0 B5R0.1 CC(C)NC#N ca654f29c9678ccae3e6761ddb91602e [0,0,0,0,0,0|2,0,1]=3 1 B5R0.1 CC(C)OCF fea4e57e7bb4fa505ef4ea18bd2ede99 [0,0,0,0,0,0|2,0,1]=3 2 B5R0.1 CCOC(C)C e40579e838af0384b34ea3d488054b89 [0,0,0,0,0,0|1,0,1]=2 3 B4R0.2 CCNC#N d0f03dd102d2d8b7abe705087df6ba79 [1,0,0,0,0,0|2,0,1]=4 4 B6R0.1 C#CC(C)NC=O 50c944dc0c2f52246cf2f8b75f249da5 [0,1,0,0,0,0|2,0,1]=4 5 B6R0.1 C#CC(C)NCC 85cc62c068fe8347941753880600425b [0,1,0,0,0,0|1,0,2]=4 6 B6R0.1 C#CC(C)OCC 788c44cbb46959d6943b8cac1e896fa7 [0,1,0,0,0,0|1,0,2]=4 7 B6R0.1 C#C[C@@H](C)NC=O 4fee702505a1fdefb270b5b6e9eb7aa3 [0,1,0,0,0,0|2,0,1]=4 8 B6R0.1 C#C[C@@H](C)NCC 500769c3a32c8a4fe4bacf70b2bb6f30 [0,1,0,0,0,0|1,0,2]=4 9 B6R0.1 C#C[C@@H](C)OCC c7465ab1da07bbdf42877ee57642c1cd [0,1,0,0,0,0|1,0,2]=4 10 B6R0.1 C#C[C@H](C)NC=O 55f7e717dc246fc1c154a9332387447d [0,1,0,0,0,0|2,0,1]=4 11 B6R0.1 C#C[C@H](C)NCC 996961b9a4ddcbb2cfb9dcd81ac9d63f [0,1,0,0,0,0|1,0,2]=4 12 B6R0.1 C#C[C@H](C)OCC e1b8dec53e104261dd95078ad7e6d539 [0,1,0,0,0,0|1,0,2]=4 13 B6R0.1 C=CC(C)NC=O ea3bd8a0f1437d84f5ea96318c16e9bd [0,1,0,0,0,0|2,0,1]=4 14 B6R0.1 C=CC(C)NCC 948c94c892befefe9756783e6d4a372c [0,1,0,0,0,0|1,0,2]=4 15 B6R0.1 C=CC(C)OCC 56eed946f70859c9519e59c17b27f8ec [0,1,0,0,0,0|1,0,2]=4 16 B6R0.1 C=CCN(C)CC 66590de6b708bb2b2b2945a656dd0b8f [0,1,0,0,0,0|1,0,2]=4 17 B6R0.1 C=CCN(C)CF 7e02e3a96da7141f47b832fca75c32a8 [0,1,0,0,0,0|1,0,2]=4 18 B6R0.1 C=CCN(C)CO e638b434bf874996eb81f2689695f38f [0,1,0,0,0,0|1,0,2]=4 19 B6R0.1 C=C[C@H](C)OCC 1f2a0e5dd56f9e416c2e4c2822c0bb6e [0,1,0,0,0,0|1,0,2]=4 20 B6R0.1 CC(C#N)NC=O bab971dbe2c7155864d30c197f73349b [0,1,0,0,0,0|2,0,1]=4 21 B6R0.1 CC(CF)OCF 32adde0cda0df7ca13f616d81360f718 [0,1,0,0,0,0|2,0,1]=4 22 B6R0.1 CC(CO)NC#N b6bfa3976d2a6a9619606ed55bd1d96b [0,1,0,0,0,0|2,0,1]=4 23 B6R0.1 CC(CO)NC=O 6cb3b07738b3559c75de386eaa588767 [0,1,0,0,0,0|2,0,0]=3 24 B6R0.1 CC(CO)NCF ab7f612930dc9a706824818dda371d27 [0,1,0,0,0,0|2,0,1]=4 25 B6R0.1 CC(CO)NCO 220515de56991eed80ebf3de2b03eb11 [0,1,0,0,0,0|2,0,1]=4 26 B6R0.1 CC(CS)OCF 3aa76e588b94fa8c0abffd230ad3c80a [0,1,0,0,0,0|2,0,1]=4 27 B6R0.1 CCC(C)NC#N c755bc17a86225b89fbcb7b323cbfbb8 [0,1,0,0,0,0|2,0,1]=4 28 B6R0.1 CCC(C)NC=O b39ff0b918608a651b17fb1bcfe748b2 [0,1,0,0,0,0|2,0,0]=3 29 B6R0.1 CCC(C)NCF cd789606d14d277b4095dc11d6d1f629 [0,1,0,0,0,0|2,0,1]=4 30 B6R0.1 CCC(C)NCO 2f150bbe96920869e15d5d5aa816b484 [0,1,0,0,0,0|2,0,1]=4 31 B6R0.1 CCC(C)OCF b1f4704464bbfd0265fa8845c1d734e2 [0,1,0,0,0,0|2,0,1]=4 32 B6R0.1 CCCN(C)CC 063caa89be0fdd356f6455d1751457ac [0,1,0,0,0,0|1,0,2]=4 33 B6R0.1 CCCN(C)CF 5c995bfd39cfefd185b6001ca8e730f3 [0,1,0,0,0,0|1,0,2]=4 34 B6R0.1 CCCN(C)CO fa8c399923bf908abe4d1198e252c43d [0,1,0,0,0,0|1,0,2]=4 35 B6R0.1 CCN(C)CC=O 027065f0dd139518bb2cdfff7d6533ae [0,1,0,0,0,0|2,0,1]=4 36 B6R0.1 CCN(C)COC 2dba1e0fec030895fe26248c793df52e [0,1,0,0,0,0|2,0,1]=4 37 B6R0.1 CCN(C)CSC 613c63b39ee46a6bdda90b076e70e35a [0,1,0,0,0,0|2,0,1]=4 38 B6R0.1 CCNC(C)C#N c11bb97931a96bb8667e2c19bb27e47b [0,1,0,0,0,0|1,0,2]=4 39 B6R0.1 CCNC(C)CC 396d13a5c682c09283d5fcc86ff55a86 [0,1,0,0,0,0|1,0,1]=3 40 B6R0.1 CCNC(C)CO 31c32677d35319c7bce72f49aa59533d [0,1,0,0,0,0|1,0,1]=3 41 B6R0.1 CCN[C@@H](C)CC 8864275bc593322b499f8ffa253a175e [0,1,0,0,0,0|1,0,1]=3 42 B6R0.1 CCN[C@@H](C)CO 1b5cec79590e2129f58d3514073a1390 [0,1,0,0,0,0|1,0,1]=3 43 B6R0.1 CCN[C@H](C)CC 2ca98ce961a0f1b51c5b9bb18e4cf730 [0,1,0,0,0,0|1,0,1]=3 44 B6R0.1 CCN[C@H](C)CO 4334eb4497c625ddabbfceeac7d82066 [0,1,0,0,0,0|1,0,1]=3 45 B6R0.1 CCOC(C)C=O 4021b7076259f80e1751543881198165 [0,1,0,0,0,0|1,0,2]=4 46 B6R0.1 CCOC(C)CC 56a4de537882754d70714e008cda003f [0,1,0,0,0,0|1,0,1]=3 47 B6R0.1 CCOC(C)CF 65f06da7a639a9baf133860813b79ea3 [0,1,0,0,0,0|1,0,1]=3 48 B6R0.1 CCOC(C)CS eb3404d1a98d8fb6f364ecf6e98ac96e [0,1,0,0,0,0|1,0,1]=3 49 B6R0.1 CCO[C@@H](C)CC 1c34d8425f39e9be808db66bb381a14c [0,1,0,0,0,0|1,0,1]=3 50 B6R0.1 CCO[C@H](C)CC 08a1e8fcc5a32008da3650c30e1472a7 [0,1,0,0,0,0|1,0,1]=3 51 B6R0.1 CCO[C@H](C)CS 7d1ac13ead965fd5112ee05598239ca1 [0,1,0,0,0,0|1,0,1]=3 52 B6R0.1 CC[C@@H](C)NC=O b2daaabeaf297395c554f58ded1a06ac [0,1,0,0,0,0|2,0,0]=3 53 B6R0.1 CC[C@@H](C)NCF 6dbb95a50e3976893bdb1627db012fbb [0,1,0,0,0,0|2,0,1]=4 54 B6R0.1 CC[C@@H](C)NCO ac0974a6f9b0bb6d16f90be7439490a9 [0,1,0,0,0,0|2,0,1]=4 55 B6R0.1 CC[C@@H](C)OCF f4fa7810a1d84f0f9cde4476fd8e3f60 [0,1,0,0,0,0|2,0,1]=4 56 B6R0.1 CC[C@H](C)NC=O de5ee03736ab09026768085a3122631f [0,1,0,0,0,0|2,0,0]=3 57 B6R0.1 CC[C@H](C)NCF 5d430afc33b47de08bdee5a967987e85 [0,1,0,0,0,0|2,0,1]=4 58 B6R0.1 CC[C@H](C)NCO 3a0d2629be7074b261ab0759e7061769 [0,1,0,0,0,0|2,0,1]=4 59 B6R0.1 CC[C@H](C)OCF 7272126d7b60c9c2f9744715a5cbda1c [0,1,0,0,0,0|2,0,1]=4 60 B6R0.1 C[C@@H](CO)NC#N 139f5cc18c10fce938a3acd4b6e91304 [0,1,0,0,0,0|2,0,1]=4 61 B6R0.1 C[C@@H](CO)NC=O ec3f1323844b2b166f286f44082a1734 [0,1,0,0,0,0|2,0,0]=3 62 B6R0.1 C[C@@H](CO)NCF 2b92b0d94fc310efd060ea85fc1ec030 [0,1,0,0,0,0|2,0,1]=4 63 B6R0.1 C[C@@H](CO)NCO f2447992c21252c0f96361e913fb5f29 [0,1,0,0,0,0|2,0,1]=4 64 B6R0.1 C[C@H](CO)NC#N 169e9f99802281ff5010262eba8da425 [0,1,0,0,0,0|2,0,1]=4 65 B6R0.1 C[C@H](CO)NC=O 3cbedcbe22de2e07327f619fdeffeaec [0,1,0,0,0,0|2,0,0]=3 66 B6R0.1 C[C@H](CO)NCF 769b646e43e30d6b70ca628125c680bc [0,1,0,0,0,0|2,0,1]=4 67 B6R0.1 C[C@H](CO)NCO 8d1246dd802e302de647e53829f5ca23 [0,1,0,0,0,0|2,0,1]=4 68 B6R0.1 C[C@H](CS)OCF db899319a56836cd7d73603a0da16225 [0,1,0,0,0,0|2,0,1]=4 69 B6R0.2 CC(C)OC(C)C ca12c9680239690a47d96d71519e9e05 [0,1,0,0,0,0|1,0,1]=3 70 B6R0.3 CC(C)N(C)C=O ed819c6af0078a1de69f07f4fd8d9ee5 [0,1,0,0,0,0|2,0,0]=3 71 B6R0.3 CC(C)N(C)CF d3c40e8bfc08dfa1b44a8a87aef31e93 [0,1,0,0,0,0|2,0,1]=4 72 B6R0.3 CC(C)N(C)CO 68aaa92996932618c2ea955d854bb5c7 [0,1,0,0,0,0|2,0,1]=4 73 B6R0.3 CCN(C)C(C)C 515b7690a64e89945d29d623804849df [0,1,0,0,0,0|1,0,1]=3 74 B6R0.4 C#CCNC(C)C cd1408fc1dae47155e40a1bc6beb1606 [0,1,0,0,0,0|0,0,3]=4 75 B6R0.4 C#CCOC(C)C f06fe85c789040b5be09600decc77ea1 [0,1,0,0,0,0|0,0,3]=4 76 B6R0.4 C=CCOC(C)C 041109637968f56803a7bcb6b6bd0ab7 [0,1,0,0,0,0|0,0,2]=3 77 B6R0.4 CC(C)CNC#N 4669aa11e322ca513b1e9ea16868c159 [0,1,0,0,0,0|1,0,2]=4 78 B6R0.4 CC(C)CNC=O e82c18370445f70bde3f0aa61f9296e6 [0,1,0,0,0,0|1,0,1]=3 79 B6R0.4 CC(C)CNCF 8978b44d87fa42438515590def89eb79 [0,1,0,0,0,0|1,0,1]=3 80 B6R0.4 CC(C)CNCO c3b5fde83cdd81c2f0ea167064fd2c5c [0,1,0,0,0,0|1,0,1]=3 81 B6R0.4 