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|1,0,1]=2 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 B4R0.2 N#CNC=O 59e0103a779e5b0a13a338a320bd9101 [1,0,0,0,0,0|2,0,1]=4 5 B6R0.1 C#CC(C)NC=O 50c944dc0c2f52246cf2f8b75f249da5 [0,1,0,0,0,0|1,0,1]=3 6 B6R0.1 C#CC(C)OCC 788c44cbb46959d6943b8cac1e896fa7 [0,1,0,0,0,0|1,0,2]=4 7 B6R0.1 C#CC(C)OCF 49e9b130a26815265491d4c3a424ec61 [0,1,0,0,0,0|1,0,2]=4 8 B6R0.1 C#C[C@@H](C)NC=O 4fee702505a1fdefb270b5b6e9eb7aa3 [0,1,0,0,0,0|1,0,1]=3 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)OCF 84c9a69113565387c92718924a808d76 [0,1,0,0,0,0|1,0,2]=4 11 B6R0.1 C#C[C@H](C)NC=O 55f7e717dc246fc1c154a9332387447d [0,1,0,0,0,0|1,0,1]=3 12 B6R0.1 C#C[C@H](C)OCC e1b8dec53e104261dd95078ad7e6d539 [0,1,0,0,0,0|1,0,2]=4 13 B6R0.1 C#C[C@H](C)OCF 8667845c9da8dd8e24b1d3a8f6a93aa8 [0,1,0,0,0,0|1,0,2]=4 14 B6R0.1 C=CC(C)NC=O ea3bd8a0f1437d84f5ea96318c16e9bd [0,1,0,0,0,0|1,0,1]=3 15 B6R0.1 C=CC(C)OCC 56eed946f70859c9519e59c17b27f8ec [0,1,0,0,0,0|1,0,2]=4 16 B6R0.1 C=CC(C)OCF 703d6773683044b537087d8c1dd5b1e2 [0,1,0,0,0,0|1,0,2]=4 17 B6R0.1 C=CCN(C)CC 66590de6b708bb2b2b2945a656dd0b8f [0,1,0,0,0,0|3,0,0]=4 18 B6R0.1 C=CCN(C)CF 7e02e3a96da7141f47b832fca75c32a8 [0,1,0,0,0,0|3,0,0]=4 19 B6R0.1 C=CCN(C)CO e638b434bf874996eb81f2689695f38f [0,1,0,0,0,0|3,0,0]=4 20 B6R0.1 C=C[C@H](C)OCC 1f2a0e5dd56f9e416c2e4c2822c0bb6e [0,1,0,0,0,0|1,0,2]=4 21 B6R0.1 C=C[C@H](C)OCF c364441950765d3e5b6d38d7dfe0e6ea [0,1,0,0,0,0|1,0,2]=4 22 B6R0.1 CC(C#N)NC=O bab971dbe2c7155864d30c197f73349b [0,1,0,0,0,0|1,0,1]=3 23 B6R0.1 CC(C=O)OCF 65789c25ac421199f1e20366eb603500 [0,1,0,0,0,0|1,0,2]=4 24 B6R0.1 CC(CF)OCF 32adde0cda0df7ca13f616d81360f718 [0,1,0,0,0,0|1,0,1]=3 25 B6R0.1 CC(CO)NC#N b6bfa3976d2a6a9619606ed55bd1d96b [0,1,0,0,0,0|2,0,1]=4 26 B6R0.1 CC(CO)NC=O 6cb3b07738b3559c75de386eaa588767 [0,1,0,0,0,0|1,0,0]=2 27 B6R0.1 CC(CO)NCF ab7f612930dc9a706824818dda371d27 [0,1,0,0,0,0|2,0,1]=4 28 B6R0.1 CC(CO)NCO 220515de56991eed80ebf3de2b03eb11 [0,1,0,0,0,0|1,0,2]=4 29 B6R0.1 CC(CS)OCF 3aa76e588b94fa8c0abffd230ad3c80a [0,1,0,0,0,0|1,0,1]=3 30 B6R0.1 CCC(C)NC#N c755bc17a86225b89fbcb7b323cbfbb8 [0,1,0,0,0,0|2,0,1]=4 31 B6R0.1 CCC(C)NC=O b39ff0b918608a651b17fb1bcfe748b2 [0,1,0,0,0,0|1,0,0]=2 32 B6R0.1 CCC(C)NCF cd789606d14d277b4095dc11d6d1f629 [0,1,0,0,0,0|2,0,1]=4 33 B6R0.1 CCC(C)NCO 2f150bbe96920869e15d5d5aa816b484 [0,1,0,0,0,0|1,0,2]=4 34 B6R0.1 CCC(C)OCF b1f4704464bbfd0265fa8845c1d734e2 [0,1,0,0,0,0|1,0,1]=3 35 B6R0.1 CCN(C)CC=O 027065f0dd139518bb2cdfff7d6533ae [0,1,0,0,0,0|2,0,0]=3 36 B6R0.1 CCNC(C)CC 396d13a5c682c09283d5fcc86ff55a86 [0,1,0,0,0,0|2,0,1]=4 37 B6R0.1 CCNC(C)CO 31c32677d35319c7bce72f49aa59533d [0,1,0,0,0,0|2,0,1]=4 38 B6R0.1 CCN[C@@H](C)CC 8864275bc593322b499f8ffa253a175e [0,1,0,0,0,0|2,0,1]=4 39 B6R0.1 CCN[C@@H](C)CO 1b5cec79590e2129f58d3514073a1390 [0,1,0,0,0,0|2,0,1]=4 40 B6R0.1 CCN[C@H](C)CC 2ca98ce961a0f1b51c5b9bb18e4cf730 [0,1,0,0,0,0|2,0,1]=4 41 B6R0.1 CCN[C@H](C)CO 4334eb4497c625ddabbfceeac7d82066 [0,1,0,0,0,0|2,0,1]=4 42 B6R0.1 CCOC(C)C=O 4021b7076259f80e1751543881198165 [0,1,0,0,0,0|1,0,2]=4 43 B6R0.1 CCOC(C)CC 56a4de537882754d70714e008cda003f [0,1,0,0,0,0|1,0,1]=3 44 B6R0.1 CCOC(C)CF 65f06da7a639a9baf133860813b79ea3 [0,1,0,0,0,0|1,0,1]=3 45 B6R0.1 CCOC(C)CS eb3404d1a98d8fb6f364ecf6e98ac96e [0,1,0,0,0,0|1,0,1]=3 46 B6R0.1 CCO[C@@H](C)CC 1c34d8425f39e9be808db66bb381a14c [0,1,0,0,0,0|1,0,1]=3 47 B6R0.1 CCO[C@H](C)CC 08a1e8fcc5a32008da3650c30e1472a7 [0,1,0,0,0,0|1,0,1]=3 48 B6R0.1 CCO[C@H](C)CS 7d1ac13ead965fd5112ee05598239ca1 [0,1,0,0,0,0|1,0,1]=3 49 B6R0.1 CC[C@@H](C)NC=O b2daaabeaf297395c554f58ded1a06ac [0,1,0,0,0,0|1,0,0]=2 50 B6R0.1 CC[C@@H](C)NCF 6dbb95a50e3976893bdb1627db012fbb [0,1,0,0,0,0|2,0,1]=4 51 B6R0.1 CC[C@@H](C)NCO ac0974a6f9b0bb6d16f90be7439490a9 [0,1,0,0,0,0|1,0,2]=4 52 B6R0.1 CC[C@@H](C)OCF f4fa7810a1d84f0f9cde4476fd8e3f60 [0,1,0,0,0,0|1,0,1]=3 53 B6R0.1 CC[C@H](C)NC=O de5ee03736ab09026768085a3122631f [0,1,0,0,0,0|1,0,0]=2 54 B6R0.1 CC[C@H](C)NCF 5d430afc33b47de08bdee5a967987e85 [0,1,0,0,0,0|2,0,1]=4 55 B6R0.1 CC[C@H](C)NCO 3a0d2629be7074b261ab0759e7061769 [0,1,0,0,0,0|1,0,2]=4 56 B6R0.1 CC[C@H](C)OCF 7272126d7b60c9c2f9744715a5cbda1c [0,1,0,0,0,0|1,0,1]=3 57 B6R0.1 C[C@@H](CO)NC#N 139f5cc18c10fce938a3acd4b6e91304 [0,1,0,0,0,0|2,0,1]=4 58 B6R0.1 C[C@@H](CO)NC=O ec3f1323844b2b166f286f44082a1734 [0,1,0,0,0,0|1,0,0]=2 59 B6R0.1 C[C@@H](CO)NCF 2b92b0d94fc310efd060ea85fc1ec030 [0,1,0,0,0,0|2,0,1]=4 60 B6R0.1 C[C@@H](CO)NCO f2447992c21252c0f96361e913fb5f29 [0,1,0,0,0,0|1,0,2]=4 61 B6R0.1 C[C@H](CO)NC#N 169e9f99802281ff5010262eba8da425 [0,1,0,0,0,0|2,0,1]=4 62 B6R0.1 C[C@H](CO)NC=O 3cbedcbe22de2e07327f619fdeffeaec [0,1,0,0,0,0|1,0,0]=2 63 B6R0.1 C[C@H](CO)NCF 769b646e43e30d6b70ca628125c680bc [0,1,0,0,0,0|2,0,1]=4 64 B6R0.1 C[C@H](CO)NCO 8d1246dd802e302de647e53829f5ca23 [0,1,0,0,0,0|1,0,2]=4 65 B6R0.1 C[C@H](CS)OCF db899319a56836cd7d73603a0da16225 [0,1,0,0,0,0|1,0,1]=3 66 B6R0.2 CC(C)OC(C)C ca12c9680239690a47d96d71519e9e05 [0,1,0,0,0,0|1,0,1]=3 67 B6R0.3 CC(C)N(C)C=O ed819c6af0078a1de69f07f4fd8d9ee5 [0,1,0,0,0,0|1,0,0]=2 68 B6R0.3 CC(C)N(C)CF d3c40e8bfc08dfa1b44a8a87aef31e93 [0,1,0,0,0,0|2,0,1]=4 69 B6R0.3 CC(C)N(C)CO 68aaa92996932618c2ea955d854bb5c7 [0,1,0,0,0,0|1,0,2]=4 70 B6R0.3 CCN(C)C(C)C 515b7690a64e89945d29d623804849df [0,1,0,0,0,0|2,0,1]=4 71 B6R0.4 C#CCNC(C)C cd1408fc1dae47155e40a1bc6beb1606 [0,1,0,0,0,0|2,0,1]=4 72 B6R0.4 C#CCOC(C)C f06fe85c789040b5be09600decc77ea1 [0,1,0,0,0,0|1,0,1]=3 73 B6R0.4 C=C(C)CNC=O 0d0687e6ed98c39501c4c0fd9c1a287e [0,1,0,0,0,0|1,0,2]=4 74 B6R0.4 C=CCOC(C)C 041109637968f56803a7bcb6b6bd0ab7 [0,1,0,0,0,0|1,0,0]=2 75 B6R0.4 CC(=O)CNC=O 799a78176c711722415c8986d9015770 [0,1,0,0,0,0|2,0,1]=4 76 B6R0.4 CC(C)CNC#N 4669aa11e322ca513b1e9ea16868c159 [0,1,0,0,0,0|2,0,1]=4 77 B6R0.4 CC(C)CNC=O e82c18370445f70bde3f0aa61f9296e6 [0,1,0,0,0,0|1,0,0]=2 78 B6R0.4 CC(C)CNCF 8978b44d87fa42438515590def89eb79 [0,1,0,0,0,0|2,0,1]=4 79 B6R0.4 CC(C)CNCO c3b5fde83cdd81c2f0ea167064fd2c5c [0,1,0,0,0,0|1,0,2]=4 80 B6R0.4 CC(C)COCF b089fa536e65fca20df885ea5dacd9f2 [0,1,0,0,0,0|1,0,1]=3 81 B6R0.4 CC(C)NCC#N 8d9c5f2bbdfd2e60c34ddc5972663be0 [0,1,0,0,0,0|2,0,1]=4 82 B6R0.4 CC(C)NCCBr a3900e505497b08f4c9baca17b4fa185 [0,1,0,0,0,0|2,0,1]=4 83 B6R0.4 CC(C)NCCF 3152aefd56bd5a8bc9f6ac7f33a6fcdb [0,1,0,0,0,0|2,0,1]=4 84 B6R0.4 CC(C)NCCI 61300b723cb63b92262a59e1c054336d [0,1,0,0,0,0|2,0,1]=4 85 B6R0.4 CC(C)NCCO 3b0ca7166ca7093e2a2ed1b091b6c5af [0,1,0,0,0,0|1,0,2]=4 86 B6R0.4 CC(C)NCCS cdea7056049e21082f31ef0c239da6f7 [0,1,0,0,0,0|1,1,1]=4 87 B6R0.4 CC(C)OCC#N 1be7e1885bd3670d21ecc2d4422857b0 [0,1,0,0,0,0|1,0,1]=3 88 B6R0.4 CC(C)OCC=O 656e3e823b109ec9cd57494110924cc8 [0,1,0,0,0,0|0,0,0]=1 89 B6R0.4 CC(C)OCCF 102209588400e8045c1b7317560b3baf [0,1,0,0,0,0|1,0,1]=3 90 B6R0.4 CC(C)OCCS 9f8fcde0a26cdc1f53f7ed80bebd9fd6 [0,1,0,0,0,0|0,1,1]=3 91 B6R0.4 CC(F)COCF 184378aa5cda319f35eff5a374bd7b36 [0,1,0,0,0,0|2,0,1]=4 92 B6R0.4 CC(O)CNC=O 8669f80d50d055de0db4e7936b8a26b4 [0,1,0,0,0,0|2,0,0]=3 93 B6R0.4 CC(S)COCF f0912ffde29b0e269706eb1406d36aad [0,1,0,0,0,0|2,0,1]=4 94 B6R0.4 CCCNC(C)C 4cc952815a9d9d6816d0fb90ac14a178 [0,1,0,0,0,0|2,0,1]=4 95 B6R0.4 CCCOC(C)C 9e8901dd10ed96aa593b6a5525365a05 [0,1,0,0,0,0|1,0,1]=3 96 B6R0.4 CCNCC(C)C 7e39c7f79a4a74429f1ae559b7eef67a [0,1,0,0,0,0|2,0,1]=4 97 B6R0.4 CCOCC(C)C 2ccacce0745bb2fe2e67c6f95de49a4c [0,1,0,0,0,0|1,0,1]=3 98 B6R0.4 CCOCC(C)F 44ebcc9497b122666f7d5bc3ab3ef961 [0,1,0,0,0,0|2,0,1]=4 99 B6R0.4 CCOCC(C)S 1b6e2c538b0c5040f1c381953bd73f14 [0,1,0,0,0,0|2,0,1]=4 100 B6R0.4 CCOC[C@@H](C)F 2d70ac2d3ad9d2770f50309e83cd9521 [0,1,0,0,0,0|2,0,1]=4 101 B6R0.4 CCOC[C@H](C)F b1411946299fa054261b7f4dedb203a5 [0,1,0,0,0,0|2,0,1]=4 102 B6R0.4 COCOC(C)C 2db698e0a27d38f57903461e5b8bf21f [0,1,0,0,0,0|0,0,2]=3 103 B6R0.4 CSCOC(C)C df2443d5e1bdbc2f3ac237524c1a32f1 [0,1,0,0,0,0|0,1,1]=3 104 B6R0.4 C[C@@H](F)COCF 2fceb23c1851fd728d248a746424d5d7 [0,1,0,0,0,0|2,0,1]=4 105 B6R0.4 C[C@@H](O)CNC=O 893e330470131b7f4e3b63b1afe5eaa3 [0,1,0,0,0,0|2,0,0]=3 106 B6R0.4 C[C@H](F)COCF e3a81502e05212c96edfcd9edba6a43c [0,1,0,0,0,0|2,0,1]=4 107 B6R0.4 C[C@H](O)CNC=O 3f425a15e29afb471d950c9316d4c9b2 [0,1,0,0,0,0|2,0,0]=3 108 B6R0.4 O=CNCC(F)F b205fb0d823ccdf5423d257101ba187a [0,1,0,0,0,0|3,0,0]=4 109 B6R0.5 CC(C)(C)NC=O fd731f01e449e88bdf1e84dfcee6c8d2 [0,1,0,0,0,0|1,0,0]=2 110 B6R0.5 CC(C)(C)NCF 3cacbed1609b720894d3f72aa5b5474f [0,1,0,0,0,0|2,0,1]=4 111 B6R0.5 CC(C)(C)NCO 98c610d421d69102d9fd33b99f13912a [0,1,0,0,0,0|1,0,2]=4 112 B6R0.5 CCNC(C)(C)C 075494290386c2ca265fcbc967febc26 [0,1,0,0,0,0|2,0,1]=4 113 B6R1.3 CCNC1CC1 ac3981af76d7269974e900b3cfc5de71 [0,0,0,1,0,0|2,0,1]=4 114 B6R1.3 CCOC1CC1 2c69a519fd7808244f9f88e8c40da7c1 [0,0,0,1,0,0|1,0,1]=3 115 B6R1.3 FCNC1CC1 1715feed97cb051cb760323cf608febe [0,0,0,1,0,0|2,0,1]=4 116 B6R1.3 FCOC1CC1 c80b7a723f6ace17df2859b2130f1eb6 [0,0,0,1,0,0|1,0,1]=3 117 B6R1.3 N#CNC1CC1 e16d88e60b8af9226032f06df181743e [0,0,0,1,0,0|2,0,1]=4 118 B6R1.3 O=CNC1CC1 8f8618d92d234287e5df05f6330bfc1f [0,0,0,1,0,0|1,0,0]=2 119 B6R1.3 OCNC1CC1 101960c0f522708da07270474b234f44 [0,0,0,1,0,0|1,0,2]=4 120 B5R0.3 CCN(C)C=O 60ddb02da2ac3e0bbf46f02c328ae40d [1,1,0,0,0,0|1,0,0]=3 121 B5R0.2 C#CCOCC 625c68641a74502dc56dd1108cdba604 [1,1,0,0,0,0|1,0,1]=4 122 B5R0.2 CCCNC=O 394eea314e4a7e284e23571b2081e74b [1,1,0,0,0,0|1,0,0]=3 123 B5R0.2 CCCOCC a0c48a14a19cfc2180230756acaf40ab [1,1,0,0,0,0|1,0,1]=4 124 B5R0.2 CCCOCF 3a09ada643594a0865eabd839c992d22 [1,1,0,0,0,0|1,0,1]=4 125 