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2f150bbe96920869e15d5d5aa816b484 [0,1,0,0,0,0|0,1,2]=4 14 B6R0.1 CCC(C)OCF b1f4704464bbfd0265fa8845c1d734e2 [0,1,0,0,0,0|2,0,1]=4 15 B6R0.1 CCNC(C)CC 396d13a5c682c09283d5fcc86ff55a86 [0,1,0,0,0,0|1,0,2]=4 16 B6R0.1 CCNC(C)CO 31c32677d35319c7bce72f49aa59533d [0,1,0,0,0,0|1,0,2]=4 17 B6R0.1 CCN[C@@H](C)CC 8864275bc593322b499f8ffa253a175e [0,1,0,0,0,0|1,0,2]=4 18 B6R0.1 CCN[C@@H](C)CO 1b5cec79590e2129f58d3514073a1390 [0,1,0,0,0,0|1,0,2]=4 19 B6R0.1 CCN[C@H](C)CC 2ca98ce961a0f1b51c5b9bb18e4cf730 [0,1,0,0,0,0|1,0,2]=4 20 B6R0.1 CCN[C@H](C)CO 4334eb4497c625ddabbfceeac7d82066 [0,1,0,0,0,0|1,0,2]=4 21 B6R0.1 CCOC(C)CC 56a4de537882754d70714e008cda003f [0,1,0,0,0,0|2,0,1]=4 22 B6R0.1 CCOC(C)CF 65f06da7a639a9baf133860813b79ea3 [0,1,0,0,0,0|2,0,1]=4 23 B6R0.1 CCOC(C)CS eb3404d1a98d8fb6f364ecf6e98ac96e [0,1,0,0,0,0|2,0,1]=4 24 B6R0.1 CCO[C@@H](C)CC 1c34d8425f39e9be808db66bb381a14c [0,1,0,0,0,0|2,0,1]=4 25 B6R0.1 CCO[C@H](C)CC 08a1e8fcc5a32008da3650c30e1472a7 [0,1,0,0,0,0|2,0,1]=4 26 B6R0.1 CCO[C@H](C)CS 7d1ac13ead965fd5112ee05598239ca1 [0,1,0,0,0,0|2,0,1]=4 27 B6R0.1 CC[C@@H](C)NC=O b2daaabeaf297395c554f58ded1a06ac [0,1,0,0,0,0|0,1,2]=4 28 B6R0.1 CC[C@@H](C)NCF 6dbb95a50e3976893bdb1627db012fbb [0,1,0,0,0,0|1,0,2]=4 29 B6R0.1 CC[C@@H](C)NCO ac0974a6f9b0bb6d16f90be7439490a9 [0,1,0,0,0,0|0,1,2]=4 30 B6R0.1 CC[C@@H](C)OCF f4fa7810a1d84f0f9cde4476fd8e3f60 [0,1,0,0,0,0|2,0,1]=4 31 B6R0.1 CC[C@H](C)NC=O de5ee03736ab09026768085a3122631f [0,1,0,0,0,0|0,1,2]=4 32 B6R0.1 CC[C@H](C)NCF 5d430afc33b47de08bdee5a967987e85 [0,1,0,0,0,0|1,0,2]=4 33 B6R0.1 CC[C@H](C)NCO 3a0d2629be7074b261ab0759e7061769 [0,1,0,0,0,0|0,1,2]=4 34 B6R0.1 CC[C@H](C)OCF 7272126d7b60c9c2f9744715a5cbda1c [0,1,0,0,0,0|2,0,1]=4 35 B6R0.1 C[C@@H](CO)NC#N 139f5cc18c10fce938a3acd4b6e91304 [0,1,0,0,0,0|1,0,2]=4 36 B6R0.1 C[C@@H](CO)NC=O ec3f1323844b2b166f286f44082a1734 [0,1,0,0,0,0|0,1,2]=4 37 B6R0.1 C[C@@H](CO)NCF 2b92b0d94fc310efd060ea85fc1ec030 [0,1,0,0,0,0|1,0,2]=4 38 B6R0.1 C[C@@H](CO)NCO f2447992c21252c0f96361e913fb5f29 [0,1,0,0,0,0|0,1,2]=4 39 B6R0.1 C[C@H](CO)NC#N 169e9f99802281ff5010262eba8da425 [0,1,0,0,0,0|1,0,2]=4 40 B6R0.1 C[C@H](CO)NC=O 3cbedcbe22de2e07327f619fdeffeaec [0,1,0,0,0,0|0,1,2]=4 41 B6R0.1 C[C@H](CO)NCF 769b646e43e30d6b70ca628125c680bc [0,1,0,0,0,0|1,0,2]=4 42 B6R0.1 C[C@H](CO)NCO 8d1246dd802e302de647e53829f5ca23 [0,1,0,0,0,0|0,1,2]=4 43 B6R0.1 C[C@H](CS)OCF db899319a56836cd7d73603a0da16225 [0,1,0,0,0,0|2,0,1]=4 44 B6R0.2 CC(C)OC(C)C ca12c9680239690a47d96d71519e9e05 [0,1,0,0,0,0|2,0,1]=4 45 B6R0.3 CC(C)N(C)C=O ed819c6af0078a1de69f07f4fd8d9ee5 [0,1,0,0,0,0|0,1,2]=4 46 B6R0.3 CC(C)N(C)CF d3c40e8bfc08dfa1b44a8a87aef31e93 [0,1,0,0,0,0|1,0,2]=4 47 B6R0.3 CC(C)N(C)CO 68aaa92996932618c2ea955d854bb5c7 [0,1,0,0,0,0|0,1,2]=4 48 