1146 B14R2.17233 CC1(CBr)[C@@H]2CC[C@@]1(C)C(=O)[C@H]2Br Amb27655904 [0,2,0,0,0,0|0,0,0]=2 1147 B14R2.17233 CC1(CBr)[C@H]2CC[C@]1(C)C(=O)C2=O Amb27967847 [0,2,0,0,0,0|0,0,1]=3 1148 B14R2.17233 CC1(CBr)[C@H]2CC[C@]1(C)C(=O)C2Br Amb24696446 [0,2,0,0,0,0|0,0,0]=2 1149 B14R2.17233 CC12CCC(C(=O)C1=O)C2(C)C#N Amb28324336 [0,2,0,0,0,0|0,0,2]=4 1150 B14R2.17233 CC12CCC(C(=O)C1=O)C2(C)CBr Amb2792404 [0,2,0,0,0,0|0,0,1]=3 1151 B14R2.17233 CC12CCC(C(=O)C1=O)C2(C)CCl Amb28455531 [0,2,0,0,0,0|0,0,1]=3 1152 B14R2.17233 CC12CCC(C(=O)C1=O)C2(C)CF Amb27204870 [0,2,0,0,0,0|0,0,1]=3 1153 B14R2.17233 CC12CCC(C(=O)C1=O)C2(C)CI Amb2459780 [0,2,0,0,0,0|0,0,1]=3 1154 B14R2.17233 CC12CCC(C(Br)C1=O)C2(C)CBr Amb1350711 [0,2,0,0,0,0|0,0,0]=2 1155 B14R2.17233 CC12CCC(C(Br)C1=O)C2(C)CI Amb23569079 [0,2,0,0,0,0|0,0,0]=2 1156 B14R2.17233 CC12CCC(C(N)C1=O)C2(C)CO Amb27446559 [0,2,0,0,0,0|0,0,0]=2 1157 B14R2.18552 CC1(C)C2CCC1(C)C(O)C2CO Amb26840705 [0,2,0,0,0,0|0,0,2]=4 1158 B14R2.18552 CC1(C)C2CCC1(C)C(O)C2NO Amb9809262 [0,2,0,0,0,0|0,0,2]=4 1159 B14R2.18552 CC1(C)[C@@H]2CC[C@@]1(C)C(=O)C2C=O Amb28456527 [0,2,0,0,0,0|0,0,0]=2 1160 B14R2.18552 CC1(C)[C@@H]2CC[C@@]1(C)C(=O)[C@H]2CO Amb27853819 [0,2,0,0,0,0|0,0,0]=2 1161 B14R2.18552 CC1(C)[C@@H]2CC[C@@]1(C)C(=O)\C2=C/N Amb27211949 [0,2,0,0,0,0|0,0,1]=3 1162 B14R2.18552 CC1(C)[C@@H]2CC[C@@]1(C)C(=O)\C2=C\Cl Amb27845457 [0,2,0,0,0,0|0,0,1]=3 1163 B14R2.18552 CC1(C)[C@@H]2CC[C@@]1(C)C(=O)\C2=N/O Amb22353059 [0,2,0,0,0,0|0,0,1]=3 1164 B14R2.18552 CC1(C)[C@@H]2CC[C@@]1(C)C(=O)\C2=N\O Amb27439844 [0,2,0,0,0,0|0,0,1]=3 1165 B14R2.18552 CC1(C)[C@@H]2CC[C@@]1(C)C(O)C2CO Amb27983529 [0,2,0,0,0,0|0,0,2]=4 1166 B14R2.18552 CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](O)[C@@H]2CO Amb27790223 [0,2,0,0,0,0|0,0,2]=4 1167 B14R2.18552 CC1(C)[C@@H]2CC[C@]1(C)C(=O)\C2=N\O Amb34915037 [0,2,0,0,0,0|0,0,1]=3 1168 B14R2.18552 CC1(C)[C@@H]2CC[C@]1(C)[C@H](O)[C@H]2CO Amb27420438 [0,2,0,0,0,0|0,0,2]=4 1169 B14R2.18552 CC1(C)[C@H]2CC[C@]1(C)C(=O)\C2=N/O Amb22338277 [0,2,0,0,0,0|0,0,1]=3 1170 B14R2.18552 CC1(C)[C@H]2CC[C@]1(C)C(=O)\C2=N\O Amb26013458 [0,2,0,0,0,0|0,0,1]=3 1171 B14R2.18552 CC12CCC(C(C#N)C1=O)C2(C)C Amb2386214 [0,2,0,0,0,0|0,0,0]=2 1172 B14R2.18552 CC12CCC(C(C=N)C1=O)C2(C)C Amb28386620 [0,2,0,0,0,0|0,0,0]=2 1173 B14R2.18552 CC12CCC(C(CO)C1=O)C2(C)C Amb17777691 [0,2,0,0,0,0|0,0,0]=2 1174 B14R2.18552 CC12CCC(\C(=C/Cl)C1=O)C2(C)C Amb27657792 [0,2,0,0,0,0|0,0,1]=3 1175 B14R2.18552 CC12CCC(\C(=C/N)C1=O)C2(C)C Amb22058085 [0,2,0,0,0,0|0,0,1]=3 1176 B14R2.18552 CC12CCC(\C(=C\N)C1=O)C2(C)C Amb2386022 [0,2,0,0,0,0|0,0,1]=3 1177 B14R2.18552 CC12CCC(\C(=C\O)C1=O)C2(C)C Amb17594621 [0,2,0,0,0,0|0,0,1]=3 1178 B14R2.18552 CC12CCC(\C(=N/O)C1=O)C2(C)C Amb25137142 [0,2,0,0,0,0|0,0,1]=3 1179 B14R2.18552 CCC1C2CCC(C)(C1O)C2(C)C Amb27594745 [0,2,0,0,0,0|0,0,2]=4 1180 B14R2.18552 CNC1C2CCC(C)(C1O)C2(C)C Amb28123541 [0,2,0,0,0,0|0,0,2]=4 1181 B14R2.18552 CN[C@@H]1C(=O)[C@]2(C)CC[C@@H]1C2(C)C Amb27866463 [0,2,0,0,0,0|0,0,0]=2 1182 B14R2.18552 CN[C@@H]1[C@@H]2CC[C@](C)([C@H]1O)C2(C)C Amb27440481 [0,2,0,0,0,0|0,0,2]=4 1183 B14R2.18552 CN[C@@H]1[C@H]2CC[C@](C)([C@@H]1O)C2(C)C Amb27195758 [0,2,0,0,0,0|0,0,2]=4 1184 B14R2.18552 CN[C@H]1C(=O)[C@@]2(C)CC[C@@H]1C2(C)C Amb27866241 [0,2,0,0,0,0|0,0,0]=2 1185 B14R2.18552 CN[C@H]1C(=O)[C@@]2(C)CC[C@H]1C2(C)C Amb27640670 [0,2,0,0,0,0|0,0,0]=2 1186 B14R2.18552 CN[C@H]1[C@@H](O)[C@@]2(C)CC[C@@H]1C2(C)C Amb27788387 [0,2,0,0,0,0|0,0,2]=4 1187 B14R2.18552 CN[C@H]1[C@H]2CC[C@@](C)([C@H]1O)C2(C)C Amb27261576 [0,2,0,0,0,0|0,0,2]=4 1188 B14R2.18552 CN[C@H]1[C@H]2CC[C@](C)([C@H]1O)C2(C)C Amb27467886 [0,2,0,0,0,0|0,0,2]=4 1189 B14R2.18552 CSC1C2CCC(C)(C1O)C2(C)C Amb25352445 [0,2,0,0,0,0|0,0,2]=4 1190 B14R2.18552 C\C=C1/C(=O)C2(C)CCC1C2(C)C Amb17843319 [0,2,0,0,0,0|0,0,1]=3 1191 B14R2.56800 CC1(C)[C@H]2CC[C@@](C)([C@@H]1O)C2(C)C Amb28345392 [0,2,0,0,0,0|0,0,2]=4 1192 B14R2.56800 CC1(O)C2CCC(C)(C1O)C2(C)C Amb28065364 [0,2,0,0,0,0|0,0,2]=4 1193 B14R2.56800 CC12CCC(C(Br)(Br)C1=O)C2(C)C Amb2616296 [0,2,0,0,0,0|0,0,0]=2 1194 B14R2.69067 CC12CCC(Br)(C(Br)C1=O)C2(C)C Amb1268615 [0,2,0,0,0,0|0,0,0]=2 1195 B14R2.69067 CC12CCC(C)(C(=O)C1=O)C2(C)C Amb2807266 [0,2,0,0,0,0|0,0,1]=3 1196 B14R2.69067 CC12CCC(C)(C(O)C1N)C2(C)C Amb28291596 [0,2,0,0,0,0|0,0,2]=4 1197 B14R2.69067 CC1C(O)C2(C)CCC1(C)C2(C)C Amb27397059 [0,2,0,0,0,0|0,0,2]=4 1198 B14R2.86733 CC1(C)C2CCC1(CBr)C(=O)C2=O Amb2459791 [0,2,0,0,0,0|0,0,1]=3 1199 B14R2.86733 CC1(C)C2CCC1(CBr)C(=O)C2Br Amb5716827 [0,2,0,0,0,0|0,0,0]=2 1200 B14R2.86733 CC1(C)[C@@H]2CC[C@@]1(CO)[C@H](O)[C@@H]2O Amb28435805 [0,2,0,0,0,0|0,0,2]=4 1201 B14R2.86733 CCC12CCC(C(O)C1=O)C2(C)C Amb28249068 [0,2,0,0,0,0|0,0,0]=2 1202 B14R2.86733 CCC12CCC(C(O)C1N)C2(C)C Amb27215981 [0,2,0,0,0,0|1,0,1]=4 1203 B14R2.86733 CC[C@]12CC[C@H]([C@@H](O)C1=O)C2(C)C Amb28205983 [0,2,0,0,0,0|0,0,0]=2 1204 B14R2.27846 CC1(C)C2CCC1(C(=O)Cl)C(=O)C2 Amb22357062 [0,2,0,0,0,0|0,0,1]=3 1205 