B5R0.2 CCOCC#N 0fd8a1783429ce080c52b3010d70b565 [1,1,0,0,0,0|1,0,1]=4 126 B5R0.2 CCOCCF e5d78433fc996ba51bd8a100b7998155 [1,1,0,0,0,0|1,0,1]=4 127 B5R0.2 CCOCCS 56f6087ed887f762fd2bdcb15935222f [1,1,0,0,0,0|0,1,1]=4 128 B5R0.2 CCOCOC 6cd815448945789916c4199ac0685ffd [1,1,0,0,0,0|0,0,2]=4 129 B5R0.2 COCOCF 8b21adc85de0de107e0e54e13944287c [1,1,0,0,0,0|1,0,1]=4 130 B5R0.2 FCCOCF ca742562f732a5154eefbdd51554f094 [1,1,0,0,0,0|1,0,1]=4 131 B5R0.2 FCOCCS 3aade357eac7f8414966cbb46c36a193 [1,1,0,0,0,0|1,0,1]=4 132 B5R0.2 N#CCNC=O 80b3c5a6fd13156c1522f1a3270bb14c [1,1,0,0,0,0|1,0,1]=4 133 B5R0.2 O=CNCCBr 7c28f652da8d817ffdc4b1e301878e6d [1,1,0,0,0,0|1,0,0]=3 134 B5R0.2 O=CNCCF cc6ab20072548fa955497a25033be1e2 [1,1,0,0,0,0|1,0,0]=3 135 B5R0.2 O=CNCCI 782f0f8ecb3f6f21bf51449dd497a309 [1,1,0,0,0,0|1,0,0]=3 136 B5R0.2 O=CNCCO 0b79256f67d9aeba37165bf9fc8ffac5 [1,1,0,0,0,0|1,0,0]=3 137 B5R0.2 O=CNCCS 22fad8cac4457d75d73ab95d2ca38298 [1,1,0,0,0,0|1,0,0]=3 138 B7R0.2 C#CC(C)NC(=O)C 30a91f9e689320cab67e7176279a027a [0,2,0,0,0,0|1,0,1]=4 139 B7R0.2 C#CC(C)OC(C)C bd395c473397c0df03907e2995614562 [0,2,0,0,0,0|1,0,1]=4 140 B7R0.2 C#C[C@@H](C)NC(=O)C b5f4cb4c2ca82f0d4e132f2977db08a6 [0,2,0,0,0,0|1,0,1]=4 141 B7R0.2 C#C[C@@H](C)OC(C)C 57b406fc1bff6e055637741c210d864a [0,2,0,0,0,0|1,0,1]=4 142 B7R0.2 C#C[C@H](C)NC(=O)C adfc3d71c946a289355ab55f3775ec5f [0,2,0,0,0,0|1,0,1]=4 143 B7R0.2 C#C[C@H](C)OC(C)C 20fe24039694ac0ddbbae904a1c50c14 [0,2,0,0,0,0|1,0,1]=4 144 B7R0.2 C=C(C=O)OC(C)C 1024bdfd369573a0f4c5c31da01d34c1 [0,2,0,0,0,0|0,0,0]=2 145 B7R0.2 C=CC(C)NC(=O)C da0f45e746fe5ddfb85b752dba1a7d5c [0,2,0,0,0,0|1,0,1]=4 146 B7R0.2 C=CC(C)NC(C)C 538c1af40a959f36dd21007158f94b60 [0,2,0,0,0,0|2,0,0]=4 147 B7R0.2 C=CC(C)OC(C)C 532c4624b978961a1c4eda7e3050b228 [0,2,0,0,0,0|1,0,0]=3 148 B7R0.2 C=C[C@H](C)OC(C)C 0e0bab0a84cd6e94202f911cf430b03e [0,2,0,0,0,0|1,0,0]=3 149 B7R0.2 CC(=O)NC(C)C#N 5c82a898464bc97e12136e75988ac4b5 [0,2,0,0,0,0|1,0,1]=4 150 B7R0.2 CC(=O)NC(C)CO 5b33fe0ccef9f04a2ffcb97aafaea882 [0,2,0,0,0,0|1,0,0]=3 151 B7R0.2 CC(=O)N[C@@H](C)CO 6858caa5d94a6988c3c1bcaa83d0b2b8 [0,2,0,0,0,0|1,0,0]=3 152 B7R0.2 CC(=O)N[C@H](C)CO 0b20f01b94b45fad0762ce944038f07e [0,2,0,0,0,0|1,0,0]=3 153 B7R0.2 CC(C)CN(C)C=O b4351ddc68e0590149228e0a5cd05648 [0,2,0,0,0,0|1,0,0]=3 154 B7R0.2 CC(C)OC(C)C#N d367aad557142d52591f863ae6f1ec70 [0,2,0,0,0,0|1,0,1]=4 155 B7R0.2 CC(C)OC(C)C=O 46dcc605c08f0d0f96a7a481f23b4bf0 [0,2,0,0,0,0|0,0,0]=2 156 B7R0.2 CC(C)OC(C)CF 4c1a23ea77490e2b6e1f5f1f7c7a9ead [0,2,0,0,0,0|1,0,1]=4 157 B7R0.2 CC(C)OC(C)CS f89a38446eb00d60fe9fa60b597f2b73 [0,2,0,0,0,0|0,1,1]=4 158 B7R0.2 CC(C)O[C@H](C)C=O 3f46dec97b43d031419f8bec573ffcd6 [0,2,0,0,0,0|0,0,0]=2 159 B7R0.2 CC(C)O[C@H](C)CS 75e7bc7c54e109d0d519f886fee3300f [0,2,0,0,0,0|0,1,1]=4 160 B7R0.2 CC(O)CN(C)C=O 327f1a278ffacbbe3e88f0ce0c9edbdc [0,2,0,0,0,0|2,0,0]=4 161 B7R0.2 CCC(C)NC(=O)C d52a9bb324dcdb60d53e4e9e2013cb50 [0,2,0,0,0,0|1,0,0]=3 162 B7R0.2 CCC(C)OC(C)C 06c7f52afdb28395f9fa9574a364e474 [0,2,0,0,0,0|1,0,1]=4 163 B7R0.2 CCN(C)CC(=O)N 58c4f2962e11e395e9dd8c9fccee33dd [0,2,0,0,0,0|2,0,0]=4 164 B7R0.2 CCN(C)CC(=O)O ed00a192e609f5d5786e1c989c44eb8f [0,2,0,0,0,0|2,0,0]=4 165 B7R0.2 CC[C@@H](C)NC(=O)C c6d5d80303dcfd2ae6eb945ac41b31c0 [0,2,0,0,0,0|1,0,0]=3 166 B7R0.2 CC[C@@H](C)OC(C)C be2816eab25b2a9101da766270106c57 [0,2,0,0,0,0|1,0,1]=4 167 B7R0.2 CC[C@H](C)NC(=O)C 96d2ad332d2a7d6643a2730e644df4f3 [0,2,0,0,0,0|1,0,0]=3 168 B7R0.2 CC[C@H](C)OC(C)C 2c6d159b250df3bb005afd7417a4b5dc [0,2,0,0,0,0|1,0,1]=4 169 B7R0.2 CN(CF)CC(=O)N 35f09c99eb4485b888503c93a96568a5 [0,2,0,0,0,0|2,0,0]=4 170 B7R0.2 CN(CF)CC(=O)O 7d1eb1d71c500640f6029a70869bff49 [0,2,0,0,0,0|2,0,0]=4 171 B7R0.2 CN(CO)CC(=O)N 731e626c7cf4b35c02c8b97f3321d2b5 [0,2,0,0,0,0|2,0,0]=4 172 B7R0.2 CN(CO)CC(=O)O e8788fe9a5132c43f9e5136dbe3278ce [0,2,0,0,0,0|2,0,0]=4 173 B7R0.2 C[C@H](O)CN(C)C=O 25d41e47dcdadeb17ce6f98cdd60ebbc [0,2,0,0,0,0|2,0,0]=4 174 B7R0.3 C#CC(C)NCC=O ee5942f89b23fd86f41ead0eb91f1f2e [0,2,0,0,0,0|1,0,1]=4 175 B7R0.3 C#CC(C)OCC=C 35c2ceb14425d29fdc0391a672c4f5e1 [0,2,0,0,0,0|1,0,1]=4 176 B7R0.3 C#CC(C)OCC=O ba88f9e6c584cf37d447c8f942df3466 [0,2,0,0,0,0|0,0,1]=3 177 B7R0.3 C#CCOC(C)CC 59388fb49cbbdba7f912f977834cecae [0,2,0,0,0,0|1,0,1]=4 178 B7R0.3 C#CCOC(C)CF 221cd713b73297c7e5f97bde204915de [0,2,0,0,0,0|1,0,1]=4 179 B7R0.3 C#CCOC(C)CS 7e7645935526fd9fe5b548e99a949915 [0,2,0,0,0,0|1,0,1]=4 180 B7R0.3 C#CCO[C@@H](C)CC 0638932b66273b5968485ec5247ca338 [0,2,0,0,0,0|1,0,1]=4 181 B7R0.3 C#CCO[C@H](C)CC 846e054615825e240b725005682063ae [0,2,0,0,0,0|1,0,1]=4 182 B7R0.3 C#CCO[C@H](C)CS ab6f4be9fefb8635e941439c0052c852 [0,2,0,0,0,0|1,0,1]=4 183 B7R0.3 C#C[C@@H](C)NCC=O 5e75d1c6c4c57369266bed642bd09c8c [0,2,0,0,0,0|1,0,1]=4 