CC(C)COCF b089fa536e65fca20df885ea5dacd9f2 [0,1,0,0,0,0|1,0,1]=3 82 B6R0.4 CC(C)NCC#N 8d9c5f2bbdfd2e60c34ddc5972663be0 [0,1,0,0,0,0|1,0,2]=4 83 B6R0.4 CC(C)NCCBr a3900e505497b08f4c9baca17b4fa185 [0,1,0,0,0,0|1,0,1]=3 84 B6R0.4 CC(C)NCCF 3152aefd56bd5a8bc9f6ac7f33a6fcdb [0,1,0,0,0,0|1,0,1]=3 85 B6R0.4 CC(C)NCCI 61300b723cb63b92262a59e1c054336d [0,1,0,0,0,0|1,0,1]=3 86 B6R0.4 CC(C)NCCO 3b0ca7166ca7093e2a2ed1b091b6c5af [0,1,0,0,0,0|1,0,1]=3 87 B6R0.4 CC(C)NCCS cdea7056049e21082f31ef0c239da6f7 [0,1,0,0,0,0|1,0,1]=3 88 B6R0.4 CC(C)OCC#N 1be7e1885bd3670d21ecc2d4422857b0 [0,1,0,0,0,0|1,0,2]=4 89 B6R0.4 CC(C)OCC=O 656e3e823b109ec9cd57494110924cc8 [0,1,0,0,0,0|1,0,1]=3 90 B6R0.4 CC(C)OCCF 102209588400e8045c1b7317560b3baf [0,1,0,0,0,0|1,0,1]=3 91 B6R0.4 CC(C)OCCS 9f8fcde0a26cdc1f53f7ed80bebd9fd6 [0,1,0,0,0,0|1,0,1]=3 92 B6R0.4 CC(F)COCF 184378aa5cda319f35eff5a374bd7b36 [0,1,0,0,0,0|2,0,1]=4 93 B6R0.4 CC(O)CNC=O 8669f80d50d055de0db4e7936b8a26b4 [0,1,0,0,0,0|2,0,1]=4 94 B6R0.4 CC(O)CNCF 144c0c9eef2933c1009167efe9e078a9 [0,1,0,0,0,0|2,0,1]=4 95 B6R0.4 CC(O)CNCO e374449d449cacbe0a46d6d64f7dfbfc [0,1,0,0,0,0|2,0,1]=4 96 B6R0.4 CC(S)COCF f0912ffde29b0e269706eb1406d36aad [0,1,0,0,0,0|2,0,1]=4 97 B6R0.4 CCCNC(C)C 4cc952815a9d9d6816d0fb90ac14a178 [0,1,0,0,0,0|0,0,2]=3 98 B6R0.4 CCCOC(C)C 9e8901dd10ed96aa593b6a5525365a05 [0,1,0,0,0,0|0,0,2]=3 99 B6R0.4 CCNCC(C)C 7e39c7f79a4a74429f1ae559b7eef67a [0,1,0,0,0,0|0,0,2]=3 100 B6R0.4 CCNCC(C)O 23f38b24d1514a42c01693786c45a1e6 [0,1,0,0,0,0|1,0,2]=4 101 B6R0.4 CCNC[C@@H](C)O 72a96453a23c9791f4ab7ea0647d5c76 [0,1,0,0,0,0|1,0,2]=4 102 B6R0.4 CCNC[C@H](C)O 8a893664491d34251811ef315cfcf0f6 [0,1,0,0,0,0|1,0,2]=4 103 B6R0.4 CCOCC(C)C 2ccacce0745bb2fe2e67c6f95de49a4c [0,1,0,0,0,0|0,0,2]=3 104 B6R0.4 CCOCC(C)F 44ebcc9497b122666f7d5bc3ab3ef961 [0,1,0,0,0,0|1,0,2]=4 105 B6R0.4 CCOCC(C)S 1b6e2c538b0c5040f1c381953bd73f14 [0,1,0,0,0,0|1,0,2]=4 106 B6R0.4 CCOC[C@@H](C)F 2d70ac2d3ad9d2770f50309e83cd9521 [0,1,0,0,0,0|1,0,2]=4 107 B6R0.4 CCOC[C@H](C)F b1411946299fa054261b7f4dedb203a5 [0,1,0,0,0,0|1,0,2]=4 108 B6R0.4 COCOC(C)C 2db698e0a27d38f57903461e5b8bf21f [0,1,0,0,0,0|1,0,1]=3 109 B6R0.4 CSCOC(C)C df2443d5e1bdbc2f3ac237524c1a32f1 [0,1,0,0,0,0|1,0,1]=3 110 B6R0.4 C[C@@H](F)COCF 2fceb23c1851fd728d248a746424d5d7 [0,1,0,0,0,0|2,0,1]=4 111 B6R0.4 C[C@@H](O)CNC=O 893e330470131b7f4e3b63b1afe5eaa3 [0,1,0,0,0,0|2,0,1]=4 112 B6R0.4 C[C@@H](O)CNCF 8bc2039df53fc164c6fcbe4ce553b9bc [0,1,0,0,0,0|2,0,1]=4 113 B6R0.4 C[C@@H](O)CNCO 41205defeb3accd5b70255f13cc7fa6b [0,1,0,0,0,0|2,0,1]=4 114 B6R0.4 C[C@H](F)COCF e3a81502e05212c96edfcd9edba6a43c [0,1,0,0,0,0|2,0,1]=4 115 B6R0.4 C[C@H](O)CNC=O 3f425a15e29afb471d950c9316d4c9b2 [0,1,0,0,0,0|2,0,1]=4 116 B6R0.4 C[C@H](O)CNCF 7add29147fcdb7b1f2a2a32e12f20796 [0,1,0,0,0,0|2,0,1]=4 117 B6R0.4 C[C@H](O)CNCO 9710122b7591011cacd5f47cf98b8818 [0,1,0,0,0,0|2,0,1]=4 118 B6R0.5 CC(C)(C)NC=O fd731f01e449e88bdf1e84dfcee6c8d2 [0,1,0,0,0,0|2,0,0]=3 119 B6R0.5 CC(C)(C)NCF 3cacbed1609b720894d3f72aa5b5474f [0,1,0,0,0,0|2,0,1]=4 120 B6R0.5 CC(C)(C)NCO 98c610d421d69102d9fd33b99f13912a [0,1,0,0,0,0|2,0,1]=4 121 B6R0.5 CCNC(C)(C)C 075494290386c2ca265fcbc967febc26 [0,1,0,0,0,0|1,0,1]=3 122 B6R1.3 CCNC1CC1 ac3981af76d7269974e900b3cfc5de71 [0,0,0,1,0,0|1,0,1]=3 123 B6R1.3 CCOC1CC1 2c69a519fd7808244f9f88e8c40da7c1 [0,0,0,1,0,0|1,0,1]=3 124 B6R1.3 FCNC1CC1 1715feed97cb051cb760323cf608febe [0,0,0,1,0,0|2,0,1]=4 125 B6R1.3 FCOC1CC1 c80b7a723f6ace17df2859b2130f1eb6 [0,0,0,1,0,0|2,0,1]=4 126 B6R1.3 N#CNC1CC1 e16d88e60b8af9226032f06df181743e [0,0,0,1,0,0|2,0,1]=4 127 B6R1.3 O=CNC1CC1 8f8618d92d234287e5df05f6330bfc1f [0,0,0,1,0,0|2,0,0]=3 128 B6R1.3 OCNC1CC1 101960c0f522708da07270474b234f44 [0,0,0,1,0,0|2,0,1]=4 129 B5R0.3 CCN(C)C=O 60ddb02da2ac3e0bbf46f02c328ae40d [1,1,0,0,0,0|2,0,0]=4 130 B5R0.3 CCN(C)CC ab5b03184b17818ff0d4295949ca4956 [1,1,0,0,0,0|1,0,1]=4 131 B5R0.3 CCN(C)CF f1609b6f0307b235e83ada8bb1f6ec70 [1,1,0,0,0,0|1,0,1]=4 132 B5R0.3 CCN(C)CO 992ae963459eb3513b2ca42228fd2ef7 [1,1,0,0,0,0|1,0,1]=4 133 B5R0.2 CCCNC=O 394eea314e4a7e284e23571b2081e74b [1,1,0,0,0,0|1,0,1]=4 134 B5R0.2 CCCNCC 5224ca4332fe9f083a57aa92376290e9 [1,1,0,0,0,0|0,0,2]=4 135 B5R0.2 CCCNCF 5221ca3b6142d54e68ddcdccc04ade24 [1,1,0,0,0,0|1,0,1]=4 136 B5R0.2 CCCNCO d60b753d66bdce688dd2adf0f18abf34 [1,1,0,0,0,0|1,0,1]=4 137 B5R0.2 CCCOCC a0c48a14a19cfc2180230756acaf40ab [1,1,0,0,0,0|0,0,2]=4 138 B5R0.2 CCCOCF 3a09ada643594a0865eabd839c992d22 [1,1,0,0,0,0|1,0,1]=4 139 B5R0.2 CCNCCBr 6acf983ca8c05ad7adfc0e3d5b4f64f7 [1,1,0,0,0,0|1,0,1]=4 140 B5R0.2 CCNCCF f147a768cf60514004e1bcbf470c3410 [1,1,0,0,0,0|1,0,1]=4 141 B5R0.2 CCNCCI 8421b8d41316967e2680f733246bab7d [1,1,0,0,0,0|1,0,1]=4 142 B5R0.2 CCNCCO 2fc34530a6c959b43319124309163fa3 [1,1,0,0,0,0|1,0,1]=4 143 B5R0.2 CCNCCS e4a2a02ec4ecae7b609beae190ea9ee1 [1,1,0,0,0,0|1,0,1]=4 144 B5R0.2 CCOCCF e5d78433fc996ba51bd8a100b7998155 [1,1,0,0,0,0|1,0,1]=4 145 B5R0.2 CCOCCS 56f6087ed887f762fd2bdcb15935222f [1,1,0,0,0,0|1,0,1]=4 146 B5R0.2 CCOCOC 6cd815448945789916c4199ac0685ffd [1,1,0,0,0,0|1,0,1]=4 147 B5R0.2 O=CNCCBr 7c28f652da8d817ffdc4b1e301878e6d [1,1,0,0,0,0|2,0,0]=4 148 B5R0.2 O=CNCCF cc6ab20072548fa955497a25033be1e2 [1,1,0,0,0,0|2,0,0]=4 149 B5R0.2 O=CNCCI 782f0f8ecb3f6f21bf51449dd497a309 [1,1,0,0,0,0|2,0,0]=4 150 B5R0.2 O=CNCCO 0b79256f67d9aeba37165bf9fc8ffac5 [1,1,0,0,0,0|2,0,0]=4 151 B5R0.2 O=CNCCS 22fad8cac4457d75d73ab95d2ca38298 [1,1,0,0,0,0|2,0,0]=4 152 B7R0.2 C#CC(C)NC(=O)C 30a91f9e689320cab67e7176279a027a [0,2,0,0,0,0|1,0,1]=4 153 B7R0.2 C#CC(C)NC(C)C 1adfd08d21a60fe3922bad2a8cac6fc5 [0,2,0,0,0,0|1,0,1]=4 154 B7R0.2 C#CC(C)OC(C)C bd395c473397c0df03907e2995614562 [0,2,0,0,0,0|1,0,1]=4 155 B7R0.2 C#C[C@@H](C)NC(=O)C b5f4cb4c2ca82f0d4e132f2977db08a6 [0,2,0,0,0,0|1,0,1]=4 156 B7R0.2 C#C[C@@H](C)NC(C)C 4fb0ba4a4d14b34bf0f7402f8af0e7a0 [0,2,0,0,0,0|1,0,1]=4 157 B7R0.2 C#C[C@@H](C)OC(C)C 57b406fc1bff6e055637741c210d864a [0,2,0,0,0,0|1,0,1]=4 158 B7R0.2 C#C[C@H](C)NC(=O)C adfc3d71c946a289355ab55f3775ec5f [0,2,0,0,0,0|1,0,1]=4 159 B7R0.2 C#C[C@H](C)NC(C)C 9a0729fd31b9e7a065041f3f67ecd743 [0,2,0,0,0,0|1,0,1]=4 160 B7R0.2 C#C[C@H](C)OC(C)C 20fe24039694ac0ddbbae904a1c50c14 [0,2,0,0,0,0|1,0,1]=4 161 B7R0.2 C=C(C)CN(C)CC f46aa4737385fde5ecca127cfe0fb11b [0,2,0,0,0,0|1,0,1]=4 162 B7R0.2 C=C(C=O)OC(C)C 1024bdfd369573a0f4c5c31da01d34c1 [0,2,0,0,0,0|1,0,0]=3 163 B7R0.2 C=CC(C)NC(=O)C da0f45e746fe5ddfb85b752dba1a7d5c [0,2,0,0,0,0|1,0,1]=4 164 B7R0.2 C=CC(C)NC(C)C 538c1af40a959f36dd21007158f94b60 [0,2,0,0,0,0|0,0,2]=4 165 B7R0.2 C=CC(C)OC(C)C 532c4624b978961a1c4eda7e3050b228 [0,2,0,0,0,0|0,0,2]=4 166 B7R0.2 C=C[C@H](C)OC(C)C 0e0bab0a84cd6e94202f911cf430b03e [0,2,0,0,0,0|0,0,2]=4 167 B7R0.2 CC(=O)NC(C)C#N 5c82a898464bc97e12136e75988ac4b5 [0,2,0,0,0,0|1,0,1]=4 168 B7R0.2 CC(=O)NC(C)CO 5b33fe0ccef9f04a2ffcb97aafaea882 [0,2,0,0,0,0|1,0,0]=3 169 B7R0.2 CC(=O)N[C@@H](C)CO 6858caa5d94a6988c3c1bcaa83d0b2b8 [0,2,0,0,0,0|1,0,0]=3 170 B7R0.2 CC(=O)N[C@H](C)CO 0b20f01b94b45fad0762ce944038f07e [0,2,0,0,0,0|1,0,0]=3 171 B7R0.2 CC(C)CN(C)C=O b4351ddc68e0590149228e0a5cd05648 [0,2,0,0,0,0|1,0,1]=4 172 B7R0.2 CC(C)CN(C)CF f2a6b79f5877628929a1b31fd183a5d0 [0,2,0,0,0,0|1,0,1]=4 173 B7R0.2 CC(C)CN(C)CO 0b6bf7cc82aa91188fc000497729e3d4 [0,2,0,0,0,0|1,0,1]=4 174 B7R0.2 CC(C)NC(C)C#N 67530a843e87041c95d3c81be4de1aa8 [0,2,0,0,0,0|1,0,1]=4 175 B7R0.2 CC(C)NC(C)CO 7d97b958c7e2d8819c7c1f63bb18ce94 [0,2,0,0,0,0|1,0,1]=4 176 B7R0.2 CC(C)N[C@@H](C)CO cb1d68f0941324aa0f3206f5b48bd94c [0,2,0,0,0,0|1,0,1]=4 177 B7R0.2 CC(C)N[C@H](C)CO f1b0a39369263dcbc11a080cbeb93c35 [0,2,0,0,0,0|1,0,1]=4 178 B7R0.2 CC(C)OC(C)C#N d367aad557142d52591f863ae6f1ec70 [0,2,0,0,0,0|1,0,1]=4 179 B7R0.2 CC(C)OC(C)C=O 46dcc605c08f0d0f96a7a481f23b4bf0 [0,2,0,0,0,0|1,0,1]=4 180 B7R0.2 CC(C)OC(C)CF 4c1a23ea77490e2b6e1f5f1f7c7a9ead [0,2,0,0,0,0|1,0,1]=4 181 B7R0.2 CC(C)OC(C)CS f89a38446eb00d60fe9fa60b597f2b73 [0,2,0,0,0,0|1,0,1]=4 182 B7R0.2 CC(C)O[C@H](C)C=O 3f46dec97b43d031419f8bec573ffcd6 [0,2,0,0,0,0|1,0,1]=4 183 B7R0.2 CC(C)O[C@H](C)CS 75e7bc7c54e109d0d519f886fee3300f [0,2,0,0,0,0|1,0,1]=4 184 B7R0.2 CCC(C)NC(=O)C d52a9bb324dcdb60d53e4e9e2013cb50 [0,2,0,0,0,0|1,0,0]=3 185 B7R0.2 CCC(C)NC(C)C 0cb605662148972b343a2865e41d2f95 [0,2,0,0,0,0|0,0,2]=4 186 B7R0.2 CCC(C)OC(C)C 06c7f52afdb28395f9fa9574a364e474 [0,2,0,0,0,0|0,0,2]=4 187 B7R0.2 CCN(C)CC(C)C b1801f5d5c3a2fe65e0c5338da1b288f [0,2,0,0,0,0|0,0,2]=4 188 B7R0.2 CC[C@@H](C)NC(=O)C c6d5d80303dcfd2ae6eb945ac41b31c0 [0,2,0,0,0,0|1,0,0]=3 189 B7R0.2 CC[C@@H](C)NC(C)C fbd46dfde63f10a9f545bd04d72d3565 [0,2,0,0,0,0|0,0,2]=4 190 B7R0.2 CC[C@@H](C)OC(C)C be2816eab25b2a9101da766270106c57 [0,2,0,0,0,0|0,0,2]=4 191 B7R0.2 CC[C@H](C)NC(=O)C 96d2ad332d2a7d6643a2730e644df4f3 [0,2,0,0,0,0|1,0,0]=3 192 B7R0.2 CC[C@H](C)NC(C)C df85b8e0c4ded03d149c43327f4a7c4a [0,2,0,0,0,0|0,0,2]=4 193 B7R0.2 CC[C@H](C)OC(C)C 2c6d159b250df3bb005afd7417a4b5dc [0,2,0,0,0,0|0,0,2]=4 194 B7R0.3 C/C=C/CN(C)CC a833def0c5a9483904429a6d4fa647bf [0,2,0,0,0,0|1,0,0]=3 195 B7R0.3 C/C=C\CN(C)CC 0d52835f1d4ec546901139cc9ef0efe3 [0,2,0,0,0,0|1,0,0]=3 196 B7R0.3 C=CCNC(C)CC d45d48be61d418ef3d95cad9c5582bbe [0,2,0,0,0,0|0,0,2]=4 197 B7R0.3 C=CCNC(C)CO a948e20f9bd4754ec87302b6fdce81b3 [0,2,0,0,0,0|0,0,2]=4 198 B7R0.3 C=CCN[C@@H](C)CC c610fd310f1909b965f637191eeb2b15 [0,2,0,0,0,0|0,0,2]=4 199 B7R0.3 C=CCN[C@@H](C)CO e3ac2dff9fa8b94ad1bb6f4b16ad0799 [0,2,0,0,0,0|0,0,2]=4 200 B7R0.3 C=CCN[C@H](C)CC 0c789cf00460bd8cdb23c51009c4742c [0,2,0,0,0,0|0,0,2]=4 201 B7R0.3 C=CCN[C@H](C)CO 45438ab57072f0e042c82a4659374125 [0,2,0,0,0,0|0,0,2]=4 202 B7R0.3 C=CCOC(C)CC 787a9267d8fe014db706087d78f6c857 [0,2,0,0,0,0|0,0,2]=4 203 B7R0.3 C=CCOC(C)CF fb11bf0cefab4ea0e38b93cfcee01743 [0,2,0,0,0,0|0,0,2]=4 204 B7R0.3 C=CCOC(C)CS 0ddb9af989e9e9c33b24b66863a996b5 [0,2,0,0,0,0|0,0,2]=4 205 B7R0.3 C=CCO[C@@H](C)CC b304fc3faf864b09563f01310febaac7 [0,2,0,0,0,0|0,0,2]=4 206 B7R0.3 C=CCO[C@H](C)CC 15018d65de2076ec221d9660c184c296 [0,2,0,0,0,0|0,0,2]=4 207 B7R0.3 C=CCO[C@H](C)CS fd43ed19bf853317b3a063b2977abf8d [0,2,0,0,0,0|0,0,2]=4 208 B7R0.3 CC(CF)OCC=O 41897813684ca2355d787ae430508b45 [0,2,0,0,0,0|1,0,1]=4 209 B7R0.3 CC(CF)OCCF 61970d4a8d2156da592b0c1d02226f38 [0,2,0,0,0,0|1,0,1]=4 210 B7R0.3 CC(CF)OCCS 1b0e427f947de38ae03c6161eb7f3753 [0,2,0,0,0,0|1,0,1]=4 211 B7R0.3 CC(CO)CNC=O 24fbd7aa61fab8c89f8d9333e1a09567 [0,2,0,0,0,0|1,0,1]=4 212 B7R0.3 CC(CO)CNCF 8062cd63b1d1a450c851a630bc24bbef [0,2,0,0,0,0|1,0,1]=4 213 B7R0.3 CC(CO)CNCO 21fb23aa708a9b1afe928be1d7d3777a [0,2,0,0,0,0|1,0,1]=4 214 B7R0.3 CC(CO)NCC=O abc80e1c9772f639d76c5de7d6ae2b6e [0,2,0,0,0,0|1,0,1]=4 215 B7R0.3 CC(CO)NCCBr 9d4fd176b9f7156afcd17616b9df73f4 [0,2,0,0,0,0|1,0,1]=4 216 B7R0.3 CC(CO)NCCF 3fb2f9d7a1fb44ff3a81b0f43c3cecd1 [0,2,0,0,0,0|1,0,1]=4 217 B7R0.3 CC(CO)NCCI 5c0bfbc53939f51e926c19c25f286c71 [0,2,0,0,0,0|1,0,1]=4 218 B7R0.3 CC(CO)NCCO 5cd093cef9425d970f2779cfd472d185 [0,2,0,0,0,0|1,0,1]=4 219 B7R0.3 CC(CO)NCCS 7e1b4b642ac91e5af00fd08799aa6e2e [0,2,0,0,0,0|1,0,1]=4 220 B7R0.3 CC(CS)OCC=O 4070359928b4f2d4ef682a3d0e169b5c [0,2,0,0,0,0|1,0,1]=4 221 B7R0.3 CC(CS)OCCF 5a14cb2acfb2d6d25be1b8f12b44b6ed [0,2,0,0,0,0|1,0,1]=4 222 B7R0.3 CC(CS)OCCS 4c5a0494234ba5cfb20d857e8ce0ca08 [0,2,0,0,0,0|1,0,1]=4 223 B7R0.3 CCC(C)CNC=O ebd419a28eb79e00a55acb30bf712ff2 [0,2,0,0,0,0|1,0,1]=4 224 B7R0.3 CCC(C)CNCF b50ea40d2446dde4a785720e8c9ab76e [0,2,0,0,0,0|1,0,1]=4 225 B7R0.3 CCC(C)CNCO a95514de2db5be0c68571e33ca613f6e [0,2,0,0,0,0|1,0,1]=4 226 B7R0.3 CCC(C)COCF d83d0a95392ef09a2490e51164140783 [0,2,0,0,0,0|1,0,1]=4 227 B7R0.3 CCC(C)NCC=O e7aeaed45b54a2e3fad4afa638418830 [0,2,0,0,0,0|1,0,1]=4 228 B7R0.3 CCC(C)NCCBr a824f3363a2868a7206559546a3484f0 [0,2,0,0,0,0|1,0,1]=4 229 B7R0.3 CCC(C)NCCF 2a8d3394dec4d41ce38c860bf4ab17dd [0,2,0,0,0,0|1,0,1]=4 230 B7R0.3 CCC(C)NCCI 6c2db2487fbf25506eed8cabe391bbb0 [0,2,0,0,0,0|1,0,1]=4 231 B7R0.3 CCC(C)NCCO 513c7a6bd13dc3bbf026a87954b89604 [0,2,0,0,0,0|1,0,1]=4 232 B7R0.3 CCC(C)NCCS 7a8d315a94e5493fa661ae8da8c0d7d5 [0,2,0,0,0,0|1,0,1]=4 233 B7R0.3 CCC(C)NCOC 7706fa764743624f662862fda01b7a28 [0,2,0,0,0,0|1,0,1]=4 234 B7R0.3 CCC(C)NCSC c04eb7da5ed0a2a03e68485c2016666a [0,2,0,0,0,0|1,0,1]=4 235 B7R0.3 CCC(C)OCC=O 3048fa7b9eb03a623d9ab002261defa2 [0,2,0,0,0,0|1,0,1]=4 236 B7R0.3 CCC(C)OCCF b50b83f4cc04a33902077c0b3a238cbc [0,2,0,0,0,0|1,0,1]=4 237 B7R0.3 CCC(C)OCCS 0b195719e1e4b78092bc0c0213134f4f [0,2,0,0,0,0|1,0,1]=4 238 B7R0.3 CCC(C)OCOC 7b2a5b8cb8aef52b76ee0f9de192d2d0 [0,2,0,0,0,0|1,0,1]=4 239 B7R0.3 CCC(C)OCSC a5a0b25f047959799e9ece96fa20b187 [0,2,0,0,0,0|1,0,1]=4 240 B7R0.3 CCCNC(C)CC 943eb030d61b8e5bd9a7ef7a782a9e18 [0,2,0,0,0,0|0,0,2]=4 241 B7R0.3 CCCNC(C)CO