B14R2.27846 CC1(C)C2CCC1(C(=O)O)C(=O)C2 Amb2689055 [0,2,0,0,0,0|0,0,1]=3 1206 B14R2.27846 CC1(C)C2CCC1(C(N)=O)C(=O)C2 Amb2928485 [0,2,0,0,0,0|0,0,1]=3 1207 B14R2.27846 CC1(C)[C@@H]2CC[C@@]1(C(=O)O)C(=O)C2 Amb19883996 [0,2,0,0,0,0|0,0,1]=3 1208 B14R2.27846 CC1(C)[C@H]2CC[C@]1(C(=O)O)C(=O)C2 Amb22744983 [0,2,0,0,0,0|0,0,1]=3 1209 B14R2.27846 CN(C)C12CCC(CC1O)C2(C)C Amb28188259 [0,2,0,0,0,0|0,0,2]=4 1210 B14R2.27846 C[SiH](C)C12CCC(CC1O)C2(C)C Amb28189492 [0,2,0,0,0,0|0,0,2]=4 1211 B14R2.27846 C[SiH](C)[C@@]12CC[C@@H](C[C@@H]1O)C2(C)C Amb27969131 [0,2,0,0,0,0|0,0,2]=4 1212 B14R2.47207 CC1(CBr)C2CCC1(CBr)C(=O)C2 Amb2778580 [0,2,0,0,0,0|0,0,0]=2 1213 B14R2.47207 CC1(CI)C2CCC1(CI)C(=O)C2 Amb2792567 [0,2,0,0,0,0|0,0,0]=2 1214 B14R2.51558 C=C1CC2CCC1(SC#N)C2(C)C Amb27793284 [0,2,0,0,0,0|1,0,1]=4 1215 B14R2.51558 C=C1C[C@@H]2CC[C@@]1(SC#N)C2(C)C Amb26545986 [0,2,0,0,0,0|1,0,1]=4 1216 B14R2.51558 CC1(C)C2CCC1(CCN)C(Cl)C2 Amb27783385 [0,2,0,0,0,0|1,0,1]=4 1217 B14R2.51558 CC1(C)C2CCC1(CCO)C(=O)C2 Amb27169875 [0,2,0,0,0,0|0,0,0]=2 1218 B14R2.51558 CC1(C)C2CCC1(N=C=O)C(=O)C2 Amb25125284 [0,2,0,0,0,0|0,0,1]=3 1219 B14R2.51558 CC1(C)[C@@H]2CC[C@@]1(CC#N)C(=O)C2 Amb28052475 [0,2,0,0,0,0|0,0,0]=2 1220 B14R2.51558 CC1(C)[C@@H]2CC[C@@]1(CCO)C(Cl)C2 Amb27489038 [0,2,0,0,0,0|1,0,1]=4 1221 B14R2.51558 CC1(C)[C@H]2CC[C@@]1(N=C=O)C(=O)C2 Amb28053619 [0,2,0,0,0,0|0,0,1]=3 1222 B14R2.51558 CC1(C)[C@H]2CC[C@]1(CCN)[C@H](Cl)C2 Amb28247152 [0,2,0,0,0,0|1,0,1]=4 1223 B14R2.51558 CC1(C)[C@H]2CC[C@]1(CCO)[C@H](Cl)C2 Amb27427719 [0,2,0,0,0,0|1,0,1]=4 1224 B14R2.51558 CNC[C@]12CC[C@H](C[C@H]1O)C2(C)C Amb27964541 [0,2,0,0,0,0|0,0,2]=4 1225 B14R2.22303 CC1(C(=O)O)[C@H]2CC[C@]1(C)C(=O)C2 Amb27252207 [0,2,0,0,0,0|0,0,1]=3 1226 B14R2.22303 CC12CCC(CC1=O)C2(C)C(=O)O Amb4001767 [0,2,0,0,0,0|0,0,1]=3 1227 B14R2.63454 CC1(CC#N)[C@H]2CC[C@]1(C)C(O)C2 Amb27422428 [0,2,0,0,0,0|0,0,2]=4 1228 B14R2.63454 CC1(CC#N)[C@H]2CC[C@]1(C)[C@@H](O)C2 Amb28064118 [0,2,0,0,0,0|0,0,2]=4 1229 B14R2.63454 CC12CCC(CC1O)C2(C)CC#N Amb27207388 [0,2,0,0,0,0|0,0,2]=4 1230 B14R2.63454 CC12CCC(CC1O)C2(C)CCO Amb27179784 [0,2,0,0,0,0|0,0,2]=4 1231 B14R2.86732 C#CC12CCC(C)(C(=O)C1)C2(C)C Amb27212525 [0,2,0,0,0,0|0,0,0]=2 1232 B14R2.86732 C#CC12CCC(C)(C(O)C1)C2(C)C Amb27853558 [0,2,0,0,0,0|0,0,2]=4 1233 B14R2.86732 C#C[C@]12CC[C@](C)(C(=O)C1)C2(C)C Amb27427678 [0,2,0,0,0,0|0,0,0]=2 1234 B14R2.86732 C=CC12CCC(C)(C(=O)O1)C2(C)C Amb25300479 [0,2,0,0,0,0|1,0,0]=3 1235 B14R2.86732 CC1(C)[C@]2(C)CC[C@@]1(C#N)C[C@@H]2O Amb28318814 [0,2,0,0,0,0|0,0,2]=4 1236 B14R2.86732 CC1(C)[C@]2(C)CC[C@@]1(CO)C[C@@H]2O Amb27197639 [0,2,0,0,0,0|0,0,2]=4 1237 B14R2.86732 CC1(C)[C@]2(C=O)CC[C@@]1(C)C(=O)O2 Amb24631914 [0,2,0,0,0,0|1,0,0]=3 1238 B14R2.86732 CC1(C)[C@]2(CO)CC[C@@]1(C)C(=O)O2 Amb27862376 [0,2,0,0,0,0|1,0,0]=3 1239 B14R2.86732 CC12CCC(C=O)(CC1=O)C2(C)C Amb23452562 [0,2,0,0,0,0|0,0,0]=2 1240 B14R2.86732 CC12CCC(CN)(CC1O)C2(C)C Amb23448463 [0,2,0,0,0,0|0,0,2]=4 1241 B14R2.86732 CC12CCC(CO)(CC1O)C2(C)C Amb23536197 [0,2,0,0,0,0|0,0,2]=4 1242 B14R2.86732 CC12CCC(CO)(OC1=O)C2(C)C Amb2537072 [0,2,0,0,0,0|1,0,0]=3 1243 B14R2.86732 CCC12CCC(C)(C(O)C1)C2(C)C Amb27805291 [0,2,0,0,0,0|0,0,2]=4 1244 B10R0.53 CCC(=O)NC(CBr)C(C)C Amb27670625 [0,0,2,0,0,0|2,0,0]=4 1245 B10R0.53 CCC(=O)NC(CCl)C(C)C Amb27670623 [0,0,2,0,0,0|2,0,0]=4 1246 B10R0.53 CCC(=O)NC(CI)C(C)C Amb27269257 [0,0,2,0,0,0|2,0,0]=4 1247 B10R0.53 CCC(=O)NC(CN)C(C)C Amb27269864 [0,0,2,0,0,0|2,0,0]=4 1248 B10R0.53 CCC(=O)NC(CO)C(C)C Amb17102546 [0,0,2,0,0,0|2,0,0]=4 1249 B10R0.53 CCC(CC(=O)NC)C(C)C Amb27270616 [0,0,2,0,0,0|1,0,0]=3 1250 B10R0.53 CCC(CC(=O)NO)C(C)C Amb27270277 [0,0,2,0,0,0|2,0,0]=4 1251 B10R0.53 CCC(NC(=O)CO)C(C)C Amb28352080 [0,0,2,0,0,0|2,0,0]=4 1252 B10R0.53 CCC(NC(=O)CS)C(C)C Amb27670444 [0,0,2,0,0,0|2,0,0]=4 1253 B10R0.53 CCC(NC(=O)OC)C(C)C Amb28387490 [0,0,2,0,0,0|2,0,0]=4 1254 B10R0.53 COC(=O)CC(CN)C(C)C Amb33474684 [0,0,2,0,0,0|2,0,0]=4 1255 B10R0.57 CC(C)CNC(=O)[C@H](C)CO Amb27673443 [0,0,2,0,0,0|2,0,0]=4 1256 B10R0.57 CCC(Br)C(=O)NCC(C)C Amb27271151 [0,0,2,0,0,0|2,0,0]=4 1257 B10R0.57 CCC(C)C(=O)NCC(C)Br Amb27670616 [0,0,2,0,0,0|2,0,0]=4 1258 B10R0.57 CCC(C)C(=O)NCC(C)Cl Amb27670608 [0,0,2,0,0,0|2,0,0]=4 1259 B10R0.57 CCC(C)C(=O)NCC(C)N Amb27818820 [0,0,2,0,0,0|2,0,0]=4 1260 B10R0.57 CCC(C)C(=O)NC[C@@H](C)O Amb27271261 [0,0,2,0,0,0|2,0,0]=4 1261 B10R0.57 CCC(C)C(=O)NC[C@H](C)O Amb27271252 [0,0,2,0,0,0|2,0,0]=4 1262 B10R0.57 CCC(C)C(=O)OCC(C)Br Amb33276592 [0,0,2,0,0,0|2,0,0]=4 1263 B10R0.57 CCC(C)C(=O)OCC(C)C Amb24074112 [0,0,2,0,0,0|1,0,0]=3 1264 B10R0.57 CCN(C)C(=O)NCC(C)C Amb27269666 [0,0,2,0,0,0|2,0,0]=4 1265 B10R0.57 CC[C@@H](N)C(=O)NCC(C)C Amb27989653 [0,0,2,0,0,0|2,0,0]=4 1266 B10R0.57 COC(C)C(=O)NCC(C)C Amb27986555 [0,0,2,0,0,0|2,0,0]=4 1267 B10R0.57 CON(C)C(=O)CCC(C)C Amb20673763 [0,0,2,0,0,0|2,0,0]=4 1268 B10R0.57 CSC(C)C(=O)NCC(C)C Amb27988931 [0,0,2,0,0,0|2,0,0]=4 1269 B10R0.82 CC(C=O)CCN(C)C(C)C Amb33225678 [0,0,2,0,0,0|1,0,0]=3 1270 B10R0.93 CC(Br)C(=O)NC(C)C(C)C Amb28291234 [0,0,2,0,0,0|2,0,0]=4 1271 B10R0.93 CC(C)C(=O)CC(=O)C(C)C Amb8516603 [0,0,2,0,0,0|1,0,1]=4 1272 B10R0.93 CC(C)C(=O)CC(C)N(C)C Amb28080300 [0,0,2,0,0,0|1,0,0]=3 1273 B10R0.93 CC(C)C(=O)CC(Cl)C(C)C Amb27990095 [0,0,2,0,0,0|1,0,0]=3 1274 B10R0.93 CC(C)C(=O)CC(N)C(C)C Amb27672762 [0,0,2,0,0,0|1,0,0]=3 1275 B10R0.93 CC(C)C(=O)CC(O)C(C)C Amb27672320 [0,0,2,0,0,0|1,0,0]=3 1276 B10R0.93 CC(C)C(=O)CN(C)C(C)C Amb27670353 [0,0,2,0,0,0|1,0,0]=3 1277 B10R0.93 CC(C)C(=O)C[C@H](O)C(C)C Amb27672577 [0,0,2,0,0,0|1,0,0]=3 1278 B10R0.93 CC(C)C(=O)OC(C)C(C)C Amb28351932 [0,0,2,0,0,0|1,0,0]=3 1279 B10R0.93 CC(C)C(C)CC(N)C(C)C Amb28387329 [0,0,2,0,0,0|1,0,1]=4 1280 B10R0.93 CC(C)C(C)OC(=O)[C@@H](C)N Amb27988336 [0,0,2,0,0,0|2,0,0]=4 1281 B10R0.93 CC(C)C(C)OC(=O)[C@H](C)N Amb27988334 [0,0,2,0,0,0|2,0,0]=4 1282 B10R0.93 CC(C)C(N)CS(=O)C(C)C Amb27491914 [0,0,2,0,0,0|2,0,0]=4 1283 B10R0.93 CC(C)C(O)CC(=O)N(C)C Amb26082072 [0,0,2,0,0,0|2,0,0]=4 1284 B10R0.93 CC(C)N(C)CC(=O)N(C)C Amb27270479 [0,0,2,0,0,0|2,0,0]=4 1285 B10R0.93 CC(C)[C@H](C)OC(=O)[C@H](C)N Amb28080469 [0,0,2,0,0,0|2,0,0]=4 1286 B10R0.93 CC(CC(=O)N(C)C)N(C)C Amb32752681 [0,0,2,0,0,0|2,0,0]=4 1287 B10R0.93 CC(N)C(=O)NC(C)C(C)C Amb7797285 [0,0,2,0,0,0|2,0,0]=4 1288 B10R0.93 CC(N)C(=O)OC(C)C(C)C Amb27988335 [0,0,2,0,0,0|2,0,0]=4 1289 B10R0.93 CC(O)C(=O)O[C@@H](C)C(C)C Amb28080031 [0,0,2,0,0,0|2,0,0]=4 1290 B10R0.93 C[C@H](CC(=O)N(C)C)N(C)C Amb32669740 [0,0,2,0,0,0|2,0,0]=4 1291 B10R0.93 C\C(=C/C(=O)C(C)C)C(C)C Amb27267916 [0,0,2,0,0,0|0,0,2]=4 1292 B10R0.98 CC(=O)N(C)CCNC(C)C Amb32696082 [0,0,2,0,0,0|2,0,0]=4 1293 B10R0.98 CC(=O)\C(C)=C/CCC(C)C Amb27673583 [0,0,2,0,0,0|0,0,2]=4 1294 B10R0.98 CC(C)CCCC(C)C(=O)O Amb33358621 [0,0,2,0,0,0|1,0,0]=3 1295 B10R0.98 CC(C)CCCC(N)C(=O)O Amb30584746 [0,0,2,0,0,0|2,0,0]=4 1296 B10R0.98 CC(C)CCCC(N)C(=O)O Amb32679429 [0,0,2,0,0,0|2,0,0]=4 1297 B10R0.98 CC(C)CCCC(N)C(N)=O Amb32796888 [0,0,2,0,0,0|2,0,0]=4 1298 B10R0.98 CC(C)CCC[C@@H](C)C(=O)O Amb33727257 [0,0,2,0,0,0|1,0,0]=3 1299 B10R0.98 CC(C)CCC[C@@H](N)C(=O)O Amb22745714 [0,0,2,0,0,0|2,0,0]=4 1300 B10R0.98 CC(C)CCC[C@H](C)C(=O)O Amb33744631 [0,0,2,0,0,0|1,0,0]=3 1301 B10R0.98 CC(C)CCC[C@H](N)C(=O)O Amb34161240 [0,0,2,0,0,0|2,0,0]=4 1302 B10R0.98 CC(C)CCNC(C)C(=O)O Amb10609116 [0,0,2,0,0,0|2,0,0]=4 1303 B10R0.98 CC(C)CCNC(C)C(=O)O Amb1109923 [0,0,2,0,0,0|2,0,0]=4 1304 B10R0.98 CC(C)CCOC(C)C(=O)O Amb9728095 [0,0,2,0,0,0|2,0,0]=4 1305 B10R0.98 CC(C)CCSC(C)C(=O)O Amb6265720 [0,0,2,0,0,0|2,0,0]=4 1306 B10R0.98 CC(C)OCCC(C)C(=O)O Amb18792223 [0,0,2,0,0,0|2,0,0]=4 1307 B10R0.98 CC(CCCN(C)C)C(=O)O Amb33359292 [0,0,2,0,0,0|2,0,0]=4 1308 B10R0.98 CC(N)CCCC(C)C(=O)O Amb19337779 [0,0,2,0,0,0|2,0,0]=4 1309 B10R0.98 CC(N)CCCC(C)C(=O)O Amb22059651 [0,0,2,0,0,0|2,0,0]=4 1310 B10R0.36 C=C(C)C(C)(C)C(=O)CCC Amb27673787 [0,0,2,0,0,0|0,0,2]=4 1311 B10R0.36 CCCC(=O)C(C)(C)C(C)=O Amb28080137 [0,0,2,0,0,0|1,0,1]=4 1312 B10R0.36 CCNC(=O)C(C)(O)C(C)C Amb28349635 [0,0,2,0,0,0|2,0,0]=4 1313 B10R0.36 CCNC(=O)[C@@](C)(N)C(C)C Amb27877949 [0,0,2,0,0,0|2,0,0]=4 1314 B10R0.36 CCOC(=O)C(C)(C)C(C)N Amb24766789 [0,0,2,0,0,0|2,0,0]=4 1315 B10R0.36 CCOC(=O)C(C)(C)C(C)O Amb17615306 [0,0,2,0,0,0|2,0,0]=4 1316 B10R0.36 CCOC(=O)C(C)(N)C(C)C Amb18310631 [0,0,2,0,0,0|2,0,0]=4 1317 B10R0.36 CCOC(=O)C(C)(N)C(C)C Amb19374500 [0,0,2,0,0,0|2,0,0]=4 1318 B10R0.36 CCOC(=O)[C@@](C)(N)C(C)C Amb31295531 [0,0,2,0,0,0|2,0,0]=4 1319 B10R0.36 CCOC(=O)[C@@](C)(N)C(C)C Amb35788382 [0,0,2,0,0,0|2,0,0]=4 1320 B10R0.36 COCC(=O)C(C)(C)N(C)C Amb27987796 [0,0,2,0,0,0|2,0,0]=4 1321 B10R0.36 CONC(=O)C(C)(C)C(C)C Amb27804935 [0,0,2,0,0,0|2,0,0]=4 1322 B10R0.75 CC(C)N(C)CCCCC=O Amb33273325 [0,0,2,0,0,0|1,0,0]=3 1323 B10R0.81 C#CCCC(=O)C(C)C(C)C Amb27270090 [0,0,2,0,0,0|0,0,2]=4 1324 B10R0.81 CC(C)C(C)C(=O)CCC#N Amb28387323 [0,0,2,0,0,0|1,0,1]=4 1325 B10R0.81 CC(C)C(C)C(=O)NCCF Amb28326536 [0,0,2,0,0,0|2,0,0]=4 1326 B10R0.81 CC(C)C(C)C(=O)NCCI Amb27988415 [0,0,2,0,0,0|2,0,0]=4 1327 B10R0.81 CC(C)C(C)C(=O)NCCO Amb27492168 [0,0,2,0,0,0|2,0,0]=4 1328 B10R0.81 CC(C)C(C)C(=O)OCCBr Amb33051937 [0,0,2,0,0,0|2,0,0]=4 1329 B10R0.81 CCCNC(=O)C(Br)C(C)C Amb6244897 [0,0,2,0,0,0|2,0,0]=4 1330 B10R0.81 CCCNC(=O)C(C)C(C)C Amb27272579 [0,0,2,0,0,0|1,0,0]=3 1331 B10R0.81 CCCNC(=O)C(C)N(C)C Amb27986511 [0,0,2,0,0,0|2,0,0]=4 1332 B10R0.81 CCCNC(=O)C(Cl)C(C)C Amb18809030 [0,0,2,0,0,0|2,0,0]=4 1333 B10R0.81 CCCNC(=O)C(F)C(C)C Amb27272102 [0,0,2,0,0,0|2,0,0]=4 1334 B10R0.81 CCCNC(=O)C(S)C(C)C Amb27989869 [0,0,2,0,0,0|2,0,0]=4 1335 B10R0.81 CCCNC(=O)N(C)C(C)C Amb28387573 [0,0,2,0,0,0|2,0,0]=4 1336 B10R0.81 CCCNC(=O)[C@@H](N)C(C)C Amb5783391 [0,0,2,0,0,0|2,0,0]=4 1337 B10R0.81 CCCNC(=O)[C@@H](O)C(C)C Amb28387217 [0,0,2,0,0,0|2,0,0]=4 1338 B10R0.81 CCCNC(=O)[C@H](C)N(C)C Amb27818142 [0,0,2,0,0,0|2,0,0]=4 1339 B10R0.81 CCCNC(=O)[C@H](N)C(C)C Amb18527986 [0,0,2,0,0,0|2,0,0]=4 1340 B10R0.81 