184 B7R0.3 C#C[C@@H](C)OCC=C 9616943c520fd58556348ca49fc2eb55 [0,2,0,0,0,0|1,0,1]=4 185 B7R0.3 C#C[C@@H](C)OCC=O e5dc09536c65fde58fa0a450d6db7a37 [0,2,0,0,0,0|0,0,1]=3 186 B7R0.3 C#C[C@H](C)NCC=O a08e4dd67e9c6ea8e5647895c6d0c01d [0,2,0,0,0,0|1,0,1]=4 187 B7R0.3 C#C[C@H](C)OCC=C d42b9d87af2457408c59a2ed3eb69c8d [0,2,0,0,0,0|1,0,1]=4 188 B7R0.3 C#C[C@H](C)OCC=O 0416c8a6869357496f6fa27d6441617b [0,2,0,0,0,0|0,0,1]=3 189 B7R0.3 C=CC(C)NCC=O 39b14e3f69e0eb05b9593b7c40c09aad [0,2,0,0,0,0|1,0,1]=4 190 B7R0.3 C=CC(C)OCC=O cb8ab1e26c946580cb2eacb238eceadb [0,2,0,0,0,0|0,0,1]=3 191 B7R0.3 C=CCNC(C)CC d45d48be61d418ef3d95cad9c5582bbe [0,2,0,0,0,0|2,0,0]=4 192 B7R0.3 C=CCNC(C)CO a948e20f9bd4754ec87302b6fdce81b3 [0,2,0,0,0,0|2,0,0]=4 193 B7R0.3 C=CCN[C@@H](C)CC c610fd310f1909b965f637191eeb2b15 [0,2,0,0,0,0|2,0,0]=4 194 B7R0.3 C=CCN[C@@H](C)CO e3ac2dff9fa8b94ad1bb6f4b16ad0799 [0,2,0,0,0,0|2,0,0]=4 195 B7R0.3 C=CCN[C@H](C)CC 0c789cf00460bd8cdb23c51009c4742c [0,2,0,0,0,0|2,0,0]=4 196 B7R0.3 C=CCN[C@H](C)CO 45438ab57072f0e042c82a4659374125 [0,2,0,0,0,0|2,0,0]=4 197 B7R0.3 C=CCOC(C)C=C a1650d51ca3c5bc9bbb4242a057bd09a [0,2,0,0,0,0|1,0,1]=4 198 B7R0.3 C=CCOC(C)C=O 6657ba082e9c102df1bd1e051b83669e [0,2,0,0,0,0|1,0,1]=4 199 B7R0.3 C=CCOC(C)CC 787a9267d8fe014db706087d78f6c857 [0,2,0,0,0,0|1,0,0]=3 200 B7R0.3 C=CCOC(C)CF fb11bf0cefab4ea0e38b93cfcee01743 [0,2,0,0,0,0|1,0,0]=3 201 B7R0.3 C=CCOC(C)CS 0ddb9af989e9e9c33b24b66863a996b5 [0,2,0,0,0,0|1,0,0]=3 202 B7R0.3 C=CCO[C@@H](C)C=C 346d3a0f77fdd9102666716758056241 [0,2,0,0,0,0|1,0,1]=4 203 B7R0.3 C=CCO[C@@H](C)CC b304fc3faf864b09563f01310febaac7 [0,2,0,0,0,0|1,0,0]=3 204 B7R0.3 C=CCO[C@H](C)CC 15018d65de2076ec221d9660c184c296 [0,2,0,0,0,0|1,0,0]=3 205 B7R0.3 C=CCO[C@H](C)CS fd43ed19bf853317b3a063b2977abf8d [0,2,0,0,0,0|1,0,0]=3 206 B7R0.3 C=C[C@H](C)OCC=O 1b1ed3039c6605fda21f2d5059ac888e [0,2,0,0,0,0|0,0,1]=3 207 B7R0.3 CC(C#N)NCC=O 69c055aa64463f8147e8c2a5cf4caa1a [0,2,0,0,0,0|1,0,1]=4 208 B7R0.3 CC(C=O)OCC=O 216dc0b62aef64aacebb34095641e5d6 [0,2,0,0,0,0|0,0,1]=3 209 B7R0.3 CC(CF)OCC#N 6cc0a505593a119a3106139b239e6163 [0,2,0,0,0,0|1,0,1]=4 210 B7R0.3 CC(CF)OCC=O 41897813684ca2355d787ae430508b45 [0,2,0,0,0,0|0,0,0]=2 211 B7R0.3 CC(CF)OCCF 61970d4a8d2156da592b0c1d02226f38 [0,2,0,0,0,0|1,0,1]=4 212 B7R0.3 CC(CF)OCCS 1b0e427f947de38ae03c6161eb7f3753 [0,2,0,0,0,0|0,1,1]=4 213 B7R0.3 CC(CO)CNC=O 24fbd7aa61fab8c89f8d9333e1a09567 [0,2,0,0,0,0|1,0,0]=3 214 B7R0.3 CC(CO)NCC=O abc80e1c9772f639d76c5de7d6ae2b6e [0,2,0,0,0,0|1,0,0]=3 215 B7R0.3 CC(CS)OCC#N 676888cdcec921bfd46a956f5c3d5131 [0,2,0,0,0,0|1,0,1]=4 216 B7R0.3 CC(CS)OCC=O 4070359928b4f2d4ef682a3d0e169b5c [0,2,0,0,0,0|0,0,0]=2 217 B7R0.3 CC(CS)OCCF 5a14cb2acfb2d6d25be1b8f12b44b6ed [0,2,0,0,0,0|1,0,1]=4 218 B7R0.3 CC(CS)OCCS 4c5a0494234ba5cfb20d857e8ce0ca08 [0,2,0,0,0,0|0,1,1]=4 219 B7R0.3 CCC(C)CNC=O ebd419a28eb79e00a55acb30bf712ff2 [0,2,0,0,0,0|1,0,0]=3 220 B7R0.3 CCC(C)COCF d83d0a95392ef09a2490e51164140783 [0,2,0,0,0,0|1,0,1]=4 221 B7R0.3 CCC(C)NCC=O e7aeaed45b54a2e3fad4afa638418830 [0,2,0,0,0,0|1,0,0]=3 222 B7R0.3 CCC(C)OCC#N 50ba24c28a608cb499d346735f93665e [0,2,0,0,0,0|1,0,1]=4 223 B7R0.3 CCC(C)OCC=O 3048fa7b9eb03a623d9ab002261defa2 [0,2,0,0,0,0|0,0,0]=2 224 B7R0.3 CCC(C)OCCF b50b83f4cc04a33902077c0b3a238cbc [0,2,0,0,0,0|1,0,1]=4 225 B7R0.3 CCC(C)OCCS 0b195719e1e4b78092bc0c0213134f4f [0,2,0,0,0,0|0,1,1]=4 226 B7R0.3 CCC(C)OCOC 7b2a5b8cb8aef52b76ee0f9de192d2d0 [0,2,0,0,0,0|0,0,2]=4 227 B7R0.3 CCC(C)OCSC a5a0b25f047959799e9ece96fa20b187 [0,2,0,0,0,0|0,1,1]=4 228 B7R0.3 CCC(O)CNC=O 3e7e1c1d57179570b5ce8a6f87ec4444 [0,2,0,0,0,0|2,0,0]=4 229 B7R0.3 CCCOC(C)CC 98a624a488dc392a35e8b0b44aac3f30 [0,2,0,0,0,0|1,0,1]=4 230 B7R0.3 CCCOC(C)CF 9754423e03bd9c1680aa4f64130d3218 [0,2,0,0,0,0|1,0,1]=4 231 B7R0.3 CCCOC(C)CS 3831bbe85ee4c34ff42a76d0b53dbb5c [0,2,0,0,0,0|1,0,1]=4 232 B7R0.3 CCCO[C@@H](C)CC af9e77ade15ce19a7659cd0cba0e805a [0,2,0,0,0,0|1,0,1]=4 233 B7R0.3 CCCO[C@H](C)CC aceb38a7b284bb9c5e1ae0a6fb45caa0 [0,2,0,0,0,0|1,0,1]=4 234 B7R0.3 CCCO[C@H](C)CS 34c71dbcb154ce995a79e0481e98962a [0,2,0,0,0,0|1,0,1]=4 235 B7R0.3 CCN(C)CCC=O 7943cc4d9a1ab8d439ad27cf7b079146 [0,2,0,0,0,0|2,0,0]=4 236 B7R0.3 CCOCC(C)CC b48ffd68a9924a596413f28a1f26cd9a [0,2,0,0,0,0|1,0,1]=4 237 B7R0.3 CCOCC(C)OC 00214de46f1604d32f121bd91c115789 [0,2,0,0,0,0|1,0,1]=4 238 B7R0.3 CCOC[C@@H](C)CC 24d1c149f27d56a7b1370d3d84a93c4a [0,2,0,0,0,0|1,0,1]=4 239 B7R0.3 CCOC[C@@H](C)OC ecceb3df9b78b58b5b76fdc0f6911e92 [0,2,0,0,0,0|1,0,1]=4 240 B7R0.3 CCOC[C@H](C)CC e4857d3b038c108c7619c84891e8a2f7 [0,2,0,0,0,0|1,0,1]=4 241 B7R0.3 CCOC[C@H](C)OC fd13d8de7d92a89af8eab0e711a6bd02 [0,2,0,0,0,0|1,0,1]=4 242 B7R0.3 CC[C@@H](C)COCF 27ee9a97e87757a57bbd2473b47c8a0b [0,2,0,0,0,0|1,0,1]=4 243 