ef58a4cf57fdde87a0f1c08020c4e142 [0,2,0,0,0,0|0,0,2]=4 242 B7R0.3 CCCN[C@@H](C)CC 9b5d6f86dd01bda6e2759939f83bc7a8 [0,2,0,0,0,0|0,0,2]=4 243 B7R0.3 CCCN[C@@H](C)CO 9717e8befa87e4e1275959dce684e068 [0,2,0,0,0,0|0,0,2]=4 244 B7R0.3 CCCN[C@H](C)CC 1516fdad8637f0b3c763f64cc7a7beb7 [0,2,0,0,0,0|0,0,2]=4 245 B7R0.3 CCCN[C@H](C)CO 7bbdc293a56e3b9e5394e782c67eaddd [0,2,0,0,0,0|0,0,2]=4 246 B7R0.3 CCCOC(C)CC 98a624a488dc392a35e8b0b44aac3f30 [0,2,0,0,0,0|0,0,2]=4 247 B7R0.3 CCCOC(C)CF 9754423e03bd9c1680aa4f64130d3218 [0,2,0,0,0,0|0,0,2]=4 248 B7R0.3 CCCOC(C)CS 3831bbe85ee4c34ff42a76d0b53dbb5c [0,2,0,0,0,0|0,0,2]=4 249 B7R0.3 CCCO[C@@H](C)CC af9e77ade15ce19a7659cd0cba0e805a [0,2,0,0,0,0|0,0,2]=4 250 B7R0.3 CCCO[C@H](C)CC aceb38a7b284bb9c5e1ae0a6fb45caa0 [0,2,0,0,0,0|0,0,2]=4 251 B7R0.3 CCCO[C@H](C)CS 34c71dbcb154ce995a79e0481e98962a [0,2,0,0,0,0|0,0,2]=4 252 B7R0.3 CCN(C)C/C=C/Cl 823585dad91397251f5e992cc63297db [0,2,0,0,0,0|2,0,0]=4 253 B7R0.3 CCN(C)C/C=C\Cl c5e2db65672dae81ab8ccdee907a4957 [0,2,0,0,0,0|2,0,0]=4 254 B7R0.3 CCN(C)C/C=C\O 60deab8000357700021216d9934790c2 [0,2,0,0,0,0|2,0,0]=4 255 B7R0.3 CCNCC(C)CC 1a6ded6349edd095188d6a9fb8900c29 [0,2,0,0,0,0|0,0,2]=4 256 B7R0.3 CCNCC(C)CO ded6e5c82cb05dc8e16cf8630e1ca3b5 [0,2,0,0,0,0|0,0,2]=4 257 B7R0.3 CCNC[C@@H](C)CC 79edf92db75b8292301b7cbe642600de [0,2,0,0,0,0|0,0,2]=4 258 B7R0.3 CCNC[C@@H](C)OC 6e88fe4f7175c837d5238f2168d0e9a3 [0,2,0,0,0,0|0,0,2]=4 259 B7R0.3 CCNC[C@H](C)CO ef051a7bca96170e9f6bad04a99231e7 [0,2,0,0,0,0|0,0,2]=4 260 B7R0.3 CCNC[C@H](C)OC 0584eeded494335d50fae9461e407d42 [0,2,0,0,0,0|0,0,2]=4 261 B7R0.3 CCOCC(C)CC b48ffd68a9924a596413f28a1f26cd9a [0,2,0,0,0,0|0,0,2]=4 262 B7R0.3 CCOCC(C)OC 00214de46f1604d32f121bd91c115789 [0,2,0,0,0,0|0,0,2]=4 263 B7R0.3 CCOC[C@@H](C)CC 24d1c149f27d56a7b1370d3d84a93c4a [0,2,0,0,0,0|0,0,2]=4 264 B7R0.3 CCOC[C@@H](C)OC ecceb3df9b78b58b5b76fdc0f6911e92 [0,2,0,0,0,0|0,0,2]=4 265 B7R0.3 CCOC[C@H](C)CC e4857d3b038c108c7619c84891e8a2f7 [0,2,0,0,0,0|0,0,2]=4 266 B7R0.3 CCOC[C@H](C)OC fd13d8de7d92a89af8eab0e711a6bd02 [0,2,0,0,0,0|0,0,2]=4 267 B7R0.3 CC[C@@H](C)COCF 27ee9a97e87757a57bbd2473b47c8a0b [0,2,0,0,0,0|1,0,1]=4 268 B7R0.3 CC[C@@H](C)NCC=O 728ce0e6b12a20079c33ab77be7d6271 [0,2,0,0,0,0|1,0,1]=4 269 B7R0.3 CC[C@@H](C)NCCF 93d07692499e3b9aec2552214e2ff53f [0,2,0,0,0,0|1,0,1]=4 270 B7R0.3 CC[C@@H](C)NCCO 72cce7ce1a4c2aadd49ed6fa51eb30e5 [0,2,0,0,0,0|1,0,1]=4 271 B7R0.3 CC[C@@H](C)NCCS 34946916ab9d46b94332e25fb6d97f4b [0,2,0,0,0,0|1,0,1]=4 272 B7R0.3 CC[C@@H](C)NCOC 6f18e43812c50f5929ea1f0282d55276 [0,2,0,0,0,0|1,0,1]=4 273 B7R0.3 CC[C@@H](C)NCSC b2ccc0121f9ed49266567b6f15a655a0 [0,2,0,0,0,0|1,0,1]=4 274 B7R0.3 CC[C@@H](C)OCC=O fcdaaaea8501897d08b7daa2ec02db5c [0,2,0,0,0,0|1,0,1]=4 275 B7R0.3 CC[C@@H](C)OCCF 9a9e445f08d44c81e417052c615c3334 [0,2,0,0,0,0|1,0,1]=4 276 B7R0.3 CC[C@@H](C)OCCS c58b0dc1d2db79db526d0ab1218bffc7 [0,2,0,0,0,0|1,0,1]=4 277 B7R0.3 CC[C@@H](C)OCOC 5dd2de1ba91f6cde19e7a670f775c35c [0,2,0,0,0,0|1,0,1]=4 278 B7R0.3 CC[C@@H](C)OCSC 07780bc57acd6b7b99e87c445c42d82f [0,2,0,0,0,0|1,0,1]=4 279 B7R0.3 CC[C@H](C)CNC=O 8ddf4a7afc076d1492904a4e2d1a92ee [0,2,0,0,0,0|1,0,1]=4 280 B7R0.3 CC[C@H](C)CNCF d271465589c016cce21e3753bb72dfde [0,2,0,0,0,0|1,0,1]=4 281 B7R0.3 CC[C@H](C)CNCO 0fe58ceb43d0411047b54aeefa27fcda [0,2,0,0,0,0|1,0,1]=4 282 B7R0.3 CC[C@H](C)COCF 4d1b50442964dee0f36120907b5bf9ca [0,2,0,0,0,0|1,0,1]=4 283 B7R0.3 CC[C@H](C)NCC=O b6d86a7489e7187a7b6be26ba88b7b85 [0,2,0,0,0,0|1,0,1]=4 284 B7R0.3 CC[C@H](C)NCCF c11007e79ee49cb1e974e79b53eb68c8 [0,2,0,0,0,0|1,0,1]=4 285 B7R0.3 CC[C@H](C)NCCO 14df35d641eb74814d616543d777742c [0,2,0,0,0,0|1,0,1]=4 286 B7R0.3 CC[C@H](C)NCCS e1691e0903c1eea23ce2232b4f4ff483 [0,2,0,0,0,0|1,0,1]=4 287 B7R0.3 CC[C@H](C)NCOC 487baefd593a366fd401fe5a0b33d07a [0,2,0,0,0,0|1,0,1]=4 288 B7R0.3 CC[C@H](C)NCSC b4999c020810a33e4d86f949175dda2d [0,2,0,0,0,0|1,0,1]=4 289 B7R0.3 CC[C@H](C)OCC=O 1749dffdbae3c22c50ca54c1db5fd2b4 [0,2,0,0,0,0|1,0,1]=4 290 B7R0.3 CC[C@H](C)OCCF b495df4c5acd12e724246ab7aab5bcc3 [0,2,0,0,0,0|1,0,1]=4 291 B7R0.3 CC[C@H](C)OCCS d78ff3c7dda26d3bc7cef65283cd3558 [0,2,0,0,0,0|1,0,1]=4 292 B7R0.3 CC[C@H](C)OCOC 841bb4da5d82dffee5f6f29fdb10c40b [0,2,0,0,0,0|1,0,1]=4 293 B7R0.3 CC[C@H](C)OCSC 879c6380126ff9fd0bdc6f15a431ea23 [0,2,0,0,0,0|1,0,1]=4 294 B7R0.3 COC(C)COCF c722a3f5401ca397f89df05f571bb3b2 [0,2,0,0,0,0|1,0,1]=4 295 B7R0.3 COCNC(C)CO d9fc4f8dca5bf8aac173b2beda690449 [0,2,0,0,0,0|1,0,1]=4 296 B7R0.3 COCN[C@@H](C)CO 9f63bce992902a4f83c57ec0b08063e7 [0,2,0,0,0,0|1,0,1]=4 297 B7R0.3 COCN[C@H](C)CO c2d3c8f32c0c9b24129dc2255add4931 [0,2,0,0,0,0|1,0,1]=4 298 B7R0.3 COCOC(C)CF 6a9dcf8f1b1aaa2624756f79d32e8649 [0,2,0,0,0,0|1,0,1]=4 299 B7R0.3 CO[C@@H](C)CNC=O cbdf409ea735afb7a574d69375fb28db [0,2,0,0,0,0|1,0,1]=4 300 B7R0.3 CO[C@@H](C)CNCF d565ed3e1243bb1223e9664c2fc97af8 [0,2,0,0,0,0|1,0,1]=4 301 B7R0.3 CO[C@@H](C)CNCO ff28fd2c886f6ee1545aaf943963c99e [0,2,0,0,0,0|1,0,1]=4 302 B7R0.3 CO[C@@H](C)COCF 6e6ff1c74d26861c98bac3895e10d598 [0,2,0,0,0,0|1,0,1]=4 303 B7R0.3 CO[C@H](C)CNC=O 943b01dc3bd1c6157c7dfb62f870e0a6 [0,2,0,0,0,0|1,0,1]=4 304 B7R0.3 CO[C@H](C)CNCF ceaa416f9fa3f4676b4c6f05e53da533 [0,2,0,0,0,0|1,0,1]=4 305 B7R0.3 CO[C@H](C)CNCO ef2aaae2be2c576592de749a4d18a6e8 [0,2,0,0,0,0|1,0,1]=4 306 B7R0.3 CO[C@H](C)COCF 0c169ac11c6c9290a799aeebebac70a7 [0,2,0,0,0,0|1,0,1]=4 307 B7R0.3 CSCNC(C)CO 6d4e5438054fc7d727ab269c682f1f18 [0,2,0,0,0,0|1,0,1]=4 308 B7R0.3 CSCN[C@@H](C)CO 902809602258c785ac8e71bdd59c992c [0,2,0,0,0,0|1,0,1]=4 309 B7R0.3 CSCN[C@H](C)CO a6e9f797fabfba51a16375762c3c5872 [0,2,0,0,0,0|1,0,1]=4 310 B7R0.3 CSCOC(C)CF 65e26bd5fd3fba937ab56c5fd2b72624 [0,2,0,0,0,0|1,0,1]=4 311 B7R0.3 CSCOC(C)CS e72ba884b9015d7996527663a2b23dcf [0,2,0,0,0,0|1,0,1]=4 312 B7R0.3 CSCO[C@H](C)CS f2b1cd8743208a95078103d175668411 [0,2,0,0,0,0|1,0,1]=4 313 B7R0.3 C[C@@H](CO)NCC=O 20c7bf02d372e36cba042ac5b28907f5 [0,2,0,0,0,0|1,0,1]=4 314 B7R0.3 C[C@@H](CO)NCCBr 5bfdda3a2e7eed27dfaa991ff0ef97da [0,2,0,0,0,0|1,0,1]=4 315 B7R0.3 C[C@@H](CO)NCCF c52aa10a04722f940d2009fa7a4930ad [0,2,0,0,0,0|1,0,1]=4 316 B7R0.3 C[C@@H](CO)NCCI 6bdc75e50c6dc3234bc69f090327544f [0,2,0,0,0,0|1,0,1]=4 317 B7R0.3 C[C@@H](CO)NCCO f533b151726db8df114b2e138c242e75 [0,2,0,0,0,0|1,0,1]=4 318 B7R0.3 C[C@@H](CO)NCCS 7391d6153b1cb03960b0fd4a99934217 [0,2,0,0,0,0|1,0,1]=4 