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[2,0,0,0,0,0|2,0,0]=4 39 B15R2.130895 CC12CCC(N1CCO)(CC(=O)C2)C 68220a0f066670e6610f26a0ad6af47d [2,0,0,0,0,0|2,0,0]=4 40 B15R2.130895 CCCN1C2(CCC1(CC(=O)C2)C)C 3fab8a5ccfadd9afe5ee2135ead8823d [2,0,0,0,0,0|2,0,0]=4 41 B17R1.196222 CC(C)(O)CCN1C(CC(=O)CC1(C)C)(C)C 8dc280bcb3602e45075ec7f35198fd31 [0,1,1,0,0,0|2,0,0]=4 42 B17R1.385017 CC(CO)CCN1C(CC(=O)CC1(C)C)(C)C d08a3039420c1330d70bbec6f53c3cc4 [0,1,1,0,0,0|2,0,0]=4 43 B17R2.979335 CC12CCC(N1CCCCF)(CC(=O)C2)C e71b0266b4ded5244625055db0b20c3b [1,1,0,0,0,0|2,0,0]=4 44 B17R2.979335 CC12CCC(N1CCCCO)(CC(=O)C2)C 9a9df967556911bb77980d1609bb680d [1,1,0,0,0,0|2,0,0]=4 45 B17R2.979335 CCCCCN1C2(CCC1(CC(=O)C2)C)C 0513dd2e6a7e4fd96aed62083f67343a [1,1,0,0,0,0|2,0,0]=4 46 B17R2.979335 CCOCCN1C2(CCC1(CC(=O)C2)C)C 4b696a0eb748dc48c6f437c3e669c445 [1,1,0,0,0,0|2,0,0]=4 47 B17R2.979335 CCSCCN1C2(CCC1(CC(=O)C2)C)C 70e2572098b595c9aec97f4566014993 [1,1,0,0,0,0|2,0,0]=4 48 B17R2.979335 COCCCN1C2(CCC1(CC(=O)C2)C)C a6f1a2cd6a81cf81938ea546af04cc0e [1,1,0,0,0,0|2,0,0]=4 49 B17R2.979335 CSCCCN1C2(CCC1(CC(=O)C2)C)C 84f6c8dccdf3eda1cdb124c8af5f025c [1,1,0,0,0,0|2,0,0]=4 50 B17R2.1047333 CC(CCO)N1C2(CCC1(CC(=O)C2)C)C a71ae95937692cd93f17e76b82f592d8 [1,1,0,0,0,0|2,0,0]=4 51 B17R2.1047333 CCCC(C)N1C2(CCC1(CC(=O)C2)C)C ef949c867a8bd2331bc47e80fa3a65d0 [1,1,0,0,0,0|2,0,0]=4 52 B17R2.1122885 CC(CO)CN1C2(CCC1(CC(=O)C2)C)C f3e24aaeff5bc2a2166c3cd7609615d2 [1,1,0,0,0,0|2,0,0]=4 53 B17R2.1122885 CC12CCC(N1CC(O)CO)(CC(=O)C2)C 9922df9da78ba63a499624b6f8b06f41 [1,1,0,0,0,0|2,0,0]=4 54 B17R2.1122885 CC12CCC(N1C[C@@H](O)CO)(CC(=O)C2)C 423bac34f25bc2b8f6738aa7329799b6 [1,1,0,0,0,0|2,0,0]=4 55 B17R2.1122885 CC12CCC(N1C[C@H](O)CO)(CC(=O)C2)C 88b2f9a794e349c3ae07bdc009aafb31 [1,1,0,0,0,0|2,0,0]=4 56 B17R2.1122885 CCC(C)CN1C2(CCC1(CC(=O)C2)C)C b5d1d00dd585b7e690527ddd4b2d81b5 [1,1,0,0,0,0|2,0,0]=4 57 B17R2.1122885 CCC(O)CN1C2(CCC1(CC(=O)C2)C)C 8c51650e43133c42d7aba5dba00a3e7a [1,1,0,0,0,0|2,0,0]=4 58 B17R2.1122885 CC[C@@H](C)CN1C2(CCC1(CC(=O)C2)C)C a7c25ed3b5467169b8af56060d71ac88 [1,1,0,0,0,0|2,0,0]=4 59 B17R2.1122885 CC[C@H](C)CN1C2(CCC1(CC(=O)C2)C)C 1533dacb813643f1185773a2c40fda59 [1,1,0,0,0,0|2,0,0]=4 60 B17R2.1122885 C[C@@H](CO)CN1C2(CCC1(CC(=O)C2)C)C c2545b91fc8d130692149d033f2f8550 [1,1,0,0,0,0|2,0,0]=4 61 B17R2.1122885 C[C@H](CO)CN1C2(CCC1(CC(=O)C2)C)C 4dff67143f082de2830cce7dbf89aa34 [1,1,0,0,0,0|2,0,0]=4 62 B17R2.1286811 CC(C)(O)CN1C2(CCC1(CC(=O)C2)C)C 630e70e93e4353cebfbb4e730cf7b9a5 [0,1,0,0,1,0|2,0,0]=4 63 B19R2.8233550 CC(O)CCC(=O)N1C2(CCC1(CC(=O)C2)C)C d4f6bd75ea2a572c03bde84e181b4e6f [0,1,0,0,0,1|2,0,0]=4 64 B19R2.16297075 CC(C)(O)CCCN1C2(CCC1(CC(=O)C2)C)C 87d4af8d26caa1d2d30d560b74f430c1 [0,1,0,0,0,1|2,0,0]=4 65 B19R2.5921422 COC(CCN1C2(CCC1(CC(=O)C2)C)C)OC 1277b7e870a6b72a38542a469ab856ee [0,2,0,0,0,0|2,0,0]=4 66 B15R0.303 CC(C)CCCC(C)CC(=O)NC(C)CO 345cee47032a0250e03cb1e827da69ed [0,0,2,0,0,0|2,0,0]=4 67 B15R0.303 CC(C)CCCC(C)CC(=O)N[C@@H](C)CO ef6f46a49724284e398a883daadf44d1 [0,0,2,0,0,0|2,0,0]=4 68 B15R0.303 CC(C)CCCC(C)CC(=O)N[C@H](C)CO 4659a06c8b5b546cabf42ad9f10ff92b [0,0,2,0,0,0|2,0,0]=4 69 B15R0.303 COC(C)CC(=O)NC(C)CCCC(C)C 6155f77c9f60b951117ee51bc46673a7 [0,0,2,0,0,0|2,0,0]=4 70 B17R3.2932363 CC12CCC(N1CC3CC3)(CC(=O)C2)C 2518d6ebe52318ca65241fd9e0670e2d [1,0,0,1,0,0|2,0,0]=4 71 B19R3.14329676 CC12CCC(N1CCC3CCO3)(CC(=O)C2)C a7d376803035514880fa690f012f1226 [0,1,0,1,0,0|2,0,0]=4 72 B19R3.14329676 CC12CCC(N1CCC3COC3)(CC(=O)C2)C 581e4cdda09a03eb61f31bfb4ecb66e7 [0,1,0,1,0,0|2,0,0]=4 73 B15R1.15569 CC(O)CN1C(CC(=O)CC1(C)C)(C)C f0be381f3d1c219f9ca58c4e317b524f [0,0,1,0,1,0|2,0,0]=4 74 B15R1.15569 C[C@H](O)CN1C(CC(=O)CC1(C)C)(C)C 72ed98e40e6fc09a00b63b23427a579b [0,0,1,0,1,0|2,0,0]=4 75 B17R1.35183 CC(O)CCCN1C(CC(=O)CC1(C)C)(C)C f8ce4b1a2834864ebb5144fa17c9485f [0,0,1,0,0,1|2,0,0]=4 76 B19R2.8233512 CC(O)CCCCN1C2(CCC1(CC(=O)C2)C)C b7cc8b67ba5317a85b05b67cb368b1fb [0,0,0,0,0,2|2,0,0]=4 77 B19R2.8233512 C[C@@H](O)CCCCN1C2(CCC1(CC(=O)C2)C)C 4e06c39d02c71254c281970945988aee [0,0,0,0,0,2|2,0,0]=4 78 B14R0.1383 CC(O)CC(=O)NC(C)(C)CCCCO c64e4dbf2eaf7e8b4db1bc8b802e42b6 [1,0,2,0,0,0|1,0,0]=4 79 B14R0.1383 