B6R0.3 CCN(C)C(C)C 515b7690a64e89945d29d623804849df [0,1,0,0,0,0|1,0,2]=4 49 B6R0.4 C#CCNC(C)C cd1408fc1dae47155e40a1bc6beb1606 [0,1,0,0,0,0|1,0,2]=4 50 B6R0.4 C#CCOC(C)C f06fe85c789040b5be09600decc77ea1 [0,1,0,0,0,0|2,0,1]=4 51 B6R0.4 C=CCOC(C)C 041109637968f56803a7bcb6b6bd0ab7 [0,1,0,0,0,0|2,0,1]=4 52 B6R0.4 CC(C)CNC#N 4669aa11e322ca513b1e9ea16868c159 [0,1,0,0,0,0|1,0,2]=4 53 B6R0.4 CC(C)CNC=O e82c18370445f70bde3f0aa61f9296e6 [0,1,0,0,0,0|0,1,2]=4 54 B6R0.4 CC(C)CNCF 8978b44d87fa42438515590def89eb79 [0,1,0,0,0,0|1,0,2]=4 55 B6R0.4 CC(C)CNCO c3b5fde83cdd81c2f0ea167064fd2c5c [0,1,0,0,0,0|0,1,2]=4 56 B6R0.4 CC(C)COCF b089fa536e65fca20df885ea5dacd9f2 [0,1,0,0,0,0|2,0,1]=4 57 B6R0.4 CC(C)NCC#N 8d9c5f2bbdfd2e60c34ddc5972663be0 [0,1,0,0,0,0|1,0,2]=4 58 B6R0.4 CC(C)NCCBr a3900e505497b08f4c9baca17b4fa185 [0,1,0,0,0,0|1,0,2]=4 59 B6R0.4 CC(C)NCCF 3152aefd56bd5a8bc9f6ac7f33a6fcdb [0,1,0,0,0,0|1,0,2]=4 60 B6R0.4 CC(C)NCCI 61300b723cb63b92262a59e1c054336d [0,1,0,0,0,0|1,0,2]=4 61 B6R0.4 CC(C)NCCO 3b0ca7166ca7093e2a2ed1b091b6c5af [0,1,0,0,0,0|0,1,2]=4 62 B6R0.4 CC(C)NCCS cdea7056049e21082f31ef0c239da6f7 [0,1,0,0,0,0|0,0,3]=4 63 B6R0.4 CC(C)OCC#N 1be7e1885bd3670d21ecc2d4422857b0 [0,1,0,0,0,0|2,0,1]=4 64 B6R0.4 CC(C)OCC=O 656e3e823b109ec9cd57494110924cc8 [0,1,0,0,0,0|1,1,1]=4 65 B6R0.4 CC(C)OCCF 102209588400e8045c1b7317560b3baf [0,1,0,0,0,0|2,0,1]=4 66 B6R0.4 CC(C)OCCS 9f8fcde0a26cdc1f53f7ed80bebd9fd6 [0,1,0,0,0,0|1,0,2]=4 67 B6R0.4 CCCNC(C)C 4cc952815a9d9d6816d0fb90ac14a178 [0,1,0,0,0,0|1,0,2]=4 68 B6R0.4 CCCOC(C)C 9e8901dd10ed96aa593b6a5525365a05 [0,1,0,0,0,0|2,0,1]=4 69 B6R0.4 CCNCC(C)C 7e39c7f79a4a74429f1ae559b7eef67a [0,1,0,0,0,0|1,0,2]=4 70 B6R0.4 CCOCC(C)C 2ccacce0745bb2fe2e67c6f95de49a4c [0,1,0,0,0,0|2,0,1]=4 71 B6R0.4 COCOC(C)C 2db698e0a27d38f57903461e5b8bf21f [0,1,0,0,0,0|1,1,1]=4 72 B6R0.4 CSCOC(C)C df2443d5e1bdbc2f3ac237524c1a32f1 [0,1,0,0,0,0|1,0,2]=4 73 B6R0.5 CC(C)(C)NC=O fd731f01e449e88bdf1e84dfcee6c8d2 [0,1,0,0,0,0|0,1,2]=4 74 B6R0.5 CC(C)(C)NCF 3cacbed1609b720894d3f72aa5b5474f [0,1,0,0,0,0|1,0,2]=4 75 B6R0.5 CC(C)(C)NCO 98c610d421d69102d9fd33b99f13912a [0,1,0,0,0,0|0,1,2]=4 76 B6R0.5 CCNC(C)(C)C 075494290386c2ca265fcbc967febc26 [0,1,0,0,0,0|1,0,2]=4 77 B6R1.3 CCNC1CC1 ac3981af76d7269974e900b3cfc5de71 [0,0,0,1,0,0|1,0,2]=4 78 B6R1.3 CCOC1CC1 2c69a519fd7808244f9f88e8c40da7c1 [0,0,0,1,0,0|2,0,1]=4 79 B6R1.3 FCNC1CC1 1715feed97cb051cb760323cf608febe [0,0,0,1,0,0|1,0,2]=4 80 B6R1.3 FCOC1CC1 c80b7a723f6ace17df2859b2130f1eb6 [0,0,0,1,0,0|2,0,1]=4 81 B6R1.3 N#CNC1CC1 e16d88e60b8af9226032f06df181743e [0,0,0,1,0,0|1,0,2]=4 82 B6R1.3 O=CNC1CC1 8f8618d92d234287e5df05f6330bfc1f [0,0,0,1,0,0|0,1,2]=4 83 B6R1.3 OCNC1CC1 101960c0f522708da07270474b234f44 [0,0,0,1,0,0|0,1,2]=4 84 B7R0.6 CC(C)OCC(=S)N 1cbdee4d5c3385daad7ba959afed69ee [0,2,0,0,0,0|1,0,1]=4