319 B7R0.3 C[C@H](CO)CNC=O 32037413a41facbb9dd3661f525eb476 [0,2,0,0,0,0|1,0,1]=4 320 B7R0.3 C[C@H](CO)CNCF f5548f2764a66a9258eff90a77f81616 [0,2,0,0,0,0|1,0,1]=4 321 B7R0.3 C[C@H](CO)CNCO e7c0a7e8a9580f5a7445a0921a5a0780 [0,2,0,0,0,0|1,0,1]=4 322 B7R0.3 C[C@H](CO)NCC=O 1a3e3f6cab470e0221e0a223d10de41c [0,2,0,0,0,0|1,0,1]=4 323 B7R0.3 C[C@H](CO)NCCBr cfab7907db9e63f890c879384e24e5b4 [0,2,0,0,0,0|1,0,1]=4 324 B7R0.3 C[C@H](CO)NCCF cb91bb5edb2a0c63c570d34f11071d1c [0,2,0,0,0,0|1,0,1]=4 325 B7R0.3 C[C@H](CO)NCCI 7e2db315aeaaac49480cb09083a749f2 [0,2,0,0,0,0|1,0,1]=4 326 B7R0.3 C[C@H](CO)NCCO 57e737113b903a53b0864be81471f1e6 [0,2,0,0,0,0|1,0,1]=4 327 B7R0.3 C[C@H](CO)NCCS ca2eaea9731c563c60cf01430832dca9 [0,2,0,0,0,0|1,0,1]=4 328 B7R0.3 C[C@H](CS)OCC=O 54b8c633a4f5d8e7a615987326df81f2 [0,2,0,0,0,0|1,0,1]=4 329 B7R0.3 C[C@H](CS)OCCF e802a848389fb605db8d861c1c53c8bb [0,2,0,0,0,0|1,0,1]=4 330 B7R0.3 C[C@H](CS)OCCS f4b2ba60b9ef84050b5c98d7dfd70389 [0,2,0,0,0,0|1,0,1]=4 331 B7R0.5 C=CCN(C)C(C)C 96de01368c533ec0e3507154958af2ed [0,2,0,0,0,0|0,0,2]=4 332 B7R0.5 CC(C)C(C)NC=O 4e819ff0160e7ed0f2ff22f1b3980c8f [0,2,0,0,0,0|1,0,1]=4 333 B7R0.5 CC(C)C(C)NCF 643136cdaccdc2c2feaceaf8387098cb [0,2,0,0,0,0|1,0,1]=4 334 B7R0.5 CC(C)C(C)NCO 3e5c534ac08ff52ad797b9ecde6db54e [0,2,0,0,0,0|1,0,1]=4 335 B7R0.5 CC(C)C(C)OCF 80276d10e0b66e37d961ea14d47b0969 [0,2,0,0,0,0|1,0,1]=4 336 B7R0.5 CC(C)N(C)CC=O dce9ec45ecad4267effdc3296bdfc642 [0,2,0,0,0,0|1,0,1]=4 337 B7R0.5 CC(C)N(C)CCF bb72ad0b6f8866b4436bef306a64fc30 [0,2,0,0,0,0|1,0,1]=4 338 B7R0.5 CC(C)N(C)CCO 81a28f5ee4f12e11b2d2f617ef1d3581 [0,2,0,0,0,0|1,0,1]=4 339 B7R0.5 CC(C)N(C)CCS c1764d6a23c86a90688037664afc4e82 [0,2,0,0,0,0|1,0,1]=4 340 B7R0.5 CC(C)[C@@H](C)NC=O 83a0d0bfb3b7ec5a070ad221a7115b67 [0,2,0,0,0,0|1,0,1]=4 341 B7R0.5 CC(C)[C@@H](C)NCF b41e18f15d7a7a980d0fe6a1eba98267 [0,2,0,0,0,0|1,0,1]=4 342 B7R0.5 CC(C)[C@@H](C)NCO dae9283d092fb775f557bbf40fd5342a [0,2,0,0,0,0|1,0,1]=4 343 B7R0.5 CC(C)[C@@H](C)OCF 424651f56e9c7a59f079f55fb4486da5 [0,2,0,0,0,0|1,0,1]=4 344 B7R0.5 CC(C)[C@H](C)NC=O bcc2ba4727ee5d240548f8fc29a1480b [0,2,0,0,0,0|1,0,1]=4 345 B7R0.5 CC(C)[C@H](C)NCF e48701e9d3440c0ecd05eac322b8d2d3 [0,2,0,0,0,0|1,0,1]=4 346 B7R0.5 CC(C)[C@H](C)NCO 8adad5810c92a16d836b9deea9f0a802 [0,2,0,0,0,0|1,0,1]=4 347 B7R0.5 CC(C)[C@H](C)OCF 6f8956e151353b4df44e100c25e804da [0,2,0,0,0,0|1,0,1]=4 348 B7R0.5 CC(O)C(C)NC=O 260810e8bba0286df97574f1b44d4d22 [0,2,0,0,0,0|2,0,0]=4 349 B7R0.5 CCCN(C)C(C)C 3141e8fbdc6c20712cffde27068901ab [0,2,0,0,0,0|0,0,2]=4 350 B7R0.5 CCNC(C)C(C)C 6ff6c70a41ff0de8b891e50966ef9339 [0,2,0,0,0,0|0,0,2]=4 351 B7R0.5 CCNC(C)C(C)O 392d96cf423ba6d8f5882a82ddace883 [0,2,0,0,0,0|1,0,1]=4 352 B7R0.5 CCN[C@@H](C)C(C)C 54d4aa17c71caa18f971b7cc220c5c61 [0,2,0,0,0,0|0,0,2]=4 353 B7R0.5 CCN[C@@H](C)C(F)F f76fde6ed819e493c6854180a8253124 [0,2,0,0,0,0|1,0,1]=4 354 B7R0.5 CCN[C@H](C)C(C)C 26ce300d7da809c460e59e21a4343853 [0,2,0,0,0,0|0,0,2]=4 355 B7R0.5 CCN[C@H](C)C(F)F 9d31d6515dd78ca74d9458514fa1e8c8 [0,2,0,0,0,0|1,0,1]=4 356 B7R0.5 CCOC(C)C(=O)C 04432572fe22b740e86ca5259d0a3bbf [0,2,0,0,0,0|1,0,1]=4 357 B7R0.5 CCOC(C)C(C)C bb142acd6bd0d3536405c513b06eea53 [0,2,0,0,0,0|0,0,2]=4 358 B7R0.5 CCOC(C)C(C)S e76d621ef1113c6e6d1e86237ce3aa29 [0,2,0,0,0,0|1,0,1]=4 359 B7R0.5 CCOC(C)C(F)F 6f25fcdcd396a613a3486f9e7e152366 [0,2,0,0,0,0|1,0,1]=4 360 B7R0.5 CCO[C@@H](C)C(C)C 730945e6bcfbc2b11622279903eef1de [0,2,0,0,0,0|0,0,2]=4 361 B7R0.5 CCO[C@H](C)C(C)C 443e2922f1cca86413940e6d728bd16d [0,2,0,0,0,0|0,0,2]=4 362 B7R0.5 COCN(C)C(C)C 56238f6328cf364463db0f0876210615 [0,2,0,0,0,0|1,0,1]=4 363 B7R0.5 CSCN(C)C(C)C 6bade958cb762672bfe3ad82fb307ca1 [0,2,0,0,0,0|1,0,1]=4 364 B7R0.5 C[C@@H](NC=O)C(F)F 7a46175a666eebcaecea38c10d41c5f2 [0,2,0,0,0,0|2,0,0]=4 365 B7R0.5 C[C@H](NC=O)C(F)F 5e0cefc125bbd8fa20819b1d21e2b0ce [0,2,0,0,0,0|2,0,0]=4 366 B7R0.7 C#CCC(C)OCC c1f6c314cdd73a7fa8ad58ddb797863b [0,2,0,0,0,0|1,0,1]=4 367 B7R0.7 C/C=C/C(C)OCC 2ab4f7797f6c67b991e2e31923687bf2 [0,2,0,0,0,0|0,0,0]=2 368 B7R0.7 C/C=C/C(C)OCF 3320ba4ae2d9fdbf44f9979a869dffee [0,2,0,0,0,0|0,0,0]=2 369 B7R0.7 C=CCC(C)OCC e661cd10cce572a7601633678f7f6510 [0,2,0,0,0,0|0,0,2]=4 370 B7R0.7 C=CCC(C)OCF 2ea57e9504db84bdaa251cea2b6d235a [0,2,0,0,0,0|0,0,2]=4 371 B7R0.7 C=CC[C@@H](C)OCC 077d825b2d79fe5b7d34cfc8a591b694 [0,2,0,0,0,0|0,0,2]=4 372 B7R0.7 C=CC[C@@H](C)OCF 51977b3390daf4ec7d8c8b67e41f6ec4 [0,2,0,0,0,0|0,0,2]=4 373 B7R0.7 C=CC[C@H](C)OCC 67560b27043d123cb27b1dfe36dce4bb [0,2,0,0,0,0|0,0,2]=4 374 B7R0.7 C=CC[C@H](C)OCF e1a26aac47576e318dc06827e291df9a [0,2,0,0,0,0|0,0,2]=4 375 B7R0.7 CC#CC(C)OCC 7d169bd73109df0adecd56f315bb5686 [0,2,0,0,0,0|0,0,2]=4 376 B7R0.7 CC#CC(C)OCF 120399d6c9f7a5f34dd4ff1f36895efd [0,2,0,0,0,0|0,0,2]=4 377 B7R0.7 CC(CC#N)NC=O dfc1f8290024fbf8549fe517f54abe5f [0,2,0,0,0,0|2,0,0]=4 378 B7R0.7 CC(CCO)NC=O 892cc7a0d08c79535b8216399ec9a52d [0,2,0,0,0,0|2,0,0]=4 379 B7R0.7 CC=CC(C)OCC 5361522f2e573115d5b96113c76c93d1 [0,2,0,0,0,0|0,0,0]=2 380 B7R0.7 CC=CC(C)OCF 320a75cf236278cddb0a50a5acdd75bf [0,2,0,0,0,0|0,0,0]=2 381 B7R0.7 CCCC(C)NC=O 3b3fdc3aff176c80def2c27de1055661 [0,2,0,0,0,0|2,0,0]=4 382 B7R0.7 CCCC(C)NCC 30687af6c4de8dad0ff98831d5157fbe [0,2,0,0,0,0|0,0,2]=4 383 B7R0.7 CCCC(C)NCF 6fe7178c87e8240823259ce8a94eea0d [0,2,0,0,0,0|0,0,2]=4 384 B7R0.7 CCCC(C)NCO a80a7e4a0f1d75fc2436d616e073099f [0,2,0,0,0,0|0,0,2]=4 385 B7R0.7 CCCC(C)OCC f8a13dff786165aad9d4cfd77470c868 [0,2,0,0,0,0|0,0,2]=4 386 B7R0.7 CCCC(C)OCF e53aa9a0be571d844376e05ef43b0243 [0,2,0,0,0,0|0,0,2]=4 387 B7R0.7 CCC[C@@H](C)OCC ad566fabe40b68a5eff8830d607c6d5f [0,2,0,0,0,0|0,0,2]=4 388 B7R0.7 CCC[C@@H](C)OCF 7663802c803efdb5ffdb71e415c741b7 [0,2,0,0,0,0|0,0,2]=4 389 B7R0.7 CCC[C@H](C)NC=O d7593154c1a9fc5db070af269735e419 [0,2,0,0,0,0|2,0,0]=4 390 B7R0.7 CCC[C@H](C)NCC 753d5a7572fe2b9f2fd164a2491a308c [0,2,0,0,0,0|0,0,2]=4 391 B7R0.7 CCC[C@H](C)NCF bb5a2f2a6bcb2a0616cca7690ac17090 [0,2,0,0,0,0|0,0,2]=4 392 B7R0.7 CCC[C@H](C)NCO b51a8cc4d30d5ddff8232517fc6ea6d0 [0,2,0,0,0,0|0,0,2]=4 393 B7R0.7 CCC[C@H](C)OCC 1fee3bcf808f20e21cce64abf5182523 [0,2,0,0,0,0|0,0,2]=4 394 B7R0.7 CCC[C@H](C)OCF aaf4041a99f006e154459098e0beb231 [0,2,0,0,0,0|0,0,2]=4 395 B7R0.7 CCNC(C)CC#N 896c231cd495c6357e72819fab470c66 [0,2,0,0,0,0|1,0,1]=4 396 B7R0.7 CCNC(C)CCO 6d74a4cbe1e8603263eb7a06e9e0b8fd [0,2,0,0,0,0|1,0,1]=4 397 B7R0.7 CCNC(C)COC af3d09b9c16b18b44031a6b489b2fd56 [0,2,0,0,0,0|1,0,1]=4 398 B7R0.7 CCN[C@@H](C)CCO 120d76e4d5f3a5851fb1fd775a67dcd3 [0,2,0,0,0,0|1,0,1]=4 399 B7R0.7 CCN[C@@H](C)COC 3587673ce83b198299c531f233570bde [0,2,0,0,0,0|1,0,1]=4 400 B7R0.7 CCN[C@H](C)CCO d88e997127477e2d2a92514b9d55e900 [0,2,0,0,0,0|1,0,1]=4 401 B7R0.7 CCN[C@H](C)COC 769259f23e0c7be858a9664721e9e588 [0,2,0,0,0,0|1,0,1]=4 402 B7R0.7 CCOC(C)CC#N 74c7ff950e02e978c381dad00f0222ea [0,2,0,0,0,0|1,0,1]=4 403 B7R0.7 CCOC(C)COC fe243350564a7dc6ae1ae7113d5524f6 [0,2,0,0,0,0|1,0,1]=4 404 B7R0.7 CCOC(C)CSC e325c79726bf48130f9e676fa3908dca [0,2,0,0,0,0|1,0,1]=4 405 B7R0.7 CCO[C@@H](C)CC#N 79f640333f75719e0019c555e2ed7c25 [0,2,0,0,0,0|1,0,1]=4 406 B7R0.7 CCO[C@@H](C)COC f439908527642fb0fb69029fa9f8bc89 [0,2,0,0,0,0|1,0,1]=4 407 B7R0.7 CCO[C@H](C)CC#N 853352ce16f989e76716e5f2635f2407 [0,2,0,0,0,0|1,0,1]=4 408 B7R0.7 CCO[C@H](C)COC 9a86a7ea1ccd0f751a8074ffc2bb4277 [0,2,0,0,0,0|1,0,1]=4 409 B7R0.7 COCC(C)NC=O 45a0b649e4600219d555cc1f9498bdc8 [0,2,0,0,0,0|2,0,0]=4 410 B7R0.7 COCC(C)NCF 37ce3660c3b090e9f9edd5124bcdcd9a [0,2,0,0,0,0|1,0,1]=4 411 B7R0.7 COCC(C)NCO 6c5d5187b65d28bd76ca5cd109efad49 [0,2,0,0,0,0|1,0,1]=4 412 B7R0.7 COCC(C)OCF ba759e057fe1b6bc36072f0ed66c672a [0,2,0,0,0,0|1,0,1]=4 413 B7R0.7 COC[C@@H](C)NC=O d1500602ed7da53624fa7ed4337a50c3 [0,2,0,0,0,0|2,0,0]=4 414 B7R0.7 COC[C@@H](C)NCF a6548424f9201b13ac58df133eb2a24a [0,2,0,0,0,0|1,0,1]=4 415 B7R0.7 COC[C@@H](C)NCO 5b123b6ebd0e85051da558c3ea88e6ed [0,2,0,0,0,0|1,0,1]=4 416 B7R0.7 COC[C@@H](C)OCF 8f42f68524f58334b9b291fd96846ba2 [0,2,0,0,0,0|1,0,1]=4 417 B7R0.7 COC[C@H](C)NC=O 9ace0af38b8cac4dc5e5d6d9564d36a8 [0,2,0,0,0,0|2,0,0]=4 418 B7R0.7 COC[C@H](C)NCF 7304476e002e28def6ba549158f64fb0 [0,2,0,0,0,0|1,0,1]=4 419 B7R0.7 COC[C@H](C)NCO d58653f64afc5f3d3534e35a74eeeaa8 [0,2,0,0,0,0|1,0,1]=4 420 B7R0.7 COC[C@H](C)OCF a6a8493c8eb55af12b084ba1e2d842c6 [0,2,0,0,0,0|1,0,1]=4 421 B7R0.7 CSCC(C)OCF 689a149956402544a2d3e6be9443efc2 [0,2,0,0,0,0|1,0,1]=4 422 B7R0.7 C[C@@H](CCO)NC=O eb95ec52954fcdf5dbae515a1b580040 [0,2,0,0,0,0|2,0,0]=4 423 B7R0.7 C[C@H](CCO)NC=O b74e456417922c93cc7901b1f7160ec1 [0,2,0,0,0,0|2,0,0]=4 424 B7R0.10 C=CC(=O)N(C)CC 5cdce1a1cd893d8ab1284f8177670f55 [0,2,0,0,0,0|1,0,1]=4 425 B7R0.10 CC(CO)N(C)C=O 4659927dd4489ef42e67e78276d3b1b4 [0,2,0,0,0,0|2,0,0]=4 426 B7R0.10 CCC(=O)N(C)CC 307c98a15c6ddf11013971017d018a3f [0,2,0,0,0,0|1,0,1]=4 427 B7R0.10 CCC(C)N(C)C=O aaa2a77e867aed83923621e3629d674e [0,2,0,0,0,0|2,0,0]=4 428 B7R0.10 CCC(C)N(C)CC 7f98f3cb5d001a509589f6f457ffe6ca [0,2,0,0,0,0|1,0,1]=4 429 B7R0.10 CCN(C)C(=O)C=O db5732fec82020b1e06387d47e0f63dc [0,2,0,0,0,0|2,0,0]=4 430 B7R0.10 CCN(C)C(C)CO bebabfe649434d11c02db23f8c999491 [0,2,0,0,0,0|1,0,1]=4 431 B7R0.10 CCN(C)[C@@H](C)CO 0928581d52d4c504aa98f7d51aa86889 [0,2,0,0,0,0|1,0,1]=4 432 B7R0.10 CCN(C)[C@H](C)CO 9f8b649df632bf19345f656ecd33a6ed [0,2,0,0,0,0|1,0,1]=4 433 B7R0.10 C[C@@H](CO)N(C)C=O b94b965b512745cf284fdc052a9474ae [0,2,0,0,0,0|2,0,0]=4 434 B7R0.10 C[C@H](CO)N(C)C=O c4c1d9e89c0731cbc76ea32ef421fbca [0,2,0,0,0,0|2,0,0]=4 435 B7R0.11 C#CC(C)(C)NC=O eec20f4791fae3c1459af6a385ff52d7 [0,2,0,0,0,0|2,0,0]=4 436 B7R0.11 C#CC(C)(C)NCC 4e7a2dc62b6da47e4e55e15fbb84ccfc [0,2,0,0,0,0|1,0,1]=4 437 B7R0.11 CC(C)(C#N)NC=O bdc2e7f7dc73aab830e5294af0434498 [0,2,0,0,0,0|2,0,0]=4 438 B7R0.11 CC(C)(CF)NC=O ff7fc0b5fb780004ba739902f541960d [0,2,0,0,0,0|2,0,0]=4 439 B7R0.11 CC(C)(CO)NC=O b948c4623b1c99369aaa53f2724551dc [0,2,0,0,0,0|2,0,0]=4 440 B7R0.11 CCC(C)(C)NC=O 467bc47a116e7d37bf8e07bc1f187838 [0,2,0,0,0,0|2,0,0]=4 441 B7R0.11 CCNC(C)(C)C#N a6aa7c2beec82958604a84b90bc324e8 [0,2,0,0,0,0|1,0,1]=4 442 B7R0.11 CCNC(C)(C)CC adae57986ab49a20b402c3b11b898ff8 [0,2,0,0,0,0|1,0,1]=4 443 B7R0.11 CCNC(C)(C)CF bb534d52eb5abb944f47ed497fecbe74 [0,2,0,0,0,0|1,0,1]=4 444 B7R0.11 CCNC(C)(C)CO cfe1036a3afdbdcb353cbcf66ecedd65 [0,2,0,0,0,0|1,0,1]=4 445 B7R0.12 CCC(CC)NC=O 4175bd0bc40e9e83245363507b336b46 [0,2,0,0,0,0|2,0,0]=4 446 B7R0.12 CCC(CO)NC=O 742cd9cb7df8523077fcd6bd9de1d480 [0,2,0,0,0,0|2,0,0]=4 447 B7R0.12 CCNC(CC)CC dd1a7011b4f855f8c1ad87e5ad908f9a [0,2,0,0,0,0|1,0,1]=4 448 B7R0.12 CCNC(CC)CO 69eb8cb0bab039daf9654224be723bd4 [0,2,0,0,0,0|1,0,1]=4 449 B7R0.12 CCNC(CO)CO c3e79c4c97ee2b42d70122fc2549f86f [0,2,0,0,0,0|1,0,1]=4 450 B7R0.12 CCN[C@@H](CC)CO 58754a8a804d698e6257db6bc4cb95b3 [0,2,0,0,0,0|1,0,1]=4 451 B7R0.12 CCN[C@H](CC)CO 5b608cb220323f541c9afa99df78f847 [0,2,0,0,0,0|1,0,1]=4 452 B7R0.12 CCOC(CBr)CBr d03e7afda2ca8d59d0335adb3716d943 [0,2,0,0,0,0|1,0,1]=4 453 B7R0.12 CCOC(CC)CC 60351d1ac9a51febe159ba00076742a6 [0,2,0,0,0,0|1,0,1]=4 454 B7R0.12 CCOC(CCl)CBr 76ba5a657a7ea572d523f589d344dc39 [0,2,0,0,0,0|1,0,1]=4 455 B7R0.12 CCOC(CCl)CCl ce294a182f4713785d493074caf459e2 [0,2,0,0,0,0|1,0,1]=4 456 B7R0.12 CCOC(CF)CF ce94a3a5b0a102e0773db6b18934a605 [0,2,0,0,0,0|1,0,1]=4 457 B7R0.12 CCO[C@@H](CCl)CI 960e9d223c1c4a6537b1692e0aa03922 [0,2,0,0,0,0|1,0,1]=4 458 B7R0.12 CCO[C@H](CCl)CI eaef576ad3d7bec19924ce3c27aa4ce5 [0,2,0,0,0,0|1,0,1]=4 459 B7R0.12 CC[C@@H](CO)NC=O 637c953e48cb45b4be088640a9f26fb2 [0,2,0,0,0,0|2,0,0]=4 460 B7R0.12 CC[C@H](CO)NC=O c5c2fc5e70a5e94955887b0f6db6a1a2 [0,2,0,0,0,0|2,0,0]=4 461 B7R0.12 O=CNC(CO)CO cf9304986c9a1419edf6773dbe4f0207 [0,2,0,0,0,0|2,0,0]=4 462 B7R0.9 CC(=O)NC(C)(C)C a1c7999946c2b3954cecc4a7e85b6160 [0,2,0,0,0,0|1,0,0]=3 463 B7R0.9 CC(C)NC(C)(C)C 8a7a846b84a7e272a6ee9556f3179be1 [0,2,0,0,0,0|1,0,1]=4 464 B7R0.16 CC(=O)N(C)C(C)C 68e786e7c5c4f60e8b7c36108316ab9e [0,2,0,0,0,0|1,0,0]=3 465 B7R0.16 CC(C)N(C)C(C)C abe10f19eddfed4a9330962779694b9d [0,2,0,0,0,0|1,0,1]=4 466 B7R0.14 CCN(C)C(C)(C)C b713cbd327d098cb797fd38b303de500 [0,2,0,0,0,0|1,0,1]=4 467 B7R0.15 CCN(C=O)C(C)C 86649df767a092150d1d82b73f12f48f [0,2,0,0,0,0|1,0,1]=4 468 B7R0.15 CCN(CC)C(C)C 3f01a351ede1b688c65b6abfdefd7c48 [0,2,0,0,0,0|1,0,1]=4 469 B7R0.15 CCN(CF)C(C)C 9d5cf24a52f779b8159ba787e901de86 [0,2,0,0,0,0|1,0,1]=4 470 B7R0.15 CCN(CO)C(C)C 2e5cc72f2eec9d2d5cbf0a379e663ee8 [0,2,0,0,0,0|1,0,1]=4 471 B7R0.4 C#CCCNC(C)C 4f43d4aa609bb85ba1ce2df12e95dc64 [0,2,0,0,0,0|1,0,1]=4 472 B7R0.4 C#CCCOC(C)C 742a793a3d568179dfa9ddcdeebb6426 [0,2,0,0,0,0|1,0,1]=4 473 B7R0.4 C#CCNCC(C)C 211a4a57c09fb23261da854e91255de6 [0,2,0,0,0,0|1,0,1]=4 474 B7R0.4 C#CCOCC(C)C 