CCCNC(=O)[C@H](O)C(C)C Amb28387219 [0,0,2,0,0,0|2,0,0]=4 1341 B10R0.81 CCCOC(=O)[C@@H](N)C(C)C Amb33042678 [0,0,2,0,0,0|2,0,0]=4 1342 B10R0.81 CCCOC(=O)[C@@H](N)C(C)C Amb33295352 [0,0,2,0,0,0|2,0,0]=4 1343 B10R0.81 CCONC(=O)C(C)C(C)C Amb27987613 [0,0,2,0,0,0|2,0,0]=4 1344 B10R0.104 CCCC(C)(C)C(N)C(=O)O Amb26659761 [0,0,2,0,0,0|2,0,0]=4 1345 B10R0.104 CCCC(C)(C)C(O)C(=O)O Amb25385207 [0,0,2,0,0,0|2,0,0]=4 1346 B10R0.104 CCCC(C)(N)C(C)C(=O)O Amb33036373 [0,0,2,0,0,0|2,0,0]=4 1347 B10R0.104 CCCC(C)(O)C(C)C(=O)O Amb19022360 [0,0,2,0,0,0|2,0,0]=4 1348 B10R0.104 COCC(C)(C)C(C)C(=O)O Amb33727405 [0,0,2,0,0,0|2,0,0]=4 1349 B10R0.104 COCC(C)(C)N(C)C(C)=O Amb27988240 [0,0,2,0,0,0|2,0,0]=4 1350 B10R0.104 COCC(C)(C)[C@@H](C)C(=O)O Amb33729111 [0,0,2,0,0,0|2,0,0]=4 1351 B10R0.104 COCC(C)(C)[C@H](C)C(=O)O Amb33728821 [0,0,2,0,0,0|2,0,0]=4 1352 B10R0.66 CC(C)(CO)C(C)(C)C(=O)O Amb33200332 [0,0,2,0,0,0|2,0,0]=4 1353 B10R0.66 CCC(C)(C)C(C)(C)C(=O)O Amb24563344 [0,0,2,0,0,0|1,0,0]=3 1354 B10R0.66 CCC(C)(N)C(C)(C)C(=O)O Amb33036346 [0,0,2,0,0,0|2,0,0]=4 1355 B10R0.66 CCC(C)(O)C(C)(C)C(=O)O Amb18990661 [0,0,2,0,0,0|2,0,0]=4 1356 B10R0.66 CCC(F)(F)C(C)(C)C(C)=O Amb35609080 [0,0,2,0,0,0|2,0,0]=4 1357 B10R0.133 CCCCC(C)(CBr)C(C)C Amb32688657 [0,0,2,0,0,0|1,0,1]=4 1358 B10R0.133 CCCCC(C)(CCl)C(C)C Amb32688652 [0,0,2,0,0,0|1,0,1]=4 1359 B10R0.137 CCC(=O)C(C)(CC)C(C)=O Amb27672697 [0,0,2,0,0,0|1,0,1]=4 1360 B10R0.137 CCC(C)(C(=O)OC)N(C)C Amb8455393 [0,0,2,0,0,0|2,0,0]=4 1361 B10R0.149 CC(C)C(C)(CCF)C(=O)O Amb27818601 [0,0,2,0,0,0|2,0,0]=4 1362 B10R0.149 CC(C)C(C)(CCO)C(=O)O Amb27818599 [0,0,2,0,0,0|2,0,0]=4 1363 B10R0.149 CCCC(C)(C(=O)O)C(C)C Amb28080680 [0,0,2,0,0,0|1,0,0]=3 1364 B10R0.149 CCCC(C)(C(=O)O)C(C)O Amb27990209 [0,0,2,0,0,0|2,0,0]=4 1365 B10R0.149 CCCC(C)(C(=O)O)N(C)C Amb9669708 [0,0,2,0,0,0|2,0,0]=4 1366 B10R0.149 CCCC(C)(C(N)=O)N(C)C Amb24116805 [0,0,2,0,0,0|2,0,0]=4 1367 B10R0.149 CCCC(O)(C(=O)O)C(C)C Amb18199843 [0,0,2,0,0,0|2,0,0]=4 1368 B10R0.149 CCOC(C)(C(=O)O)C(C)C Amb27271171 [0,0,2,0,0,0|2,0,0]=4 1369 B10R0.149 CCOC(C)(C(C)=O)C(C)C Amb27271176 [0,0,2,0,0,0|1,0,0]=3 1370 B10R0.149 COCC(C)(C(=O)O)C(C)C Amb27491886 [0,0,2,0,0,0|2,0,0]=4 1371 B10R0.173 C=C(C)C(C)(CO)C(C)(C)C Amb28345443 [0,0,2,0,0,0|2,0,0]=4 1372 B10R0.173 C=C(C)C(O)(CC)C(C)(C)C Amb27811285 [0,0,2,0,0,0|2,0,0]=4 1373 B10R0.173 CC(C)(C)C(C)(CN)C(=O)O Amb27209657 [0,0,2,0,0,0|2,0,0]=4 1374 B10R0.173 CC(C)(C)C(C)(CN)C(N)=O Amb27438467 [0,0,2,0,0,0|2,0,0]=4 1375 B10R0.173 CCC(C)(C(=O)O)C(C)(C)C Amb18645097 [0,0,2,0,0,0|1,0,0]=3 1376 B10R0.173 CCC(C)(C(=O)O)C(C)(C)O Amb32948533 [0,0,2,0,0,0|2,0,0]=4 1377 B10R0.173 CCC(N)(C(=O)O)C(C)(C)C Amb25871496 [0,0,2,0,0,0|2,0,0]=4 1378 B10R0.173 CCC(O)(C(=O)O)C(C)(C)C Amb26049838 [0,0,2,0,0,0|2,0,0]=4 1379 B10R0.173 CCC(O)(C(N)=O)C(C)(C)C Amb27481532 [0,0,2,0,0,0|2,0,0]=4 1380 B10R0.173 CNC(C)(C(=O)O)C(C)(C)C Amb25032546 [0,0,2,0,0,0|2,0,0]=4 1381 B12R2.124 O=C1OC2CCC1CCC2O Amb27603946 [0,0,1,1,0,0|2,0,0]=4 1382 B12R2.598 CC1CCC2CC1SC2(C)C Amb17672847 [0,0,1,1,0,0|0,1,1]=4 1383 B12R2.598 C[C@H]1CC[C@@H]2C[C@H]1SC2(C)C Amb24686348 [0,0,1,1,0,0|0,1,1]=4 1384 B12R2.613 CC1CCC2C(O)CC2C1=O Amb28285941 [0,0,1,1,0,0|1,0,0]=3 1385 B12R2.788 C=C(C)[C@@H]1CC(=O)[C@@]2(C)C[C@@H]12 Amb27861443 [0,0,1,1,0,0|0,0,2]=4 1386 B12R2.788 C=C(C)[C@@H]1CC(=O)[C@]2(C)C[C@H]12 Amb27861487 [0,0,1,1,0,0|0,0,2]=4 1387 B12R2.788 CC(C)C1=CC(=O)C2(C)CC12 Amb24737464 [0,0,1,1,0,0|0,0,2]=4 1388 B12R2.1040 CC1(C)CC2CCC1CC2=O Amb28200021 [0,0,1,1,0,0|0,0,0]=2 1389 B12R2.1040 CC1(C)CC2CCC1CC2O Amb27219665 [0,0,1,1,0,0|0,0,2]=4 1390 B12R2.1040 CC1(C)C[C@H]2CC[C@@H]1C[C@@H]2O Amb27260231 [0,0,1,1,0,0|0,0,2]=4 1391 B12R2.1046 C=C(C)C12CC(=O)C(C)C1C2 Amb27408540 [0,0,1,1,0,0|0,0,2]=4 1392 B12R2.1046 C=C(C)[C@@]12CC(=O)[C@H](C)[C@H]1C2 Amb27970135 [0,0,1,1,0,0|0,0,2]=4 1393 B12R2.1046 C=C(C)[C@]12CC(=O)[C@@H](C)[C@H]1C2 Amb26598475 [0,0,1,1,0,0|0,0,2]=4 1394 B12R2.1046 C=C(C)[C@]12CC(=O)[C@H](C)[C@@H]1C2 Amb27261960 [0,0,1,1,0,0|0,0,2]=4 1395 B12R2.1046 C=C(C)[C@]12CC(=O)[C@H](C)[C@H]1C2 Amb27212499 [0,0,1,1,0,0|0,0,2]=4 1396 B12R2.1046 C=C1C(=O)CC2(C(C)C)CC12 Amb27176610 [0,0,1,1,0,0|0,0,2]=4 1397 B12R2.1046 C=C1C(=O)C[C@@]2(C(C)C)CC12 Amb28322729 [0,0,1,1,0,0|0,0,2]=4 1398 B12R2.1046 C=C1C(=O)C[C@]2(C(C)C)CC12 Amb25151599 [0,0,1,1,0,0|0,0,2]=4 1399 B12R2.1046 C=C1C(=O)C[C@]2(C(C)C)C[C@H]12 Amb27251575 [0,0,1,1,0,0|0,0,2]=4 1400 B12R2.1046 CC(=O)[C@]12CC(=O)C(C)C1C2 Amb27972915 [0,0,1,1,0,0|1,0,1]=4 1401 B12R2.1046 CC(C)C12CC(=O)C(=O)C1C2 Amb27184125 [0,0,1,1,0,0|1,0,1]=4 1402 B12R2.1046 CC(C)C12CC(=O)[C@@H](C)C1C2 Amb27409568 [0,0,1,1,0,0|0,0,0]=2 1403 B12R2.1046 CC(C)[C@@]12CC(=O)[C@@H](C)[C@@H]1C2 Amb28052394 [0,0,1,1,0,0|0,0,0]=2 1404 B12R2.1046 CC(C)[C@@]12CC(=O)[C@H](C)[C@@H]1C2 Amb27211940 [0,0,1,1,0,0|0,0,0]=2 1405 B12R2.1046 CC(C)[C@@]12C[C@H](O)[C@H](C)[C@@H]1C2 Amb28138687 [0,0,1,1,0,0|0,0,2]=4 1406 B12R2.1046 CC(C)[C@]12CC(=O)[C@@H](C)C1C2 