C[C@@H](O)CC(=O)NC(C)(C)CCCCO 96fa97558b2d259fe1c939cf6b5fdd82 [1,0,2,0,0,0|1,0,0]=4 80 B14R0.1383 C[C@H](O)CC(=O)NC(C)(C)CCCCO 36a6c7557a8def49a2986d32c5dbd22e [1,0,2,0,0,0|1,0,0]=4 81 B14R0.101 CC(O)CCCCCC(=O)NC(C)CO 10fcf2b88fc2abf0cd2874f474d9a0a1 [1,0,2,0,0,0|1,0,0]=4 82 B14R0.101 CC(O)CCCCCC(=O)N[C@@H](C)CO a0d5c1383f040cbb974295bd9d6620b2 [1,0,2,0,0,0|1,0,0]=4 83 B14R0.101 CC(O)CCCCCC(=O)N[C@H](C)CO ef7abfa528bacab2a012abd4735248a4 [1,0,2,0,0,0|1,0,0]=4 84 B14R0.230 CCCCCC(C)NC(=O)CC(C)OC d34e7abde44d79f29e5abf56b1da79bd [1,0,2,0,0,0|1,0,0]=4 85 B14R0.230 CCCCC[C@H](C)NC(=O)CC(C)OC f34fadb2d832d693426b20c1b48f3b34 [1,0,2,0,0,0|1,0,0]=4 86 B14R0.67 CC(=O)CCCOC(C)CCCC(C)C 49cc91ca246ada5142951f4828245653 [1,0,2,0,0,0|1,0,0]=4 87 B14R0.227 CCCCCC(C)COC(C)CC(=O)O f6c0af7945eb71824068d6f0bd322775 [1,0,2,0,0,0|1,0,0]=4 88 B14R0.227 CCCCCC(C)COC(C)OC(=O)C 46dfb70a720897b256b2ae9bac7bc7df [1,0,2,0,0,0|1,0,0]=4 89 B14R0.227 CCCCCC(C)OCC(C)NC(=O)C 45d17b8ed335d63999bcc5ac87c6c616 [1,0,2,0,0,0|1,0,0]=4 90 B14R0.227 CCCCCC(C)OC[C@@H](C)NC(=O)C 96a8cb30007a459a823f68ae53b707df [1,0,2,0,0,0|1,0,0]=4 91 B14R0.227 CCCCC[C@H](C)OCC(C)NC(=O)C a0656b337a30bb572051e0e0104b8474 [1,0,2,0,0,0|1,0,0]=4 92 B14R0.227 CCCCC[C@H](C)OC[C@@H](C)NC(=O)C add038bd149292d70e187c2fbd8031b5 [1,0,2,0,0,0|1,0,0]=4 93 B14R1.3152 CC(O)CCN1[C@@H](CC(=O)C[C@@H]1C)C 579a4f5f0edaad0ceb460a47233c820c [2,0,1,0,0,0|1,0,0]=4 94 B14R1.1600 CC(O)CCN1CCC(=O)CC1CO 0cf488e65ed55ec12f9da78f87637e9f [2,0,1,0,0,0|1,0,0]=4 95 B16R0.7984 COC(=O)CC(C)COC(C)CCCC(C)C 5f1e4455dcce2ab00d16aa28bd69049d [0,1,2,0,0,0|1,0,0]=4 96 B16R0.218 CC(C)CCCC(C)CC(=O)NCC(C)CO f3e81c6086473f88cafe6b808525cc15 [0,0,2,0,0,1|1,0,0]=4 97 B16R0.218 CC(C)CCCC(C)CC(=O)NC[C@H](C)CO 7141dd0f9e0626b7f0ce8342b3cd5ba2 [0,0,2,0,0,1|1,0,0]=4 98 B16R0.218 CO[C@@H](C)CNC(=O)CC(C)CCCC(C)C dd81a8a19072b90bbc9143cce110da6d [0,0,2,0,0,1|1,0,0]=4 99 B16R0.218 CO[C@H](C)CNC(=O)CC(C)CCCC(C)C 451c3afcb80d05a48db93644297d4e62 [0,0,2,0,0,1|1,0,0]=4 100 B16R0.2251 CC(=O)OCC(C)COC(C)CCCC(C)C 45dd52c496f36bba5b4d88a31722c8ac [0,0,2,0,0,1|1,0,0]=4