7b3dff03c4339e6282faa453495ddd1d [0,2,0,0,0,0|1,0,1]=4 475 B7R0.4 C/C=C/COC(C)C 9aa0010d7f93a3506d4a773cf3ec644e [0,2,0,0,0,0|0,0,0]=2 476 B7R0.4 C/C=C\COC(C)C 0fabad7d11b4d0a5e5a55e0264bdae1c [0,2,0,0,0,0|0,0,0]=2 477 B7R0.4 C=CCCNC(C)C b52c7765f384ae2bfbfea60738f06e8b [0,2,0,0,0,0|0,0,2]=4 478 B7R0.4 C=CCCOC(C)C 1236c8c26ebbecb079980edfed00132c [0,2,0,0,0,0|0,0,2]=4 479 B7R0.4 C=CCNCC(C)C 7f73adb711a665b808680f9f4e975092 [0,2,0,0,0,0|0,0,2]=4 480 B7R0.4 C=CCOCC(C)C 430e26f15a2ffd69e16a09cb44866cd6 [0,2,0,0,0,0|0,0,2]=4 481 B7R0.4 CC#CCNC(C)C 812939f7f5df595f4f5af4c12709839b [0,2,0,0,0,0|0,0,2]=4 482 B7R0.4 CC#CCOC(C)C 6e8db9745cabe9183b9bff9444d41366 [0,2,0,0,0,0|0,0,2]=4 483 B7R0.4 CC(=CCNC=O)C aa6f8132c2b4d81390aba70f51f750c7 [0,2,0,0,0,0|1,0,1]=4 484 B7R0.4 CC(=CCNCF)C 3984891f07cfe78b7ee7bd273d4f999d [0,2,0,0,0,0|0,0,2]=4 485 B7R0.4 CC(=CCNCO)C cd77ec809019dfe355bce493304b24df [0,2,0,0,0,0|0,0,2]=4 486 B7R0.4 CC(=CCOCF)C c25b592aef4d9f50b5494c475de951b8 [0,2,0,0,0,0|0,0,2]=4 487 B7R0.4 CC(C)CCNC=O 8fb8d2f77b8e7548ff10a901f65a6a2b [0,2,0,0,0,0|1,0,1]=4 488 B7R0.4 CC(C)CCNCF 7f725eaafe57b21e0294a49a9a15ea60 [0,2,0,0,0,0|0,0,2]=4 489 B7R0.4 CC(C)CCNCO 55d154c6198aa4781c1600237013f9c3 [0,2,0,0,0,0|0,0,2]=4 490 B7R0.4 CC(C)CCOCF 5c4beb2cb4fc50a6f233dfe91cf9c945 [0,2,0,0,0,0|0,0,2]=4 491 B7R0.4 CC(C)CNCC#N adf92d7ae9fba28ad17a528a9bd32f1b [0,2,0,0,0,0|1,0,1]=4 492 B7R0.4 CC(C)CNCC=O e2e655e4d2528bc07c0e7e73f520729a [0,2,0,0,0,0|1,0,1]=4 493 B7R0.4 CC(C)CNCCBr 92559cb2ebacf0b0f5c92d38f861f670 [0,2,0,0,0,0|0,0,2]=4 494 B7R0.4 CC(C)CNCCF 14de296bc1a413c56debcce38ccc407f [0,2,0,0,0,0|0,0,2]=4 495 B7R0.4 CC(C)CNCCI 0dda19f31a767f7ffd847981f58c8b5f [0,2,0,0,0,0|0,0,2]=4 496 B7R0.4 CC(C)CNCCO bc40b3ae5c3a6adde3dd753071b81161 [0,2,0,0,0,0|0,0,2]=4 497 B7R0.4 CC(C)CNCCS 0f3531c02e7e4d73732ad308afcb17e1 [0,2,0,0,0,0|0,0,2]=4 498 B7R0.4 CC(C)COCC#N 7cb07814ea2e3e867e4666ea75f57343 [0,2,0,0,0,0|1,0,1]=4 499 B7R0.4 CC(C)COCC=O bd41a1e672abb592bd026a120b038c2b [0,2,0,0,0,0|1,0,1]=4 500 B7R0.4 CC(C)COCCF 83bb949d8c551562556937d0600d6efb [0,2,0,0,0,0|0,0,2]=4 501 B7R0.4 CC(C)COCCS 84ea4ff8f634d7739886cdbaa6625a00 [0,2,0,0,0,0|0,0,2]=4 502 B7R0.4 CC(C)NCCC#N d4400c07b449260898c72fb360a960eb [0,2,0,0,0,0|1,0,1]=4 503 B7R0.4 CC(C)NCCCCl 1f7b6a1eb64f799a69aafcb62f78849f [0,2,0,0,0,0|0,0,2]=4 504 B7R0.4 CC(C)NCCCO 8da9f776dfc6acc6ee817ae96d2c50e4 [0,2,0,0,0,0|0,0,2]=4 505 B7R0.4 CC(C)NCCON 0430106bca7b178ac757feef5057edc3 [0,2,0,0,0,0|1,0,1]=4 506 B7R0.4 CC(C)OC/C=C/Cl 91491ffbe45b122c593493ce1ec28e21 [0,2,0,0,0,0|1,0,0]=3 507 B7R0.4 CC(C)OC/C=C\Cl 1e6b64e528b3b312db8e7f5d9f5e401f [0,2,0,0,0,0|1,0,0]=3 508 B7R0.4 CC(C)OCC=CCl 05c2ee32f696ac6fe468daf78fa733c3 [0,2,0,0,0,0|1,0,0]=3 509 B7R0.4 CC(C)OCCC#N fd21c0fde146e79c4d1d9956f568a2be [0,2,0,0,0,0|1,0,1]=4 510 B7R0.4 CC(C)OCCC=O ccbf2d62dbd49bddcfe1567d50bb806b [0,2,0,0,0,0|1,0,1]=4 511 B7R0.4 CC(C)OCCCF 4d070417a783226fcc67bd342ecf7613 [0,2,0,0,0,0|0,0,2]=4 512 B7R0.4 CC(C)OCCCS 3817134d1cec338c192448359f8580cb [0,2,0,0,0,0|0,0,2]=4 513 B7R0.4 CC=CCNC(=O)C dc3e1d71e731895ff638118e5c964c13 [0,2,0,0,0,0|1,0,1]=4 514 B7R0.4 CC=CCNC(C)C fbbab91c5c0fa912c14bc0d774686380 [0,2,0,0,0,0|0,0,0]=2 515 B7R0.4 CC=CCOC(C)C 1ffcebdd116c02bae4b2efc3a6b36695 [0,2,0,0,0,0|0,0,0]=2 516 B7R0.4 CCCCNC(C)C 9cc424b21c3c2f75d1871abbaf0e1d28 [0,2,0,0,0,0|0,0,2]=4 517 B7R0.4 CCCCOC(C)C eb1bac952091f26d8e354583c355080c [0,2,0,0,0,0|0,0,2]=4 518 B7R0.4 CCCNCC(C)C 639a6b9872838fc9d4295ca1293ac6f5 [0,2,0,0,0,0|0,0,2]=4 519 B7R0.4 CCCOCC(C)C 519497356751b621892cf233de56054b [0,2,0,0,0,0|0,0,2]=4 520 B7R0.4 CCNCC=C(C)C babbecd9a4b03d10475bf665994a7cc4 [0,2,0,0,0,0|0,0,2]=4 521 B7R0.4 CCNCCC(C)C 2bf33aa7c5d7ca27e591c3649dacf1c3 [0,2,0,0,0,0|0,0,2]=4 522 B7R0.4 CCOCC=C(C)C 24a34a23a06cf18457415c98f967840a [0,2,0,0,0,0|0,0,2]=4 523 B7R0.4 CCOCCC(C)C a81ef4c75f60509d0095bacdc570a8e6 [0,2,0,0,0,0|0,0,2]=4 524 B7R0.4 CCOCOC(C)C fcb36bcabbd9c702db3bb59956b361ad [0,2,0,0,0,0|0,0,2]=4 525 B7R0.4 COCCNC(C)C 0e10ac0a5c18c9b5426d9b26a3199f23 [0,2,0,0,0,0|0,0,2]=4 526 B7R0.4 COCCOC(C)C 66ff9033a5dadbe3413ec342d9a7c9fe [0,2,0,0,0,0|0,0,2]=4 527 B7R0.4 COCNCC(C)C 8a41f842449ec7e26a630827b8975a34 [0,2,0,0,0,0|0,0,2]=4 528 B7R0.4 COCOCC(C)C 61a68151721001e97ead89f074e554c8 [0,2,0,0,0,0|0,0,2]=4 529 B7R0.4 CSCCNC(C)C 145dbc599c93a8d182d58abe78ded108 [0,2,0,0,0,0|0,0,2]=4 530 B7R0.4 CSCCOC(C)C 898b6e38b775cb6892ffe8b724ad6a1f [0,2,0,0,0,0|0,0,2]=4 531 B7R0.4 CSCNCC(C)C af947b38f43b5b920a6aa47378596e00 [0,2,0,0,0,0|0,0,2]=4 532 B7R0.4 CSCOCC(C)C 2e75b1421641e4cf6bcc7f6e6907b733 [0,2,0,0,0,0|0,0,2]=4 533 B7R0.6 C=C(Br)CNC(C)C c11e07a13ecc707bc58321e025560b63 [0,2,0,0,0,0|0,0,2]=4 534 B7R0.6 C=C(Br)COC(C)C 85740d76b7c2437207f473c522fb5652 [0,2,0,0,0,0|0,0,2]=4 535 B7R0.6 C=C(C)CNC(C)C a1a7325d3d8a8203023e8236e36cdc1a [0,2,0,0,0,0|0,0,1]=3 536 B7R0.6 C=C(C)COC(C)C 1163708fe8e5f25f773925b58859ae9a [0,2,0,0,0,0|0,0,1]=3 537 B7R0.6 C=C(Cl)COC(C)C 83e9098a63a39f58f2f10cb0166f135d [0,2,0,0,0,0|0,0,2]=4 538 B7R0.6 C=C(I)COC(C)C 638d63b8c7c0ebdc1a903379afb5a44c [0,2,0,0,0,0|0,0,2]=4 539 B7R0.6 CC(=O)CNC(C)C afe0e5afa4a4991702b8d7ba141d2521 [0,2,0,0,0,0|0,0,1]=3 540 B7R0.6 CC(=O)COC(C)C 8e58824c7076e094538494c263248304 [0,2,0,0,0,0|0,0,1]=3 541 B7R0.6 CC(=O)NCC(C)C 133e349c691ad200ad773179becc5ae8 [0,2,0,0,0,0|0,0,1]=3 542 B7R0.6 CC(=O)NCC(C)O 0ffb7326836e65b1a201fca72ad947e5 [0,2,0,0,0,0|1,0,1]=4 543 B7R0.6 CC(=O)NC[C@@H](C)O f988b940337d1dc00ccd246da11ece9f [0,2,0,0,0,0|1,0,1]=4 544 B7R0.6 CC(=O)NC[C@H](C)O 1a6130441852f98535cb020ca3c20f02 [0,2,0,0,0,0|1,0,1]=4 545 B7R0.6 CC(C)CNC(C)C 196a13ba094adf361c17685c0872f24d [0,2,0,0,0,0|0,0,2]=4 546 B7R0.6 CC(C)COC(C)C 77eecc331fd01778c375925278ff8a8b [0,2,0,0,0,0|0,0,2]=4 547 B7R0.6 CC(C)NCC(=O)N fce70d443053108c75f9dd76e148c70e [0,2,0,0,0,0|1,0,1]=4 548 B7R0.6 CC(C)NCC(=O)O 43feb4147baaae13baaa9c5f09499603 [0,2,0,0,0,0|1,0,1]=4 549 B7R0.6 CC(C)NCC(F)F e16f4a2920b36a22dd7fc9f2f8c67c3b [0,2,0,0,0,0|1,0,1]=4 550 B7R0.6 CC(C)NC[C@@H](C)O 78cb9f10bba40f82bff406bb1347d28d [0,2,0,0,0,0|0,0,2]=4 551 B7R0.6 CC(C)NC[C@H](C)O 0239ae5afc06334e0336f0743f1e175c [0,2,0,0,0,0|0,0,2]=4 552 B7R0.6 CC(C)OCC(=O)N 2925a3543d892638d60eb7349262c8f3 [0,2,0,0,0,0|1,0,1]=4 553 B7R0.6 CC(C)OCC(=O)O 4f99bad05a342ea59eb9c6b2912ac68e [0,2,0,0,0,0|1,0,1]=4 554 