Amb28202163 [0,0,1,1,0,0|0,0,0]=2 1407 B12R2.1046 CC(C)[C@]12CC(=O)[C@@H](C)[C@H]1C2 Amb2404786 [0,0,1,1,0,0|0,0,0]=2 1408 B12R2.1046 CC(C)[C@]12CC(=O)[C@H](C)[C@H]1C2 Amb10844718 [0,0,1,1,0,0|0,0,0]=2 1409 B12R2.1046 CC(C)[C@]12C[C@@H](N)[C@H](C)[C@H]1C2 Amb27434419 [0,0,1,1,0,0|1,0,1]=4 1410 B12R2.1046 CC(C)[C@]12C[C@H](Cl)[C@@H](C)[C@H]1C2 Amb27477921 [0,0,1,1,0,0|1,0,1]=4 1411 B12R2.1046 CC(C)[C@]12C[C@H](N)[C@@H](C)[C@H]1C2 Amb27486048 [0,0,1,1,0,0|1,0,1]=4 1412 B12R2.1046 CC(C)[C@]12C[C@H](O)[C@@H](C)[C@H]1C2 Amb28249166 [0,0,1,1,0,0|0,0,2]=4 1413 B12R2.1046 CC1C(=O)C[C@@]2(C(C)C)C[C@@H]12 Amb27212041 [0,0,1,1,0,0|0,0,0]=2 1414 B12R2.1046 CC1C(=O)C[C@]2(C(C)C)CC12 Amb24122655 [0,0,1,1,0,0|0,0,0]=2 1415 B12R2.1046 CC1C(=O)C[C@]2(C(C)C)C[C@H]12 Amb22337959 [0,0,1,1,0,0|0,0,0]=2 1416 B12R2.1046 CC1C(Cl)CC2(C(C)C)CC12 Amb27827982 [0,0,1,1,0,0|1,0,1]=4 1417 B12R2.1046 CC1C(O)CC2(C(C)C)CC12 Amb25149678 [0,0,1,1,0,0|0,0,2]=4 1418 B12R2.1136 C[C@@H]1C(=O)C[C@H]2C[C@@H]1CC2=O Amb28057543 [0,0,1,1,0,0|1,0,1]=4 1419 B12R2.1202 CC1CCC2(C(C)C)CC12O Amb31031226 [0,0,1,1,0,0|0,0,2]=4 1420 B12R2.2426 CC12CCC(CC1=O)C(=O)C2 Amb28285821 [0,0,1,1,0,0|1,0,1]=4 1421 B12R2.2426 CC1=C[C@]2(C)CC[C@H]1CC2=O Amb27198924 [0,0,1,1,0,0|0,0,2]=4 1422 B12R2.2426 CC1OC2(C)CCC1CC2=O Amb27234543 [0,0,1,1,0,0|1,0,0]=3 1423 B12R2.2824 CC(=O)C12CCC(C1)C(=O)C2 Amb27974450 [0,0,1,1,0,0|1,0,1]=4 1424 B12R2.2863 B[C@H]1C[C@H]2C[C@@H]([C@@H]1C)C2(C)C Amb27818061 [0,0,1,1,0,0|1,0,1]=4 1425 B12R2.2863 C=C1C(=O)CC2CC1C2(C)C Amb4092756 [0,0,1,1,0,0|0,0,2]=4 1426 B12R2.2863 C=C1C(=O)C[C@@H]2C[C@H]1C2(C)C Amb27227077 [0,0,1,1,0,0|0,0,2]=4 1427 B12R2.2863 C=C1C(=O)C[C@H]2C[C@@H]1C2(C)C Amb26546466 [0,0,1,1,0,0|0,0,2]=4 1428 B12R2.2863 C=C1CC2CC(C1O)C2(C)C Amb27651558 [0,0,1,1,0,0|2,0,0]=4 1429 B12R2.2863 CC1(C)C2CC(=O)C(Br)C1C2 Amb27827847 [0,0,1,1,0,0|1,0,0]=3 1430 B12R2.2863 CC1(C)[C@@H]2CC(=O)[C@@H](Br)[C@H]1C2 Amb28202623 [0,0,1,1,0,0|1,0,0]=3 1431 B12R2.2863 CC1(C)[C@H]2CC(=O)C(O)[C@@H]1C2 Amb27785502 [0,0,1,1,0,0|1,0,0]=3 1432 B12R2.2863 CC1C(=O)CC2CC1C2(C)C Amb26476721 [0,0,1,1,0,0|0,0,0]=2 1433 B12R2.2863 CC1C(Cl)CC2CC1C2(C)C Amb28291600 [0,0,1,1,0,0|1,0,1]=4 1434 B12R2.2863 CC1C(N)CC2CC1C2(C)C Amb4036819 [0,0,1,1,0,0|1,0,1]=4 1435 B12R2.2863 CC1C(O)CC2CC1C2(C)C Amb6608874 [0,0,1,1,0,0|0,0,2]=4 1436 B12R2.2863 C[C@@H]1C(=O)C[C@H]2C[C@@H]1C2(C)C Amb25987780 [0,0,1,1,0,0|0,0,0]=2 1437 B12R2.2863 C[C@@H]1C(O)C[C@H]2C[C@@H]1C2(C)C Amb27431375 [0,0,1,1,0,0|0,0,2]=4 1438 B12R2.2863 C[C@@H]1[C@@H](O)C[C@@H]2C[C@H]1C2(C)C Amb27635242 [0,0,1,1,0,0|0,0,2]=4 1439 B12R2.2863 C[C@@H]1[C@@H](O)C[C@H]2C[C@H]1C2(C)C Amb24620904 [0,0,1,1,0,0|0,0,2]=4 1440 B12R2.2863 C[C@@H]1[C@H](N)C[C@@H]2C[C@H]1C2(C)C Amb27657572 [0,0,1,1,0,0|1,0,1]=4 1441 B12R2.2863 C[C@@H]1[C@H](O)C[C@@H]2C[C@H]1C2(C)C Amb27440194 [0,0,1,1,0,0|0,0,2]=4 1442 B12R2.2863 C[C@@H]1[C@H](O)C[C@H]2C[C@H]1C2(C)C Amb26453371 [0,0,1,1,0,0|0,0,2]=4 1443 B12R2.2863 C[C@H]1C(=O)CC2CC1C2(C)C Amb27212507 [0,0,1,1,0,0|0,0,0]=2 1444 B12R2.2863 C[C@H]1C(=O)C[C@@H]2C[C@H]1C2(C)C Amb26427194 [0,0,1,1,0,0|0,0,0]=2 1445 B12R2.2863 C[C@H]1C(=O)C[C@H]2C[C@@H]1C2(C)C Amb27211978 [0,0,1,1,0,0|0,0,0]=2 1446 B12R2.2863 C[C@H]1C(O)C[C@@H]2C[C@H]1C2(C)C Amb27438746 [0,0,1,1,0,0|0,0,2]=4 1447 B12R2.2863 C[C@H]1[C@@H](Cl)C[C@@H]2C[C@H]1C2(C)C Amb27433949 [0,0,1,1,0,0|1,0,1]=4 1448 B12R2.2863 C[C@H]1[C@@H](O)C[C@@H]2C[C@H]1C2(C)C Amb27427914 [0,0,1,1,0,0|0,0,2]=4 1449 B12R2.2863 C[C@H]1[C@@H]2C[C@H](C[C@H]1O)C2(C)C Amb27446532 [0,0,1,1,0,0|0,0,2]=4 1450 B12R2.2863 C[C@H]1[C@H](N)C[C@@H]2C[C@H]1C2(C)C Amb3941706 [0,0,1,1,0,0|1,0,1]=4 1451 B12R2.2863 C[C@H]1[C@H](O)C[C@@H]2C[C@H]1C2(C)C Amb4605939 [0,0,1,1,0,0|0,0,2]=4 1452 B12R2.2953 C=C1CCC2C(C1=O)C2(C)C Amb27945678 [0,0,1,1,0,0|0,0,2]=4 1453 B12R2.2953 C[C@@H]1CC[C@@H]2[C@H]([C@@H]1O)C2(C)C Amb28053462 [0,0,1,1,0,0|0,0,2]=4 1454 B12R2.2953 C[C@@H]1CC[C@@H]2[C@H]([C@H]1N)C2(C)C Amb28194874 [0,0,1,1,0,0|1,0,1]=4 1455 B12R2.2953 C[C@@H]1CC[C@@H]2[C@H]([C@H]1O)C2(C)C Amb28076968 [0,0,1,1,0,0|0,0,2]=4 1456 B12R2.2953 C[C@H]1CC[C@@H]2[C@H](C1=O)C2(C)C Amb28052158 [0,0,1,1,0,0|0,0,0]=2 1457 B12R2.2953 C[C@H]1CC[C@@H]2[C@H]([C@@H]1N)C2(C)C Amb27232996 [0,0,1,1,0,0|1,0,1]=4 1458 B12R2.2953 C[C@H]1CC[C@H]2[C@@H]([C@@H]1N)C2(C)C Amb27781451 [0,0,1,1,0,0|1,0,1]=4 1459 B12R2.2953 C[C@H]1CC[C@H]2[C@@H]([C@@H]1O)C2(C)C Amb27639305 [0,0,1,1,0,0|0,0,2]=4 1460 B12R2.3180 CC(C)[C@@H]1CCC2(C)OC2C1 Amb26872667 [0,0,1,1,0,0|0,0,2]=4 1461 B12R2.3180 CC(C)[C@H]1CC[C@@]2(C)O[C@H]2C1 Amb27476016 [0,0,1,1,0,0|0,0,2]=4 1462 B12R2.3906 C=C1CC2C(CC1O)C2(C)C Amb27873201 [0,0,1,1,0,0|2,0,0]=4 1463 B12R2.3906 C=C1CC2C(C[C@H]1Cl)C2(C)C Amb28342220 [0,0,1,1,0,0|2,0,0]=4 1464 B12R2.3906 C=C1C[C@@H]2[C@H](C[C@@H]1O)C2(C)C Amb28205969 [0,0,1,1,0,0|2,0,0]=4 1465 B12R2.3906 C=C1C[C@@H]2[C@H](C[C@H]1O)C2(C)C Amb27775454 [0,0,1,1,0,0|2,0,0]=4 1466 B12R2.3906 C=C1C[C@H]2[C@@H](CC1=O)C2(C)C Amb28247990 [0,0,1,1,0,0|0,0,2]=4 1467 B12R2.3906 C=C1C[C@H]2[C@@H](C[C@@H]1O)C2(C)C Amb28195208 [0,0,1,1,0,0|2,0,0]=4 1468 B12R2.3906 C=C1C[C@H]2[C@@H](C[C@H]1N)C2(C)C Amb27851405 [0,0,1,1,0,0|2,0,0]=4 1469 B12R2.3906 CC1=C(C)CC2C(C1)C2(C)C Amb28142995 [0,0,1,1,0,0|1,0,1]=4 1470 B12R2.3906 CC1=C[C@H]2[C@@H](CC1=O)C2(C)C Amb27785463 [0,0,1,1,0,0|0,0,2]=4 1471 B12R2.3906 CC1CC2C(CC1Cl)C2(C)C Amb27875210 [0,0,1,1,0,0|1,0,1]=4 1472 B12R2.3906 CC1CC2C(CC1N)C2(C)C Amb24375415 [0,0,1,1,0,0|1,0,1]=4 1473 B12R2.3906 CC1CC2C(CC1O)C2(C)C Amb25258847 [0,0,1,1,0,0|0,0,2]=4 1474 B12R2.3906 CC1C[C@H]2[C@@H](CC1=O)C2(C)C Amb27447280 [0,0,1,1,0,0|0,0,0]=2 1475 B12R2.3906 C[C@@H]1CC2C(C[C@H]1O)C2(C)C Amb27208092 [0,0,1,1,0,0|0,0,2]=4 1476 B12R2.3906 C[C@@H]1C[C@H]2[C@@H](C[C@@H]1Cl)C2(C)C Amb28062792 [0,0,1,1,0,0|1,0,1]=4 1477 B12R2.3906 C[C@@H]1C[C@H]2[C@@H](C[C@@H]1N)C2(C)C Amb28195312 [0,0,1,1,0,0|1,0,1]=4 1478 B12R2.3906 C[C@@H]1C[C@H]2[C@@H](C[C@@H]1O)C2(C)C Amb27422288 [0,0,1,1,0,0|0,0,2]=4 1479 B12R2.3906 C[C@@H]1C[C@H]2[C@@H](C[C@H]1N)C2(C)C Amb27845487 [0,0,1,1,0,0|1,0,1]=4 1480 B12R2.3906 C[C@H]1C[C@@H]2[C@H](CC1=O)C2(C)C Amb27844187 [0,0,1,1,0,0|0,0,0]=2 1481 B12R2.3906 C[C@H]1C[C@@H]2[C@H](C[C@@H]1O)C2(C)C Amb27969791 [0,0,1,1,0,0|0,0,2]=4 1482 B12R2.3906 C[C@H]1C[C@@H]2[C@H](C[C@H]1O)C2(C)C Amb27422344 [0,0,1,1,0,0|0,0,2]=4 1483 B12R2.3906 C[C@H]1C[C@H]2[C@@H](C[C@@H]1O)C2(C)C Amb27801549 [0,0,1,1,0,0|0,0,2]=4 1484 B12R2.3906 C[C@H]1C[C@H]2[C@@H](C[C@H]1O)C2(C)C Amb27653180 [0,0,1,1,0,0|0,0,2]=4 1485 B12R2.5119 CC1CCC2CC1(S)C2(C)C Amb22231392 [0,0,1,1,0,0|0,1,1]=4 1486 B12R2.1140 CP1(=O)C2CCC1CC(=O)C2 Amb28321888 [0,0,1,1,0,0|2,0,0]=4 1487 B12R2.1140 CP1(=O)[C@H]2CC[C@@H]1CC(=O)C2 Amb27823419 [0,0,1,1,0,0|2,0,0]=4 1488 B12R2.1140 C[N+]1(C)C2CCC1CC(=O)C2 Amb25702468 [0,0,1,1,0,0|1,0,0]=3 1489 B12R2.1146 CC1C2CC(CC2O)C1(C)C Amb27396915 [0,0,1,1,0,0|0,0,2]=4 1490 B12R2.1146 CC1[C@H]2C[C@H](CC2=O)C1(C)C Amb26627941 [0,0,1,1,0,0|0,0,0]=2 1491 B12R2.1146 C[C@@H]1[C@@H]2C[C@H](CC2=O)C1(C)C Amb27437298 [0,0,1,1,0,0|0,0,0]=2 1492 B12R2.1146 C[C@@H]1[C@H]2C[C@H](C[C@H]2O)C1(C)C Amb27222296 [0,0,1,1,0,0|0,0,2]=4 1493 B12R2.1146 C[C@H]1C2CC(C[C@H]2O)C1(C)C Amb27422356 [0,0,1,1,0,0|0,0,2]=4 1494 B12R2.1146 C[C@H]1[C@H]2C[C@@H](C[C@H]2O)C1(C)C Amb27255198 [0,0,1,1,0,0|0,0,2]=4 1495 B12R2.1146 C[C@H]1[C@H]2C[C@H](C[C@H]2O)C1(C)C Amb27422357 [0,0,1,1,0,0|0,0,2]=4 1496 B12R2.1146 C[C@]1(O)[C@@H](O)[C@H]2C[C@@H]1CC2=O Amb28253951 [0,0,1,1,0,0|2,0,0]=4 1497 B12R2.2023 C[C@@H]1[C@@H]2C[C@@H](CCN2)C1(C)C Amb28057565 [0,0,1,1,0,0|1,0,1]=4 1498 B12R2.2486 CC12CC(=O)CC1CCC2=O Amb27164681 [0,0,1,1,0,0|1,0,1]=4 1499 B12R2.2486 CC12CC(=O)OC1CCC2O Amb27977953 [0,0,1,1,0,0|2,0,0]=4 1500 B12R2.2486 C[C@]12CC(=O)C[C@H]1CCC2=O Amb28351553 [0,0,1,1,0,0|1,0,1]=4 1501 B12R2.2486 C[C@]12CC(=O)O[C@H]1CC[C@H]2Cl Amb28244790 [0,0,1,1,0,0|2,0,0]=4 1502 B12R2.2486 C[C@]12CC(=O)O[C@H]1CC[C@H]2O Amb27220208 [0,0,1,1,0,0|2,0,0]=4 1503 B12R2.5952 CC1(C)[C@@H]2CC[C@@]1(C)CNC2 Amb25919341 [0,0,1,1,0,0|2,0,0]=4 1504 B12R2.5952 CC1(C)[C@@H]2CC[C@@]1(C)CNC2 Amb33457877 [0,0,1,1,0,0|2,0,0]=4 1505 B12R2.5952 CC1(C)[C@@H]2CC[C@]1(C)CNC2 Amb28429513 [0,0,1,1,0,0|2,0,0]=4 1506 B12R2.5952 CC1(C)[C@H]2CC[C@]1(C)CNC2 Amb26530919 [0,0,1,1,0,0|2,0,0]=4 1507 B12R2.5952 CC1(C)[C@H]2CC[C@]1(C)CNC2 Amb33328676 [0,0,1,1,0,0|2,0,0]=4 1508 B12R2.5952 CC12CCC(CCN1)C2(C)C Amb18125622 [0,0,1,1,0,0|1,0,1]=4 1509 B12R2.5952 CC12CCC(CNC1)C2(C)C Amb10610385 [0,0,1,1,0,0|2,0,0]=4 1510 B12R2.5952 CC12CCC(CNC1)C2(C)C Amb9782123 [0,0,1,1,0,0|2,0,0]=4 1511 B12R2.5952 CC12CC[C@H](CCN1)C2(C)C Amb28143799 [0,0,1,1,0,0|1,0,1]=4 1512 B12R2.208 CC1C(=O)C=C2CCCC21C Amb28200063 [0,0,1,1,0,0|0,0,2]=4 1513 B12R2.509 CC1C2(N)CCC(C2)C1(C)C Amb23448466 [0,0,1,1,0,0|1,0,1]=4 1514 B12R2.509 C[C@H]1C(C)(C)[C@H]2CC[C@]1(N)C2 Amb27643364 [0,0,1,1,0,0|1,0,1]=4 1515 B12R2.4920 C[C@]12CC[C@H]1C(=O)O[C@@H]2CO Amb27436945 [0,0,1,1,0,0|2,0,0]=4 1516 B12R2.86 CC1CCC12NCCNC2=O Amb28365661 [0,0,1,1,0,0|2,0,0]=4 1517 B12R2.1096 CC(O)C12OC1CCCC2=O Amb28253905 [0,0,1,1,0,0|2,0,0]=4 1518 B12R2.2351 O=C1CCCCC1(O)C2CC2 Amb28069036 [0,0,1,1,0,0|1,0,0]=3 1519 B12R2.2352 CC1(C)C[C@@]12CCCCC2=O Amb27262972 [0,0,1,1,0,0|0,0,0]=2 1520 B12R2.2427 CC(C)C12CCC(CC1=O)C2 Amb27953866 [0,0,1,1,0,0|0,0,0]=2 1521 B12R2.2794 CC12CCCC(CC1=O)C2=O Amb25048685 [0,0,1,1,0,0|1,0,1]=4 1522 B12R2.2794 C[C@@]12CCC[C@@H](CC1=O)C2=O Amb27970140 [0,0,1,1,0,0|1,0,1]=4 1523 B12R2.2933 CC12CCCC1(O)OCC2=O Amb28386586 [0,0,1,1,0,0|2,0,0]=4 1524 B12R2.2933 O=C1CC[C@@]2(O)CCC[C@@]12O Amb27434276 [0,0,1,1,0,0|2,0,0]=4 1525 B12R2.3917 CC1CC12C(=O)CCC2(C)O Amb27948697 [0,0,1,1,0,0|1,0,0]=3 1526 B12R2.3917 C[C@@H]1C[C@]12C(=O)CC[C@]2(C)O Amb28253860 [0,0,1,1,0,0|1,0,0]=3 1527 B12R2.3917 C[C@H]1C[C@]12C(=O)CC[C@]2(C)O Amb28052525 [0,0,1,1,0,0|1,0,0]=3 1528 B12R2.1166 CC12CCC(=O)C1(C)CC2=O Amb27226998 [0,0,1,1,0,0|1,0,1]=4 1529 B12R2.1063 CC1(C)CC2CC(=O)C1(C)C2 Amb28200071 [0,0,1,1,0,0|0,0,0]=2 1530 B12R2.3091 CC1(C)OCC2CC21C(=O)O Amb28722505 [0,0,1,1,0,0|2,0,0]=4 1531 B12R2.3092 CC(O)C12CCC(C1)C2(C)C Amb28069493 [0,0,1,1,0,0|0,0,2]=4 1532 B12R2.3092 CC(O)[C@@]12CC[C@@H](C1)C2(C)C Amb28134759 [0,0,1,1,0,0|0,0,2]=4 1533 B12R2.3092 CC1(C)C2CCC1(C(=O)O)C2 Amb9767512 [0,0,1,1,0,0|1,0,0]=3 1534 B12R2.3092 CC1(C)C2CC[C@@]1(C(=O)O)C2 Amb26888771 [0,0,1,1,0,0|1,0,0]=3 1535 B12R2.3092 CC1(C)C2CC[C@]1(C(=O)O)C2 Amb24467484 [0,0,1,1,0,0|1,0,0]=3 1536 B12R2.3092 CC1(C)[C@H]2CC[C@]1(C(=O)O)C2 Amb27783712 [0,0,1,1,0,0|1,0,0]=3 1537 B12R2.6499 NC1(C(=O)O)CCCC12CC2 Amb28196424 [0,0,1,1,0,0|2,0,0]=4 1538 B12R3.1317 O=C1CC2CCC1C23CC3 Amb25238197 [1,0,0,1,0,0|0,0,0]=2 1539 B12R3.1317 OC1CC2CCC1C23CC3 Amb27207397 [1,0,0,1,0,0|0,0,2]=4 1540 B12R3.1317 O[C@@H]1C[C@H]2CC[C@H]1C23CC3 Amb27465705 [1,0,0,1,0,0|0,0,2]=4 1541 B12R3.4045 CC1(C)C2CC3C(C2)C31C Amb22731891 [1,0,0,1,0,0|0,0,1]=3 1542 B14R3.74494 CC1(C)[C@H]2CC(=O)C3[C@H](C2)[C@@]31C Amb28411172 [0,0,0,1,0,1|0,0,0]=2 1543 B14R3.74494 CC1(C)[C@H]2CC(=O)[C@@H]3[C@@H](C2)[C@@]31C Amb28320365 [0,0,0,1,0,1|0,0,0]=2 1544 B14R3.27790 CC1(C)[C@H]2C[C@H]3C(=O)[C@]1(C)[C@@H]3C2 Amb28074703 [0,0,0,1,0,1|0,0,0]=2 1545 B14R3.4200 CC1(C)C2CCC13CCNC3C2 Amb25701806 [0,1,0,1,0,0|1,0,1]=4 1546 B14R3.4200 CC1(C)C2CCC13CCNC3C2 Amb33457454 [0,1,0,1,0,0|1,0,1]=4 1547 B14R3.28192 CC1(C)[C@H]2C[C@@H]3C(=O)[C@H](C2)[C@@]31C Amb28052249 [0,1,0,1,0,0|0,0,1]=3 1548 B14R3.47287 CC1(C)C2CC3C(CO)(C2)C31C Amb27594684 [0,1,0,1,0,0|0,0,2]=4 1549 B14R3.47287 CC1(C)[C@H]2C[C@H]3[C@@](CO)(C2)[C@@]31C Amb28345403 [0,1,0,1,0,0|0,0,2]=4 1550 B14R3.61224 CC1(C)C2CC3CNC(C2)C31C Amb27616845 [0,1,0,1,0,0|1,0,1]=4 1551 B14R3.70212 CC12CC3(O)C(C1=O)C3C2(C)C Amb27599430 [0,1,0,1,0,0|0,0,0]=2 1552 B14R3.24386 CC12CC3C(C3(Br)C1=O)C2(C)C Amb26636111 [0,1,0,1,0,0|0,0,0]=2 1553 B14R3.24386 CC12CC3C(C3(F)C1=O)C2(C)C Amb27227068 [0,1,0,1,0,0|0,0,0]=2 1554 B14R3.66385 CC12CCC3C(Br)(CC31C)C2=O Amb2459637 [0,1,0,1,0,0|0,0,0]=2 1555 B14R3.4448 CC12CSCC13CCC2CC3=O Amb25226862 [0,1,0,1,0,0|0,0,0]=2 1556 B14R3.47315 CC1(C)C2[C@@H]3C[C@@]1(C=O)C(=O)[C@H]23 Amb28198007 [0,1,0,1,0,0|0,0,1]=3 1557 B14R3.52508 CC12CC3C(C1=O)C3C2(C)C=O Amb28202270 [0,1,0,1,0,0|0,0,1]=3 1558 B14R3.52508 CC12CC3C(C1=O)[C@@H]3[C@@]2(C)CCl Amb28244759 [0,1,0,1,0,0|0,0,0]=2 1559 B14R3.52508 CC12CC3C(C1=O)[C@@H]3[C@@]2(C)CO Amb27440404 [0,1,0,1,0,0|0,0,0]=2 1560 B14R3.70240 CC12[C@H]3C[C@](C)(C(=O)[C@H]31)C2(C)C Amb27974071 [0,1,0,1,0,0|0,0,0]=2 1561 B10R1.58 CC(=O)C1CC(=O)C(C)C1 Amb26936800 [0,0,1,0,1,0|1,0,1]=4 1562 B10R1.58 CC(C)C1CC(F)C(=O)N1 Amb27426587 [0,0,1,0,1,0|2,0,0]=4 1563 B10R1.58 CC(C)[C@H]1C[C@H](F)C(=O)N1 Amb27787983 [0,0,1,0,1,0|2,0,0]=4 1564 B10R1.58 CC1=C[C@@H](C(C)C)CC1=O Amb28125705 [0,0,1,0,1,0|0,0,2]=4 1565 B10R1.58 CC1CC(C(C)C)CC1=O Amb27861161 [0,0,1,0,1,0|0,0,0]=2 1566 B10R1.58 CC1CN(C(C)C)CC1=O Amb20667831 [0,0,1,0,1,0|1,0,0]=3 1567 B10R1.58 C[C@@H]1C[C@@H]([C@@H](C)Br)OC1=O Amb27438583 [0,0,1,0,1,0|2,0,0]=4 1568 B10R1.194 C=C(C)[C@@H]1CC[C@H](C)C1=O Amb27854628 [0,0,1,0,1,0|0,0,2]=4 1569 B10R1.194 CC(C)=C1CCC(C)C1=O Amb27618011 [0,0,1,0,1,0|0,0,2]=4 1570 B10R1.194 CC(C)C1=CCC(C)C1=O Amb27832849 [0,0,1,0,1,0|0,0,2]=4 1571 B10R1.194 CC(C)N1CCC(Br)C1=O Amb20623062 [0,0,1,0,1,0|2,0,0]=4 1572 B10R1.194 CC(C)N1CCC(N)C1=O Amb18945540 [0,0,1,0,1,0|2,0,0]=4 1573 B10R1.194 CC(C)N1CCC(O)C1=O Amb27204467 [0,0,1,0,1,0|2,0,0]=4 1574 B10R1.194 CC(C)N1CC[C@H](N)C1=O Amb25121106 [0,0,1,0,1,0|2,0,0]=4 1575 B10R1.194 CC(C)[C@H]1CC[C@@H](C)C1=O Amb27428320 [0,0,1,0,1,0|0,0,0]=2 1576 B10R1.194 CC(C)[C@H]1CC[C@@H](C)[C@@H]1O Amb27451580 [0,0,1,0,1,0|0,0,2]=4 1577 B10R1.194 CC(C)[C@H]1CC[C@@H](C)[C@H]1O Amb27268417 [0,0,1,0,1,0|0,0,2]=4 1578 B10R1.194 CC1CCC(C(C)O)C1=O Amb27802736 [0,0,1,0,1,0|1,0,0]=3 1579 B10R1.194 CC1NCN(C(C)C)C1=O Amb25777746 [0,0,1,0,1,0|2,0,0]=4 1580 B10R1.314 C=C1C(O)C(C)(C)C1(C)C Amb27839250 [0,0,1,0,1,0|2,0,0]=4 1581 B10R1.314 CC1(C)C(=O)C(Br)C1(C)C Amb27849066 [0,0,1,0,1,0|1,0,0]=3 1582 B10R1.314 CC1(C)C(=O)C(Cl)C1(C)C Amb28137917 [0,0,1,0,1,0|1,0,0]=3 1583 B10R1.314 CC1C(=O)C(C)(C)C1(C)C Amb28201113 [0,0,1,0,1,0|0,0,0]=2 1584 B10R1.476 CC1(C)CC(=O)C1(O)CBr Amb28282570 [0,0,1,0,1,0|2,0,0]=4 1585 B10R1.365 C=C(C)C1(O)CCC1(C)C Amb27486659 [0,0,1,0,1,0|2,0,0]=4 1586 B10R1.365 CC(=O)C1(C)OCC1(C)C Amb27827939 [0,0,1,0,1,0|1,0,0]=3 1587 B10R1.365 CC1(C)CCC1(C)C(=O)O Amb27831961 [0,0,1,0,1,0|1,0,0]=3 1588 B10R2.206 CC1(C)[C@H]2CC(=O)[C@@H]1C2 Amb28057474 [1,0,0,0,1,0|0,0,0]=2 1589 B10R2.206 CC1(C)[C@H]2C[C@@H](N)[C@@H]1C2 Amb27851455 [1,0,0,0,1,0|1,0,1]=4 1590 B10R2.206 CC1(C)[C@H]2C[C@@H](O)[C@@H]1C2 Amb27431111 [1,0,0,0,1,0|0,0,2]=4 1591 B10R2.206 CC1(C)[C@H]2C[C@@H]1[C@H](O)C2 Amb27208111 [1,0,0,0,1,0|0,0,2]=4 1592 B10R2.206 CC1(C)[C@H]2C[C@H](O)[C@@H]1C2 Amb27256888 [1,0,0,0,1,0|0,0,2]=4 1593 B10R2.326 CC1C2CC(=O)C1(C)O2 Amb27262986 [1,0,0,0,1,0|1,0,0]=3 1594 B12R1.19 CC1CCC(CN(C)C)CC1=O