B7R0.3 CC[C@@H](C)NCC=O 728ce0e6b12a20079c33ab77be7d6271 [0,2,0,0,0,0|1,0,0]=3 244 B7R0.3 CC[C@@H](C)OCC#N 967f2c3fca95251181598ab565d2caef [0,2,0,0,0,0|1,0,1]=4 245 B7R0.3 CC[C@@H](C)OCC=O fcdaaaea8501897d08b7daa2ec02db5c [0,2,0,0,0,0|0,0,0]=2 246 B7R0.3 CC[C@@H](C)OCCF 9a9e445f08d44c81e417052c615c3334 [0,2,0,0,0,0|1,0,1]=4 247 B7R0.3 CC[C@@H](C)OCCS c58b0dc1d2db79db526d0ab1218bffc7 [0,2,0,0,0,0|0,1,1]=4 248 B7R0.3 CC[C@@H](C)OCOC 5dd2de1ba91f6cde19e7a670f775c35c [0,2,0,0,0,0|0,0,2]=4 249 B7R0.3 CC[C@@H](C)OCSC 07780bc57acd6b7b99e87c445c42d82f [0,2,0,0,0,0|0,1,1]=4 250 B7R0.3 CC[C@@H](O)CNC=O 35e0b928eef0050ada3a4c2a6cc4db4c [0,2,0,0,0,0|2,0,0]=4 251 B7R0.3 CC[C@H](C)CNC=O 8ddf4a7afc076d1492904a4e2d1a92ee [0,2,0,0,0,0|1,0,0]=3 252 B7R0.3 CC[C@H](C)COCF 4d1b50442964dee0f36120907b5bf9ca [0,2,0,0,0,0|1,0,1]=4 253 B7R0.3 CC[C@H](C)NCC=O b6d86a7489e7187a7b6be26ba88b7b85 [0,2,0,0,0,0|1,0,0]=3 254 B7R0.3 CC[C@H](C)OCC#N ea9aeb285d0ece3233263861719aeec4 [0,2,0,0,0,0|1,0,1]=4 255 B7R0.3 CC[C@H](C)OCC=O 1749dffdbae3c22c50ca54c1db5fd2b4 [0,2,0,0,0,0|0,0,0]=2 256 B7R0.3 CC[C@H](C)OCCF b495df4c5acd12e724246ab7aab5bcc3 [0,2,0,0,0,0|1,0,1]=4 257 B7R0.3 CC[C@H](C)OCCS d78ff3c7dda26d3bc7cef65283cd3558 [0,2,0,0,0,0|0,1,1]=4 258 B7R0.3 CC[C@H](C)OCOC 841bb4da5d82dffee5f6f29fdb10c40b [0,2,0,0,0,0|0,0,2]=4 259 B7R0.3 CC[C@H](C)OCSC 879c6380126ff9fd0bdc6f15a431ea23 [0,2,0,0,0,0|0,1,1]=4 260 B7R0.3 COC(C)COCF c722a3f5401ca397f89df05f571bb3b2 [0,2,0,0,0,0|1,0,1]=4 261 B7R0.3 COCOC(C)CF 6a9dcf8f1b1aaa2624756f79d32e8649 [0,2,0,0,0,0|0,0,2]=4 262 B7R0.3 CO[C@@H](C)CNC=O cbdf409ea735afb7a574d69375fb28db [0,2,0,0,0,0|1,0,0]=3 263 B7R0.3 CO[C@@H](C)COCF 6e6ff1c74d26861c98bac3895e10d598 [0,2,0,0,0,0|1,0,1]=4 264 B7R0.3 CO[C@H](C)CNC=O 943b01dc3bd1c6157c7dfb62f870e0a6 [0,2,0,0,0,0|1,0,0]=3 265 B7R0.3 CO[C@H](C)COCF 0c169ac11c6c9290a799aeebebac70a7 [0,2,0,0,0,0|1,0,1]=4 266 B7R0.3 CSCOC(C)CF 65e26bd5fd3fba937ab56c5fd2b72624 [0,2,0,0,0,0|0,1,1]=4 267 B7R0.3 CSCOC(C)CS e72ba884b9015d7996527663a2b23dcf [0,2,0,0,0,0|0,1,1]=4 268 B7R0.3 CSCO[C@H](C)CS f2b1cd8743208a95078103d175668411 [0,2,0,0,0,0|0,1,1]=4 269 B7R0.3 C[C@@H](CO)NCC=O 20c7bf02d372e36cba042ac5b28907f5 [0,2,0,0,0,0|1,0,0]=3 270 B7R0.3 C[C@H](CO)CNC=O 32037413a41facbb9dd3661f525eb476 [0,2,0,0,0,0|1,0,0]=3 271 B7R0.3 C[C@H](CO)NCC=O 1a3e3f6cab470e0221e0a223d10de41c [0,2,0,0,0,0|1,0,0]=3 272 B7R0.3 C[C@H](CS)OCC#N 8dcfe103d095e6274fbc4d899e558965 [0,2,0,0,0,0|1,0,1]=4 273 B7R0.3 C[C@H](CS)OCC=O 54b8c633a4f5d8e7a615987326df81f2 [0,2,0,0,0,0|0,0,0]=2 274 B7R0.3 C[C@H](CS)OCCF e802a848389fb605db8d861c1c53c8bb [0,2,0,0,0,0|1,0,1]=4 275 B7R0.3 C[C@H](CS)OCCS f4b2ba60b9ef84050b5c98d7dfd70389 [0,2,0,0,0,0|0,1,1]=4 276 B7R0.3 O=CNCC(Br)CBr 93597cc22f25c51d1dc8b5845ef56682 [0,2,0,0,0,0|2,0,0]=4 277 B7R0.3 O=CNCC(F)CO 20b10b91868850c2fa4696a502438329 [0,2,0,0,0,0|2,0,0]=4 278 B7R0.3 O=CNCC(O)CO f07ee978b5361099ae5463db2d8284c6 [0,2,0,0,0,0|2,0,0]=4 279 B7R0.3 O=CNC[C@@H](F)CO fe3e6de1ebe35bf08c36352dbce26e10 [0,2,0,0,0,0|2,0,0]=4 280 B7R0.3 O=CNC[C@@H](O)CO 4afeec0bbb868f60f0a97c37149bb7ed [0,2,0,0,0,0|2,0,0]=4 281 B7R0.3 O=CNC[C@H](F)CO 22ed73e19a0bc3d8fec3d0ab621da9c9 [0,2,0,0,0,0|2,0,0]=4 282 B7R0.3 O=CNC[C@H](O)CO bac710e216d9ff7e3114b1f469852b76 [0,2,0,0,0,0|2,0,0]=4 283 B7R0.5 C=CCN(C)C(C)C 96de01368c533ec0e3507154958af2ed [0,2,0,0,0,0|2,0,0]=4 284 B7R0.5 CC(=O)C(C)OCF 7c6a7a2752d146ccb367c2a6ec272a5d [0,2,0,0,0,0|1,0,1]=4 285 B7R0.5 CC(C)C(C)NC=O 4e819ff0160e7ed0f2ff22f1b3980c8f [0,2,0,0,0,0|1,0,0]=3 286 B7R0.5 CC(C)C(C)OCF 80276d10e0b66e37d961ea14d47b0969 [0,2,0,0,0,0|1,0,1]=4 287 B7R0.5 CC(C)N(C)CC=O dce9ec45ecad4267effdc3296bdfc642 [0,2,0,0,0,0|1,0,0]=3 288 B7R0.5 CC(C)[C@@H](C)NC=O 83a0d0bfb3b7ec5a070ad221a7115b67 [0,2,0,0,0,0|1,0,0]=3 289 B7R0.5 CC(C)[C@@H](C)OCF 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[0,2,0,0,0,0|1,0,0]=3 326 B7R0.7 CCCC(C)OCC f8a13dff786165aad9d4cfd77470c868 [0,2,0,0,0,0|1,0,1]=4 327 B7R0.7 CCCC(C)OCF e53aa9a0be571d844376e05ef43b0243 [0,2,0,0,0,0|1,0,1]=4 328 B7R0.7 CCCN(C)CC=O 1c62a002dac50aaed88f0fc6ab9f5e8c [0,2,0,0,0,0|2,0,0]=4 329 B7R0.7 CCC[C@@H](C)OCC ad566fabe40b68a5eff8830d607c6d5f [0,2,0,0,0,0|1,0,1]=4 330 B7R0.7 CCC[C@@H](C)OCF 7663802c803efdb5ffdb71e415c741b7 [0,2,0,0,0,0|1,0,1]=4 331 B7R0.7 CCC[C@H](C)NC=O d7593154c1a9fc5db070af269735e419 [0,2,0,0,0,0|1,0,0]=3 332 B7R0.7 CCC[C@H](C)OCC 1fee3bcf808f20e21cce64abf5182523 [0,2,0,0,0,0|1,0,1]=4 333 B7R0.7 CCC[C@H](C)OCF aaf4041a99f006e154459098e0beb231 [0,2,0,0,0,0|1,0,1]=4 334 B7R0.7 CCOC(C)CC#N 74c7ff950e02e978c381dad00f0222ea [0,2,0,0,0,0|1,0,1]=4 335 B7R0.7 CCOC(C)COC fe243350564a7dc6ae1ae7113d5524f6 [0,2,0,0,0,0|1,0,1]=4 336 B7R0.7 CCOC(C)CSC e325c79726bf48130f9e676fa3908dca [0,2,0,0,0,0|1,0,1]=4 