B7R0.6 CC(C)OCC(=S)N 1cbdee4d5c3385daad7ba959afed69ee [0,2,0,0,0,0|1,0,1]=4 555 B7R0.6 CC(C)OCC(F)F 3a22706a89b0937c0849011a08e51b94 [0,2,0,0,0,0|1,0,1]=4 556 B7R0.6 CC(C)OCN(C)C 10d50f079b7aea6fe97d70fc778c501b [0,2,0,0,0,0|1,0,1]=4 557 B7R0.6 CC(C)OC[C@@H](C)F 20a173ffcc76fe6afc30e0651bd85f9b [0,2,0,0,0,0|0,0,2]=4 558 B7R0.6 CC(C)OC[C@H](C)F 68e099b1d0df355662b96af0ef440aac [0,2,0,0,0,0|0,0,2]=4 559 B7R0.6 CC(F)COC(C)C 0baa8e540b95c92b06f0417877dbd740 [0,2,0,0,0,0|0,0,2]=4 560 B7R0.6 CC(O)CNC(C)C 67ac451099c111ca9b4a88e10960d432 [0,2,0,0,0,0|0,0,2]=4 561 B7R0.6 CC(S)COC(C)C 57c18a958d625f63860f9eb7db36a7e5 [0,2,0,0,0,0|0,0,2]=4 562 B7R0.8 C=CCNC(C)(C)C 6c0b812000d6c6a48de43a4a3f837f6a [0,2,0,0,0,0|0,0,2]=4 563 B7R0.8 CC(C)(Br)COCF a2ed6a616d532f8faaded75f8946e86e [0,2,0,0,0,0|1,0,1]=4 564 B7R0.8 CC(C)(C)CNC=O 62263fecd6dfd3bbe3846c082198510b [0,2,0,0,0,0|1,0,1]=4 565 B7R0.8 CC(C)(C)CNCF b4c56cbeef23e3f51f1c67efe05a42df [0,2,0,0,0,0|1,0,1]=4 566 B7R0.8 CC(C)(C)CNCO c1ca679419b7e4db6816982a0d672727 [0,2,0,0,0,0|1,0,1]=4 567 B7R0.8 CC(C)(C)COCF 57dd80210ffbd1c389fc6f81c3e76251 [0,2,0,0,0,0|1,0,1]=4 568 B7R0.8 CC(C)(C)NCC=O 84f91e0185bc7a8cbf173006cc00a31e [0,2,0,0,0,0|1,0,1]=4 569 B7R0.8 CC(C)(C)NCCF c88c802f8761b836dd4a8f5e773aa49e [0,2,0,0,0,0|1,0,1]=4 570 B7R0.8 CC(C)(C)NCCO 75b47887fe68bbe774c0a4c47f9d7af9 [0,2,0,0,0,0|1,0,1]=4 571 B7R0.8 CC(C)(C)NCCS 135c0df2231a86212e34458e8817f18c [0,2,0,0,0,0|1,0,1]=4 572 B7R0.8 CC(C)(F)COCF c2c8aa5e71579bf523c1627a80567a99 [0,2,0,0,0,0|1,0,1]=4 573 B7R0.8 CC(C)(O)CNC=O 342a9b6d29541cfeadb382656f3815a5 [0,2,0,0,0,0|1,0,1]=4 574 B7R0.8 CC(C)(O)CNCF 95345509a679e8693329bc205f023ca6 [0,2,0,0,0,0|1,0,1]=4 575 B7R0.8 CC(C)(O)CNCO d699f26def379d72c9f3d780e8ba9c29 [0,2,0,0,0,0|1,0,1]=4 576 B7R0.8 CC(C)(S)COCF 5e5d9df6938dea8946b0e42a96b28fba [0,2,0,0,0,0|1,0,1]=4 577 B7R0.8 CCCNC(C)(C)C 1cb59707d776cfed599d4d0bd4c6e7fe [0,2,0,0,0,0|0,0,2]=4 578 B7R0.8 CCNCC(C)(C)C 1a60db159250e75c4f3bd43804435dab [0,2,0,0,0,0|0,0,2]=4 579 B7R0.8 CCNCC(C)(C)O 3f0e3cd5306f6e0eea72b143c91acc39 [0,2,0,0,0,0|0,0,2]=4 580 B7R0.8 CCOCC(C)(C)Br c5fd84cd204c784fac27f51432de2345 [0,2,0,0,0,0|0,0,2]=4 581 B7R0.8 CCOCC(C)(C)C cbc6e6dff9d30de641f2a7020db5e172 [0,2,0,0,0,0|0,0,2]=4 582 B7R0.8 CCOCC(C)(C)F 4ceebf68b1b3af46558065e266734baa [0,2,0,0,0,0|0,0,2]=4 583 B7R0.8 CCOCC(C)(C)S a7e0d94172e2fed0c574a998a7210b49 [0,2,0,0,0,0|0,0,2]=4 584 B7R0.8 COCNC(C)(C)C a4cfaef5ba15ef99baf838799ea7f8ef [0,2,0,0,0,0|1,0,1]=4 585 B7R0.8 CSCNC(C)(C)C f8dc1bf783c8bcac4db13c58c9d3a808 [0,2,0,0,0,0|1,0,1]=4 586 B7R1.5 CC1CC1NC=O 11d2e4098455fa895a61be5d2e846089 [0,1,0,1,0,0|1,0,1]=4 587 B7R1.5 CC1CC1NCF a80d6604729f7f2bce9bccef0f1b4434 [0,1,0,1,0,0|1,0,1]=4 588 B7R1.5 CC1CC1NCO d401c45702bc5f310a419d102b35b78c [0,1,0,1,0,0|1,0,1]=4 589 B7R1.5 CCNC1CC1C f508b0aca7d0eee090ca628f208f8e9f [0,1,0,1,0,0|0,0,2]=4 590 B7R1.5 CCN[C@@H]1C[C@H]1F a9ed78f8f4d6551b032eaf6c64ed3753 [0,1,0,1,0,0|1,0,1]=4 591 B7R1.5 CCN[C@H]1C[C@@H]1F c6b3e7162a2649713fb720ae5883a3e7 [0,1,0,1,0,0|1,0,1]=4 592 B7R1.5 CCN[C@H]1C[C@H]1F f495a57898c13a33e7cadc888da3307f [0,1,0,1,0,0|1,0,1]=4 593 B7R1.6 CCNC1CCC1 70dad6b0302b94a460da5136f772c3a8 [0,1,0,1,0,0|1,0,1]=4 594 B7R1.6 CCNC1COC1 43258951421d9554a9c394ad23b1cfb7 [0,1,0,1,0,0|1,0,1]=4 595 B7R1.6 CCOC1CCC1 1be1aa1621ba0b71d53802beb6ef9946 [0,1,0,1,0,0|1,0,1]=4 596 B7R1.6 CCOC1COC1 5ee51175a5d1fbea3fd7b3b34e98d1ce [0,1,0,1,0,0|1,0,1]=4 597 B7R1.6 CCOC1CSC1 e43094097e190583d3451ab95271420f [0,1,0,1,0,0|1,0,1]=4 598 B7R1.6 O=CNC1COC1 910edb395eecbce8af210d974d8d054c [0,1,0,1,0,0|2,0,0]=4 599 B7R1.21 CC1(CC1)NC=O 07b8dc5a3dd0a56dffd330aa7b75c69f [0,1,0,1,0,0|2,0,0]=4 600 B7R1.21 CCNC1(CC1)C 49ee171fcc771c5e16d08c11c421eefd [0,1,0,1,0,0|1,0,1]=4 601 B7R1.22 CCN(C)C1CC1 476aa428dda8fdb06e16725a89d0042d [0,1,0,1,0,0|1,0,1]=4 602 B7R1.22 CN(C=O)C1CC1 928f5a4e3607cba3f0183c684f92be70 [0,1,0,1,0,0|2,0,0]=4 603 B7R1.20 CC(=O)NC1CC1 d75fb765a64005f603eb0ff25694647c [0,1,0,1,0,0|1,0,0]=3 604 B7R1.20 CC(C)NC1CC1 42821cd4935984c3074bdbd29bffeb6b [0,1,0,1,0,0|0,0,2]=4 605 B7R1.20 CC(C)OC1CC1 2ba1c960117d477fcaacedd25b727831 [0,1,0,1,0,0|0,0,2]=4 606 B7R1.18 CC(C)N1CCC1 d44ed514bb3d90dbfe71cc985ec56a8b [0,1,0,1,0,0|0,0,2]=4 607 B7R1.23 CC1(CN1C=O)C 554667b638ac8d632390465d91f13ad0 [0,1,0,1,0,0|1,0,1]=4 608 B7R1.23 CC1(CN1CF)C fef1f23f1b47177073871a5580ee83cf [0,1,0,1,0,0|1,0,1]=4 609 B7R1.23 CC1(CN1CO)C e0279fee84fe6f7f5186cbf1fccd93be [0,1,0,1,0,0|1,0,1]=4 610 B7R1.23 CCN1CC1(C)C c470c4a7bc80dec5721690a60993dfb1 [0,1,0,1,0,0|0,0,2]=4 611 B7R1.7 BrCCNC1CC1 1393b058767cc277491294f53cdb074c [0,1,0,1,0,0|1,0,1]=4 612 B7R1.7 C=CCNC1CC1 3f9b6ba489361afb59ec73915e7e75b8 [0,1,0,1,0,0|0,0,2]=4 613 B7R1.7 C=CCOC1CC1 e9d2d1f50ca09419f38c26ddd9fe852c [0,1,0,1,0,0|0,0,2]=4 614 B7R1.7 CCCNC1CC1 ccd7cbe1c58ebed6997b07f91e0c6017 [0,1,0,1,0,0|0,0,2]=4 615 B7R1.7 CCCOC1CC1 1605df6110acb8784adb6061f4289edf [0,1,0,1,0,0|0,0,2]=4 616 B7R1.7 CCNCC1CC1 94bf8bf2338afb688443da3f753f1292 [0,1,0,1,0,0|0,0,2]=4 617 B7R1.7 CCOCC1CC1 744f8109a21f695c28440e411c1b9ca0 [0,1,0,1,0,0|0,0,2]=4 618 B7R1.7 COCNC1CC1 2800df33eaeca479e7ad5159beea729f [0,1,0,1,0,0|1,0,1]=4 619 B7R1.7 COCOC1CC1 026a9c25eccde58eb88281f1e9079e4e [0,1,0,1,0,0|1,0,1]=4 620 B7R1.7 CSCNC1CC1 0c824667fb972af505e34e3d4012a12e [0,1,0,1,0,0|1,0,1]=4 621 B7R1.7 CSCOC1CC1 31d94a402b0c255e4d0b0577bbb73612 [0,1,0,1,0,0|1,0,1]=4 622 B7R1.7 FCCNC1CC1 27bdd0e03327b3d3ab47daae837284af [0,1,0,1,0,0|1,0,1]=4 623 B7R1.7 FCCOC1CC1 d382ce3d6b1520a06dd26d6fc11c28ce [0,1,0,1,0,0|1,0,1]=4 624 B7R1.7 FCNCC1CC1 1cae99c489890b890b87d2c58a6eb8c9 [0,1,0,1,0,0|1,0,1]=4 625 B7R1.7 FCOCC1CC1 ca8fac99f1600978aadc627ea28dfc26 [0,1,0,1,0,0|1,0,1]=4 626 B7R1.7 ICCNC1CC1 54cb85ddbccb623caf83beca2f313e76 [0,1,0,1,0,0|1,0,1]=4 627 B7R1.7 O=CCNC1CC1 96e340af7b360f214201a5a3c0a006d0 [0,1,0,1,0,0|1,0,1]=4 628 B7R1.7 O=CCOC1CC1 147e3a4ed8a55c478f33e39a4b8c183b [0,1,0,1,0,0|1,0,1]=4 629 B7R1.7 O=CNCC1CC1 d46f669abbd5c66800b3b497373db92a [0,1,0,1,0,0|1,0,1]=4 630 B7R1.7 OCCNC1CC1 705f78fe268d00319295f25130b39077 [0,1,0,1,0,0|1,0,1]=4 631 B7R1.7 OCNCC1CC1 9cf22817bea92a2e517d0f5b781259f3 [0,1,0,1,0,0|1,0,1]=4 632 B7R1.7 SCCNC1CC1 c809924f8210012f5574eb4a4f7021ba [0,1,0,1,0,0|1,0,1]=4 633 B7R1.7 SCCOC1CC1 b7a85648a7aee83a47e4374e76fa4b99 [0,1,0,1,0,0|1,0,1]=4