Amb27177911 [0,0,1,0,0,1|1,0,0]=3 1595 B12R1.892 CC(C)C1CCC(N)C(=O)NC1 Amb27605871 [0,0,1,0,0,1|1,0,0]=3 1596 B12R1.892 CC1CCC(C(C)C)CCC1=O Amb27260465 [0,0,1,0,0,1|0,0,0]=2 1597 B12R1.1021 CC(C)C1CCCC(=O)C(=O)C1 Amb27175971 [0,0,1,0,0,1|1,0,1]=4 1598 B12R1.1218 CC(C)=C1CCC(C)CC(=O)C1 Amb27164662 [0,0,1,0,0,1|0,0,2]=4 1599 B12R1.1218 CC(C)[C@@H]1CC[C@H](C)OC(=O)C1 Amb27626703 [0,0,1,0,0,1|0,0,0]=2 1600 B12R1.1218 CC(C)[C@H]1CC[C@@H](C)CC(=O)N1 Amb28204015 [0,0,1,0,0,1|1,0,0]=3 1601 B12R1.1218 CC(C)[C@H]1CC[C@H](C)CC(=O)C1 Amb28141325 [0,0,1,0,0,1|0,0,0]=2 1602 B12R1.1218 CC1CCC(C(C)C)=CC(=O)C1 Amb27861252 [0,0,1,0,0,1|0,0,2]=4 1603 B12R1.1218 CC1CCC(C(C)C)NC(=O)C1 Amb6359610 [0,0,1,0,0,1|1,0,0]=3 1604 B12R1.1218 CC1CC[C@H](C(C)C)CC(=O)C1 Amb27389246 [0,0,1,0,0,1|0,0,0]=2 1605 B12R1.115 CC1=CC(C)(C)C(CC=O)CC1 Amb27177457 [0,0,1,0,0,1|0,0,1]=3 1606 B12R1.115 C[C@@H]1CC[C@@H](CC=O)C(C)(C)O1 Amb28132449 [0,0,1,0,0,1|0,0,0]=2 1607 B12R1.115 C[C@H]1CC[C@@H](CC=O)C(C)(C)O1 Amb27788488 [0,0,1,0,0,1|0,0,0]=2 1608 B12R1.543 C=C1CCCC(CC=O)C1(C)C Amb27954075 [0,0,1,0,0,1|0,0,2]=4 1609 B12R1.1897 CC1=CC(C)(C)C(CO)CC1=O Amb27802562 [0,0,1,0,0,1|1,0,1]=4 1610 B12R1.1897 CCC1CC(=O)C(C)=CC1(C)C Amb27785531 [0,0,1,0,0,1|0,0,1]=3 1611 B12R1.1897 CCC1CC(=O)C(C)CC1(C)C Amb27748594 [0,0,1,0,0,1|0,0,0]=2 1612 B12R1.1897 CC[C@H]1CC(=O)C(C)=CC1(C)C Amb27854988 [0,0,1,0,0,1|0,0,1]=3 1613 B12R1.1283 CC1(C)C(=O)C=CC(O)C1(C)C Amb28253963 [0,0,1,0,0,1|1,0,1]=4 1614 B12R1.1283 CN1CCC(=O)C(C)(C)C1(C)C Amb32660177 [0,0,1,0,0,1|1,0,0]=3 1615 B12R1.2853 CC1(C)CC(C)(C)C(=O)CC1=O Amb27828956 [0,0,1,0,0,1|1,0,1]=4 1616 B12R1.2853 CC1(C)OC(C)(C)C(=O)CC1=O Amb26474898 [0,0,1,0,0,1|1,0,1]=4 1617 B12R1.123 C=C(C)C[C@]1(C)CCCCC1=O Amb27177440 [0,0,1,0,0,1|0,0,2]=4 1618 B12R1.123 CC(=O)CC1(C)CCCCC1=O Amb27950642 [0,0,1,0,0,1|1,0,1]=4 1619 B12R1.123 CC(=O)C[C@]1(C)CCCCC1=O Amb27177991 [0,0,1,0,0,1|1,0,1]=4 1620 B12R1.123 CC(C)CC1(C)NCCNC1=O Amb18960330 [0,0,1,0,0,1|2,0,0]=4 1621 B12R1.123 CN(C)CC1(C)CCCCC1=O Amb27799959 [0,0,1,0,0,1|1,0,0]=3 1622 B12R1.123 CN(C)CC1(O)CCCCC1=O Amb27434240 [0,0,1,0,0,1|2,0,0]=4 1623 B12R1.2415 CCC1(C)CC(C)(C)C=CC1=O Amb27389311 [0,0,1,0,0,1|0,0,2]=4 1624 B12R1.2415 CCC1(C)NC(C)(C)COC1=O Amb5781651 [0,0,1,0,0,1|1,0,0]=3 1625 B12R1.2406 CC1=CC(C)(C)C(C)(C=O)CC1 Amb28252433 [0,0,1,0,0,1|0,0,1]=3 1626 B12R1.3966 C=CC1(C)CCC(O)C(C)(C)O1 Amb10845051 [0,0,1,0,0,1|2,0,0]=4 1627 B12R1.3966 C=C[C@]1(C)CC[C@H](O)C(C)(C)O1 Amb28053544 [0,0,1,0,0,1|2,0,0]=4 1628 B12R1.3097 C=C(C)C1(O)CCCC(C)(C)C1 Amb27668787 [0,0,1,0,0,1|2,0,0]=4 1629 B12R1.3097 CC1(C)CCCC(C)(C(=O)O)C1 Amb27400428 [0,0,1,0,0,1|1,0,0]=3 1630 B12R1.3097 CC1(C)CCCC(C)(C(=O)O)O1 Amb17689279 [0,0,1,0,0,1|1,0,0]=3 1631 B12R1.3097 CC1(C)CCCC(C)(C(=O)[O-])O1 Amb17843490 [0,0,1,0,0,1|1,0,0]=3 1632 B12R1.3097 CC1(C)CCCC(C)(C(=O)[O-])O1 Amb17843491 [0,0,1,0,0,1|1,0,0]=3 1633 B12R1.3097 CC1(C)CCCC(C)(C(=O)[O-])O1 Amb17843493 [0,0,1,0,0,1|1,0,0]=3 1634 B12R1.3097 CC1(C)CCCC(Cl)(C(=O)Cl)C1 Amb33128005 [0,0,1,0,0,1|2,0,0]=4 1635 B12R1.3097 CC1(C)CCCC(Cl)(C(=O)O)C1 Amb33127957 [0,0,1,0,0,1|2,0,0]=4 1636 B12R1.3097 CC1(C)CCCC(N)(C(=O)O)C1 Amb27667445 [0,0,1,0,0,1|2,0,0]=4 1637 B12R1.3097 CC1(C)CCCC(N)(C(N)=O)C1 Amb27877522 [0,0,1,0,0,1|2,0,0]=4 1638 B12R1.3097 CC1(C)CCCC(O)(C(=O)O)C1 Amb25152420 [0,0,1,0,0,1|2,0,0]=4 1639 B12R1.3097 CC1(C)CCCC(O)(C(N)=O)C1 Amb27853350 [0,0,1,0,0,1|2,0,0]=4 1640 B12R1.3097 CC1(C)CCC[C@](C)(C(=O)O)O1 Amb25700991 [0,0,1,0,0,1|1,0,0]=3 1641 B12R1.3097 CC1(Cl)CCCC(C)(C(=O)Cl)C1 Amb25148888 [0,0,1,0,0,1|2,0,0]=4 1642 B12R1.3097 CC1(Cl)CCCC(C)(C(=O)O)C1 Amb18650683 [0,0,1,0,0,1|2,0,0]=4 1643 B12R1.3172 C=C(C)CC1(C)CCCC1(C)O Amb25339474 [0,0,1,0,0,1|2,0,0]=4 1644 B12R1.3172 CC(C)=CC1(C)CCCC1(C)O Amb32951024 [0,0,1,0,0,1|2,0,0]=4 1645 B12R1.3172 CC1(C)CCCC1(N)CC(=O)O Amb27442625 [0,0,1,0,0,1|2,0,0]=4 1646 B12R1.3172 CC1(C)CCCC1(N)CC(N)=O Amb32787382 [0,0,1,0,0,1|2,0,0]=4 1647 B12R2.998 CC1(C)CC2CNC1C(=O)O2 Amb27403387 [1,0,0,0,0,1|2,0,0]=4 1648 B12R2.5234 CC12CCC(CC1)C(C)(C)O2 Amb6307400 [1,0,0,0,0,1|0,0,1]=3 1649 B12R2.5234 CC12CCC(CC1)C(C)(C)S2 Amb27874080 [1,0,0,0,0,1|0,0,1]=3 1650 B12R2.1152 CC1(C)CC2(C)CC1CC2Cl Amb27863809 [0,0,0,0,1,1|1,0,1]=4 1651 B12R2.1152 CC1(C)CC2(C)CC1CC2N Amb27265932 [0,0,0,0,1,1|1,0,1]=4 1652 B12R2.1152 CC1(C)CC2(C)CC1C[C@@H]2Cl Amb28325691 [0,0,0,0,1,1|1,0,1]=4 1653 B12R2.1152 CC1(C)C[C@]2(C)C[C@H]1C[C@@H]2N Amb27489087 [0,0,0,0,1,1|1,0,1]=4 1654 B12R2.1152 CC1(C)C[C@]2(C)C[C@H]1C[C@H]2Cl Amb28245167 [0,0,0,0,1,1|1,0,1]=4 1655 B12R2.1152 CC1(C)C[C@]2(C)C[C@H]1C[C@H]2N Amb27420059 [0,0,0,0,1,1|1,0,1]=4 1656 B12R2.1152 CC1(C)C[C@]2(C)C[C@H]1C[C@H]2O Amb27978354 [0,0,0,0,1,1|0,0,2]=4 1657 B12R2.2862 CC1(C)[C@@H]2C[C@@H](N)C[C@@]1(C)C2 Amb27783328 [0,0,0,0,1,1|1,0,1]=4 1658 B14R2.24522 CC12CCC(CNC(=O)N1)C2(C)C Amb27876198 [0,0,0,0,0,2|0,0,0]=2 1659 B14R2.28808 CC1(C)[C@H]2CCN[C@]1(C)NC(=O)C2 Amb27463202 [0,0,0,0,0,2|0,0,0]=2