337 B7R0.7 CCO[C@@H](C)CC#N 79f640333f75719e0019c555e2ed7c25 [0,2,0,0,0,0|1,0,1]=4 338 B7R0.7 CCO[C@@H](C)COC f439908527642fb0fb69029fa9f8bc89 [0,2,0,0,0,0|1,0,1]=4 339 B7R0.7 CCO[C@H](C)CC#N 853352ce16f989e76716e5f2635f2407 [0,2,0,0,0,0|1,0,1]=4 340 B7R0.7 CCO[C@H](C)COC 9a86a7ea1ccd0f751a8074ffc2bb4277 [0,2,0,0,0,0|1,0,1]=4 341 B7R0.7 CN(CC#N)CC=O 12ba89d8d84c8f98fbf202698aed3177 [0,2,0,0,0,0|2,0,0]=4 342 B7R0.7 CN(CC=O)CCF e000d0184f9f374c5d6d2759945d9138 [0,2,0,0,0,0|2,0,0]=4 343 B7R0.7 CN(CC=O)CCO c9392a8ee79c46afd21599c8df016274 [0,2,0,0,0,0|2,0,0]=4 344 B7R0.7 COCC(C)NC=O 45a0b649e4600219d555cc1f9498bdc8 [0,2,0,0,0,0|1,0,0]=3 345 B7R0.7 COCC(C)OCF ba759e057fe1b6bc36072f0ed66c672a [0,2,0,0,0,0|1,0,1]=4 346 B7R0.7 COC[C@@H](C)NC=O d1500602ed7da53624fa7ed4337a50c3 [0,2,0,0,0,0|1,0,0]=3 347 B7R0.7 COC[C@@H](C)OCF 8f42f68524f58334b9b291fd96846ba2 [0,2,0,0,0,0|1,0,1]=4 348 B7R0.7 COC[C@H](C)NC=O 9ace0af38b8cac4dc5e5d6d9564d36a8 [0,2,0,0,0,0|1,0,0]=3 349 B7R0.7 COC[C@H](C)OCF a6a8493c8eb55af12b084ba1e2d842c6 [0,2,0,0,0,0|1,0,1]=4 350 B7R0.7 CSCC(C)OCF 689a149956402544a2d3e6be9443efc2 [0,2,0,0,0,0|1,0,1]=4 351 B7R0.7 C[C@@H](CC#N)OCF 69332a263c9d59474fcf15322740989a [0,2,0,0,0,0|1,0,1]=4 352 B7R0.7 C[C@@H](CCO)NC=O eb95ec52954fcdf5dbae515a1b580040 [0,2,0,0,0,0|1,0,0]=3 353 B7R0.7 C[C@H](CC#N)OCF 9dbd768d6224ac240ada1a649aeb97a3 [0,2,0,0,0,0|1,0,1]=4 354 B7R0.7 C[C@H](CCO)NC=O b74e456417922c93cc7901b1f7160ec1 [0,2,0,0,0,0|1,0,0]=3 355 B7R0.10 CC(CO)N(C)C=O 4659927dd4489ef42e67e78276d3b1b4 [0,2,0,0,0,0|1,0,0]=3 356 B7R0.10 CCC(C)N(C)C=O aaa2a77e867aed83923621e3629d674e [0,2,0,0,0,0|1,0,0]=3 357 B7R0.10 CCN(C)C(=O)C=O db5732fec82020b1e06387d47e0f63dc [0,2,0,0,0,0|2,0,0]=4 358 B7R0.10 CCN(C)C(C)C=O 3a064273f8f7f25930c79a89d95b0e17 [0,2,0,0,0,0|2,0,0]=4 359 B7R0.10 CCN(C)[C@H](C)C=O 193bc5a546dbc7ad240f6d8ae5d9f8d3 [0,2,0,0,0,0|2,0,0]=4 360 B7R0.10 C[C@@H](CO)N(C)C=O b94b965b512745cf284fdc052a9474ae [0,2,0,0,0,0|1,0,0]=3 361 B7R0.10 C[C@H](CO)N(C)C=O c4c1d9e89c0731cbc76ea32ef421fbca [0,2,0,0,0,0|1,0,0]=3 362 B7R0.11 C#CC(C)(C)NC=O eec20f4791fae3c1459af6a385ff52d7 [0,2,0,0,0,0|1,0,0]=3 363 B7R0.11 CC(C)(C#N)NC=O bdc2e7f7dc73aab830e5294af0434498 [0,2,0,0,0,0|1,0,0]=3 364 B7R0.11 CC(C)(CF)NC=O ff7fc0b5fb780004ba739902f541960d [0,2,0,0,0,0|1,0,0]=3 365 B7R0.11 CC(C)(CO)NC=O b948c4623b1c99369aaa53f2724551dc [0,2,0,0,0,0|1,0,0]=3 366 B7R0.11 CCC(C)(C)NC=O 467bc47a116e7d37bf8e07bc1f187838 [0,2,0,0,0,0|1,0,0]=3 367 B7R0.12 C=C[C@@H](CO)NC=O 5d09ef4825c604a2efc4917c4ac324ba [0,2,0,0,0,0|1,0,1]=4 368 B7R0.12 CCC(CC)NC=O 4175bd0bc40e9e83245363507b336b46 [0,2,0,0,0,0|1,0,0]=3 369 B7R0.12 CCC(CC)OCF 636355b0b109acffc3ac81270024a401 [0,2,0,0,0,0|1,0,1]=4 370 B7R0.12 CCC(CO)NC=O 742cd9cb7df8523077fcd6bd9de1d480 [0,2,0,0,0,0|1,0,0]=3 371 B7R0.12 CCOC(CBr)CBr d03e7afda2ca8d59d0335adb3716d943 [0,2,0,0,0,0|1,0,1]=4 372 B7R0.12 CCOC(CC)CC 60351d1ac9a51febe159ba00076742a6 [0,2,0,0,0,0|1,0,1]=4 373 B7R0.12 CCOC(CCl)CBr 76ba5a657a7ea572d523f589d344dc39 [0,2,0,0,0,0|1,0,1]=4 374 B7R0.12 CCOC(CCl)CCl ce294a182f4713785d493074caf459e2 [0,2,0,0,0,0|1,0,1]=4 375 B7R0.12 CCOC(CF)CF ce94a3a5b0a102e0773db6b18934a605 [0,2,0,0,0,0|1,0,1]=4 376 B7R0.12 CCO[C@@H](CCl)CI 960e9d223c1c4a6537b1692e0aa03922 [0,2,0,0,0,0|1,0,1]=4 377 B7R0.12 CCO[C@H](CCl)CI eaef576ad3d7bec19924ce3c27aa4ce5 [0,2,0,0,0,0|1,0,1]=4 378 B7R0.12 CC[C@@H](CO)NC=O 637c953e48cb45b4be088640a9f26fb2 [0,2,0,0,0,0|1,0,0]=3 379 B7R0.12 CC[C@H](CO)NC=O c5c2fc5e70a5e94955887b0f6db6a1a2 [0,2,0,0,0,0|1,0,0]=3 380 B7R0.12 FCOC(CBr)CBr 760611b5804515a02db886829643f317 [0,2,0,0,0,0|1,0,1]=4 381 B7R0.12 FCOC(CCl)CBr 72519e805199b04a3a2f9222669bc455 [0,2,0,0,0,0|1,0,1]=4 382 B7R0.12 FCOC(CCl)CCl 118ddee96acf874a0a1fb0d0ff930d02 [0,2,0,0,0,0|1,0,1]=4 383 B7R0.12 FCOC(CF)CF 705408821521684268dfce4a5f529fde [0,2,0,0,0,0|1,0,1]=4 384 B7R0.12 FCO[C@@H](CCl)CI 311aefa9fd8da5acbb1bd157cd237075 [0,2,0,0,0,0|1,0,1]=4 385 B7R0.12 FCO[C@H](CCl)CI cd5a66f48a11f01a3a244c8c713b4bbc [0,2,0,0,0,0|1,0,1]=4 386 B7R0.12 O=CNC(CO)CO cf9304986c9a1419edf6773dbe4f0207 [0,2,0,0,0,0|1,0,0]=3 387 B7R0.9 CC(=O)NC(C)(C)C a1c7999946c2b3954cecc4a7e85b6160 [0,2,0,0,0,0|1,0,0]=3 388 B7R0.16 CC(=O)N(C)C(C)C 68e786e7c5c4f60e8b7c36108316ab9e [0,2,0,0,0,0|1,0,0]=3 389 B7R0.15 CCN(C=O)C(C)C 86649df767a092150d1d82b73f12f48f [0,2,0,0,0,0|1,0,0]=3 390 B7R0.4 C#CCCOC(C)C 742a793a3d568179dfa9ddcdeebb6426 [0,2,0,0,0,0|1,0,1]=4 391 B7R0.4 C#CCOCC(C)C 7b3dff03c4339e6282faa453495ddd1d [0,2,0,0,0,0|1,0,1]=4 392 B7R0.4 C/C=C/COC(C)C 9aa0010d7f93a3506d4a773cf3ec644e [0,2,0,0,0,0|1,0,0]=3 393 B7R0.4 C/C=C\COC(C)C 0fabad7d11b4d0a5e5a55e0264bdae1c [0,2,0,0,0,0|1,0,0]=3 394 B7R0.4 C=C(C)COCC=O ac319c323600422cf8ad488ebe56732b [0,2,0,0,0,0|0,0,2]=4 395 B7R0.4 C=CCCNC(C)C b52c7765f384ae2bfbfea60738f06e8b [0,2,0,0,0,0|2,0,0]=4 396 B7R0.4 C=CCCOC(C)C 1236c8c26ebbecb079980edfed00132c [0,2,0,0,0,0|1,0,0]=3 397 B7R0.4 C=CCNCC(C)C 7f73adb711a665b808680f9f4e975092 [0,2,0,0,0,0|2,0,0]=4 398 B7R0.4 C=CCOCC(C)C 430e26f15a2ffd69e16a09cb44866cd6 [0,2,0,0,0,0|1,0,0]=3 399 B7R0.4 C=CCOCC(C)F db539a456bd6752ebe10d7b23c41a2c2 [0,2,0,0,0,0|2,0,0]=4 400 B7R0.4 C=CCOCC(C)S c0443280688281fff6bac011768c9c1b [0,2,0,0,0,0|2,0,0]=4 401 B7R0.4 C=CCOC[C@@H](C)F 6fbef7cd23b7ad6df74ff1c9ada25c26 [0,2,0,0,0,0|2,0,0]=4 402 B7R0.4 C=CCOC[C@H](C)F ee8f1a8a998027f3ef4fed8e2898cb78 [0,2,0,0,0,0|2,0,0]=4 403 B7R0.4 CC#CCOC(C)C 6e8db9745cabe9183b9bff9444d41366 [0,2,0,0,0,0|1,0,1]=4 404 B7R0.4 CC(=CCNC=O)C aa6f8132c2b4d81390aba70f51f750c7 [0,2,0,0,0,0|1,0,1]=4 405 B7R0.4 CC(=O)COCC=O 465b1cf75d509df2704309fff91522d1 [0,2,0,0,0,0|1,0,1]=4 406 B7R0.4 CC(C)CCNC=O 8fb8d2f77b8e7548ff10a901f65a6a2b [0,2,0,0,0,0|1,0,0]=3 407 B7R0.4 CC(C)CCOCF 5c4beb2cb4fc50a6f233dfe91cf9c945 [0,2,0,0,0,0|1,0,1]=4 408 B7R0.4 CC(C)CNCC=O e2e655e4d2528bc07c0e7e73f520729a [0,2,0,0,0,0|1,0,0]=3 409 B7R0.4 CC(C)COCC#N 7cb07814ea2e3e867e4666ea75f57343 [0,2,0,0,0,0|1,0,1]=4 410 B7R0.4 CC(C)COCC=O bd41a1e672abb592bd026a120b038c2b [0,2,0,0,0,0|0,0,0]=2 411 B7R0.4 CC(C)COCCF 83bb949d8c551562556937d0600d6efb [0,2,0,0,0,0|1,0,1]=4 412 B7R0.4 CC(C)COCCS 84ea4ff8f634d7739886cdbaa6625a00 [0,2,0,0,0,0|0,1,1]=4 413 B7R0.4 CC(C)OC/C=C/Cl 91491ffbe45b122c593493ce1ec28e21 [0,2,0,0,0,0|1,0,0]=3 414 B7R0.4 CC(C)OC/C=C\Cl 1e6b64e528b3b312db8e7f5d9f5e401f [0,2,0,0,0,0|1,0,0]=3 415 B7R0.4 CC(C)OCC#CI 4c8fc2966cbeaebc02cf131b7a8b6c02 [0,2,0,0,0,0|1,0,1]=4 416 B7R0.4 CC(C)OCC=CCl 05c2ee32f696ac6fe468daf78fa733c3 [0,2,0,0,0,0|1,0,0]=3 417 B7R0.4 CC(C)OCCC#N fd21c0fde146e79c4d1d9956f568a2be [0,2,0,0,0,0|1,0,1]=4 418 B7R0.4 CC(C)OCCC=O ccbf2d62dbd49bddcfe1567d50bb806b [0,2,0,0,0,0|0,0,0]=2 419 B7R0.4 CC(C)OCCCF 4d070417a783226fcc67bd342ecf7613 [0,2,0,0,0,0|1,0,1]=4 420 B7R0.4 CC(C)OCCCS 3817134d1cec338c192448359f8580cb [0,2,0,0,0,0|0,1,1]=4 421 B7R0.4 CC(C)OCNC#N 8f3411903ede6efaaea2b9680079d965 [0,2,0,0,0,0|1,0,1]=4 422 B7R0.4 CC(C)OCSC#N 2c963f31d995f44a8c820f843be23366 [0,2,0,0,0,0|0,1,1]=4 423 B7R0.4 CC(F)COCC=O b46e29d4101a17f157843c4bdc730f6e [0,2,0,0,0,0|1,0,0]=3 424 B7R0.4 CC(O)CCNC=O 7d16a38d54e5204f080aee8a4fea20ce [0,2,0,0,0,0|2,0,0]=4 425 B7R0.4 CC(O)CNCC=O 944b3483ce03d29e552c3844291f44b6 [0,2,0,0,0,0|2,0,0]=4 426 B7R0.4 CC(S)COCC=O 15ebcb7a251dae8d81b8432f521474d6 [0,2,0,0,0,0|1,0,0]=3 427 B7R0.4 CC=CCNC(C)C fbbab91c5c0fa912c14bc0d774686380 [0,2,0,0,0,0|2,0,0]=4 428 B7R0.4 CC=CCOC(C)C 1ffcebdd116c02bae4b2efc3a6b36695 [0,2,0,0,0,0|1,0,0]=3 429 B7R0.4 CCCCOC(C)C eb1bac952091f26d8e354583c355080c [0,2,0,0,0,0|1,0,1]=4 430 B7R0.4 CCCOCC(C)C 519497356751b621892cf233de56054b [0,2,0,0,0,0|1,0,1]=4 431 B7R0.4 CCOCCC(C)C a81ef4c75f60509d0095bacdc570a8e6 [0,2,0,0,0,0|1,0,1]=4 432 B7R0.4 CCOCOC(C)C fcb36bcabbd9c702db3bb59956b361ad [0,2,0,0,0,0|0,0,2]=4 433 B7R0.4 CN(C)CCNC=O f6c5ad5f38b9716c3e69f7010da88e20 [0,2,0,0,0,0|2,0,0]=4 434 B7R0.4 COCCOC(C)C 66ff9033a5dadbe3413ec342d9a7c9fe [0,2,0,0,0,0|0,0,2]=4 435 B7R0.4 COCOCC(C)C 61a68151721001e97ead89f074e554c8 [0,2,0,0,0,0|0,0,2]=4 436 B7R0.4 CSCCOC(C)C 898b6e38b775cb6892ffe8b724ad6a1f [0,2,0,0,0,0|0,1,1]=4 437 B7R0.4 CSCOCC(C)C 2e75b1421641e4cf6bcc7f6e6907b733 [0,2,0,0,0,0|0,1,1]=4 438 B7R0.4 C[C@@H](F)COCC=O dfd322669411a585629980eb6b5be0dd [0,2,0,0,0,0|1,0,0]=3 439 B7R0.4 C[C@@H](O)CCNC=O 063b940170a2cb4a98efeca14a33a52e [0,2,0,0,0,0|2,0,0]=4 440 B7R0.4 C[C@@H](O)CNCC=O ae52f375140c99168e4849031ee267c7 [0,2,0,0,0,0|2,0,0]=4 441 B7R0.4 C[C@H](F)COCC=O 41a7eddb5d50f5c0a8a1cffec2a2d618 [0,2,0,0,0,0|1,0,0]=3 442 B7R0.4 C[C@H](O)CCNC=O cef20fefdcc1f37d90fc224277e1f868 [0,2,0,0,0,0|2,0,0]=4 443 B7R0.4 C[C@H](O)CNCC=O 58f727508ba2f4be3dc454ceda8497a8 [0,2,0,0,0,0|2,0,0]=4 444 B7R0.4 O=CCOCC(F)F e1093cd74239d1a778019e251c691d5f [0,2,0,0,0,0|2,0,0]=4 445 B7R0.6 C=C(Br)CNC(C)C c11e07a13ecc707bc58321e025560b63 [0,2,0,0,0,0|2,0,0]=4 446 B7R0.6 C=C(Br)COC(C)C 85740d76b7c2437207f473c522fb5652 [0,2,0,0,0,0|1,0,0]=3 447 B7R0.6 C=C(C)CNC(C)C a1a7325d3d8a8203023e8236e36cdc1a [0,2,0,0,0,0|2,0,0]=4 448 B7R0.6 C=C(C)COC(C)C 1163708fe8e5f25f773925b58859ae9a [0,2,0,0,0,0|1,0,0]=3 449 B7R0.6 C=C(Cl)COC(C)C 83e9098a63a39f58f2f10cb0166f135d [0,2,0,0,0,0|1,0,0]=3 450 B7R0.6 C=C(I)COC(C)C 638d63b8c7c0ebdc1a903379afb5a44c [0,2,0,0,0,0|1,0,0]=3 451 B7R0.6 CC(=O)CNC(C)C afe0e5afa4a4991702b8d7ba141d2521 [0,2,0,0,0,0|1,0,0]=3 452 B7R0.6 CC(=O)COC(C)C 8e58824c7076e094538494c263248304 [0,2,0,0,0,0|0,0,0]=2 453 B7R0.6 CC(=O)NCC(C)C 133e349c691ad200ad773179becc5ae8 [0,2,0,0,0,0|1,0,0]=3 454 B7R0.6 CC(=O)NCC(C)O 0ffb7326836e65b1a201fca72ad947e5 [0,2,0,0,0,0|2,0,0]=4 455 B7R0.6 CC(=O)NC[C@@H](C)O f988b940337d1dc00ccd246da11ece9f [0,2,0,0,0,0|2,0,0]=4 456 B7R0.6 CC(=O)NC[C@H](C)O 1a6130441852f98535cb020ca3c20f02 [0,2,0,0,0,0|2,0,0]=4 457 B7R0.6 CC(C)COC(C)C 77eecc331fd01778c375925278ff8a8b [0,2,0,0,0,0|1,0,1]=4 458 B7R0.6 CC(C)NCC(=O)N fce70d443053108c75f9dd76e148c70e [0,2,0,0,0,0|1,0,0]=3 459 B7R0.6 CC(C)NCC(=O)O 43feb4147baaae13baaa9c5f09499603 [0,2,0,0,0,0|1,0,0]=3 460 B7R0.6 CC(C)OCC(=O)N 2925a3543d892638d60eb7349262c8f3 [0,2,0,0,0,0|0,0,0]=2 461 B7R0.6 CC(C)OCC(=O)O 4f99bad05a342ea59eb9c6b2912ac68e [0,2,0,0,0,0|0,0,0]=2 462 B7R0.6 CC(C)OCC(=S)N 1cbdee4d5c3385daad7ba959afed69ee [0,2,0,0,0,0|0,1,0]=3 463 B7R0.6 CC(C)OCC(F)F 3a22706a89b0937c0849011a08e51b94 [0,2,0,0,0,0|1,0,1]=4 464 B7R0.6 CC(C)OCN(C)C 10d50f079b7aea6fe97d70fc778c501b [0,2,0,0,0,0|1,0,1]=4 465 B7R0.6 CC(C)OCS(=O)O dcec0ddacfe27b8d3be4af6ba949ffc8 [0,2,0,0,0,0|0,0,1]=3 466 B7R0.6 CC(C)OC[C@@H](C)F 20a173ffcc76fe6afc30e0651bd85f9b [0,2,0,0,0,0|1,0,1]=4 467 B7R0.6 CC(C)OC[C@H](C)F 68e099b1d0df355662b96af0ef440aac [0,2,0,0,0,0|1,0,1]=4 468 B7R0.6 CC(C)OC[N+](=O)[O-] a09a83c915051312c8a631b9d400a750 [0,2,0,0,0,0|0,0,1]=3 469 B7R0.6 CC(F)COC(C)C 0baa8e540b95c92b06f0417877dbd740 [0,2,0,0,0,0|1,0,1]=4 470 B7R0.6 CC(S)COC(C)C 57c18a958d625f63860f9eb7db36a7e5 [0,2,0,0,0,0|0,1,1]=4 471 B7R0.8 C=CCNC(C)(C)C 6c0b812000d6c6a48de43a4a3f837f6a [0,2,0,0,0,0|2,0,0]=4 472 B7R0.8 CC(C)(Br)COCF a2ed6a616d532f8faaded75f8946e86e [0,2,0,0,0,0|1,0,1]=4 473 B7R0.8 CC(C)(C)CNC=O 62263fecd6dfd3bbe3846c082198510b [0,2,0,0,0,0|1,0,0]=3 474 B7R0.8 CC(C)(C)COCF 57dd80210ffbd1c389fc6f81c3e76251 [0,2,0,0,0,0|1,0,1]=4 475 B7R0.8 CC(C)(C)NCC=O 84f91e0185bc7a8cbf173006cc00a31e [0,2,0,0,0,0|1,0,0]=3 476 B7R0.8 CC(C)(F)COCF c2c8aa5e71579bf523c1627a80567a99 [0,2,0,0,0,0|1,0,1]=4 477 B7R0.8 CC(C)(O)CNC=O 342a9b6d29541cfeadb382656f3815a5 [0,2,0,0,0,0|1,0,0]=3 478 B7R0.8 CC(C)(S)COCF 5e5d9df6938dea8946b0e42a96b28fba [0,2,0,0,0,0|1,0,1]=4 479 B7R0.8 CC(F)(F)CNC=O 98b7d4b4560412215082fc8ac3d2ca18 [0,2,0,0,0,0|2,0,0]=4 480 B7R0.8 CCOCC(C)(C)Br c5fd84cd204c784fac27f51432de2345 [0,2,0,0,0,0|1,0,1]=4 481 B7R0.8 CCOCC(C)(C)C cbc6e6dff9d30de641f2a7020db5e172 [0,2,0,0,0,0|1,0,1]=4 482 B7R0.8 CCOCC(C)(C)F 4ceebf68b1b3af46558065e266734baa [0,2,0,0,0,0|1,0,1]=4 483 B7R0.8 CCOCC(C)(C)S a7e0d94172e2fed0c574a998a7210b49 [0,2,0,0,0,0|1,0,1]=4 484 B7R1.5 CC1CC1NC=O 11d2e4098455fa895a61be5d2e846089 [0,1,0,1,0,0|1,0,0]=3 485 B7R1.6 CCOC1CCC1 1be1aa1621ba0b71d53802beb6ef9946 [0,1,0,1,0,0|1,0,1]=4 486 B7R1.6 CCOC1COC1 5ee51175a5d1fbea3fd7b3b34e98d1ce [0,1,0,1,0,0|1,0,1]=4 487 B7R1.6 CCOC1CSC1 e43094097e190583d3451ab95271420f [0,1,0,1,0,0|1,0,1]=4 488 B7R1.6 FCOC1CCC1 9e1f264b6931548d5472d7bf95e89d96 [0,1,0,1,0,0|1,0,1]=4 489 B7R1.6 FCOC1COC1 34c857acb95e7e5066efa9e8f851b6c5 [0,1,0,1,0,0|1,0,1]=4 490 B7R1.6 FCOC1CSC1 c3629ce88eeefd302ac1510ed7a5efdb [0,1,0,1,0,0|1,0,1]=4 491 B7R1.6 O=CCN1CCC1 c2093fa3a09c779905e30743087db6d6 [0,1,0,1,0,0|2,0,0]=4 492 B7R1.6 O=CNC1COC1 910edb395eecbce8af210d974d8d054c [0,1,0,1,0,0|1,0,0]=3 493 B7R1.10 O=CN1CC(C1)F 10673579aa5b90bc9fa1305ce11b0f6e [0,1,0,1,0,0|2,0,0]=4 494 B7R1.10 O=CN1CC(C1)O c56a5fb25f079a78b4196509b3241e16 [0,1,0,1,0,0|2,0,0]=4 495 B7R1.21 CC1(CC1)NC=O 07b8dc5a3dd0a56dffd330aa7b75c69f [0,1,0,1,0,0|1,0,0]=3 496 B7R1.22 CN(C=O)C1CC1 928f5a4e3607cba3f0183c684f92be70 [0,1,0,1,0,0|1,0,0]=3 497 B7R1.20 CC(=O)NC1CC1 d75fb765a64005f603eb0ff25694647c [0,1,0,1,0,0|1,0,0]=3 498 B7R1.20 CC(C)OC1CC1 2ba1c960117d477fcaacedd25b727831 [0,1,0,1,0,0|1,0,1]=4 499 B7R1.23 CC1(CN1C=O)C 554667b638ac8d632390465d91f13ad0 [0,1,0,1,0,0|1,0,0]=3 500 B7R1.7 C#CCOC1CC1 5fdc8972237e2849d78e13ef5a1a79ef [0,1,0,1,0,0|1,0,1]=4 501 B7R1.7 C=CCNC1CC1 3f9b6ba489361afb59ec73915e7e75b8 [0,1,0,1,0,0|2,0,0]=4 502 B7R1.7 C=CCOC1CC1 e9d2d1f50ca09419f38c26ddd9fe852c [0,1,0,1,0,0|1,0,0]=3 503 B7R1.7 CCCOC1CC1 1605df6110acb8784adb6061f4289edf [0,1,0,1,0,0|1,0,1]=4 504 B7R1.7 CCOCC1CC1 744f8109a21f695c28440e411c1b9ca0 [0,1,0,1,0,0|1,0,1]=4 505 B7R1.7 COCOC1CC1 026a9c25eccde58eb88281f1e9079e4e [0,1,0,1,0,0|0,0,2]=4 506 B7R1.7 CSCOC1CC1 31d94a402b0c255e4d0b0577bbb73612 [0,1,0,1,0,0|0,1,1]=4 507 B7R1.7 FCCOC1CC1 d382ce3d6b1520a06dd26d6fc11c28ce [0,1,0,1,0,0|1,0,1]=4 508 B7R1.7 FCOCC1CC1 ca8fac99f1600978aadc627ea28dfc26 [0,1,0,1,0,0|1,0,1]=4 509 B7R1.7 N#CCOC1CC1 d7c2e7fafb0b43edd26a7ce548ab2216 [0,1,0,1,0,0|1,0,1]=4 510 B7R1.7 O=CCNC1CC1 96e340af7b360f214201a5a3c0a006d0 [0,1,0,1,0,0|1,0,0]=3 511 B7R1.7 O=CCOC1CC1 147e3a4ed8a55c478f33e39a4b8c183b [0,1,0,1,0,0|0,0,0]=2 512 B7R1.7 O=CNCC1CC1 d46f669abbd5c66800b3b497373db92a [0,1,0,1,0,0|1,0,0]=3 513 B7R1.7 SCCOC1CC1 b7a85648a7aee83a47e4374e76fa4b99 [0,1,0,1,0,0|0,1,1]=4