0 B7R0.18 CCC(CO)(CO)N PI-34179 [0,0,0,0,0,0|1,0,0]=1 1 B7R0.18 OCC(CO)(CO)N PI-27069 [0,0,0,0,0,0|0,0,0]=0 2 B7R0.18 OCC(N)(CO)CO PI-34173 [0,0,0,0,0,0|0,0,0]=0 3 B6R0.8 CC(N)(CC)C#C PI-36167 [1,0,0,0,0,0|2,0,1]=4 4 B6R0.9 CCC(CC)CBr PI-47059 [1,0,0,0,0,0|3,0,0]=4 5 B6R0.9 OCC(CC)CO PI-41977 [1,0,0,0,0,0|1,0,0]=2 6 B6R0.9 OCC(CO)CO PI-37259 [1,0,0,0,0,0|0,0,0]=1 7 B6R0.9 OCC(OC)CO PI-46661 [1,0,0,0,0,0|2,0,0]=3 8 B8R0.10 OCC(CO)(OC)OC PI-38182 [0,1,0,0,0,0|3,0,0]=4 9 B8R0.10 OC[P+](CO)(CO)CO PI-32401 [0,1,0,0,0,0|2,0,0]=3 10 B8R0.31 CCC(CC)(CCO)O PI-34615 [0,1,0,0,0,0|3,0,0]=4 11 B8R0.36 CCC(CC)(C(=O)O)N PI-43225 [0,1,0,0,0,0|2,0,1]=4 12 B8R0.36 OCC(Br)(CO)[N+](=O)[O-] PI-11803 [0,1,0,0,0,0|2,0,1]=4 13 B8R1.60 C1C(CO1)(CCl)CCl PI-40964 [0,0,0,1,0,0|3,0,0]=4 14 B8R1.60 OCC1(CBr)COC1 PI-46664 [0,0,0,1,0,0|2,0,0]=3 15 B8R1.60 OCC1(CO)COC1 PI-39566 [0,0,0,1,0,0|1,0,0]=2 16 B5R0.3 C(C(C=O)O)O PI-14881 [2,0,0,0,0,0|0,0,2]=4 17 B5R0.3 C(C(CBr)O)Br PI-47056 [2,0,0,0,0,0|2,0,0]=4 18 B5R0.3 C(C(CCl)O)F PI-20093 [2,0,0,0,0,0|2,0,0]=4 19 B5R0.3 C(C(CCl)O)O PI-16668 [2,0,0,0,0,0|1,0,0]=3 20 B5R0.3 C(C(CO)N)O PI-16192 [2,0,0,0,0,0|0,0,0]=2 21 B5R0.3 C(C(CO)O)N PI-10528 [2,0,0,0,0,0|1,0,0]=3 22 B5R0.3 C([C@@H](CCl)O)N PI-48662 [2,0,0,0,0,0|2,0,0]=4 23 B5R0.3 C=C[C@H](CO)N PI-48191 [2,0,0,0,0,0|1,0,1]=4 24 B5R0.3 CCC(CO)N PI-45910 [2,0,0,0,0,0|1,0,0]=3 25 B5R0.3 NCC(O)CO PI-12972 [2,0,0,0,0,0|1,0,0]=3 26 B5R0.3 NC[C@H](O)CO PI-28266 [2,0,0,0,0,0|1,0,0]=3 27 B5R0.3 N[C@H](CO)C=C PI-36414 [2,0,0,0,0,0|1,0,1]=4 28 B5R0.3 O=C[C@@H](O)CO PI-14882 [2,0,0,0,0,0|0,0,2]=4 29 B5R0.3 OCC(=C)CO PI-24347 [2,0,0,0,0,0|0,0,2]=4 30 B5R0.3 OCC(CO)N PI-10243 [2,0,0,0,0,0|0,0,0]=2 31 B5R0.3 OCC(O)CO PI-12961 [2,0,0,0,0,0|0,0,0]=2 32 B5R0.3 OC[C@H](O)CCl PI-16667 [2,0,0,0,0,0|1,0,0]=3 33 B5R0.4 CC(C)(C#N)N PI-12615 [2,0,0,0,0,0|1,0,1]=4 34 B5R0.4 CC(C)(C)CN PI-21979 [2,0,0,0,0,0|2,0,0]=4 35 B5R0.4 CC(C)(CO)N PI-50412 [2,0,0,0,0,0|0,0,0]=2 36 B5R0.4 CCC(C)(C)[O-] PI-38669 [2,0,0,0,0,0|2,0,0]=4 37 B5R0.4 C[Si](C)(C)CO PI-35298 [2,0,0,0,0,0|1,1,0]=4 38 B5R0.4 NCC(C)(C)C PI-14589 [2,0,0,0,0,0|2,0,0]=4 39 B5R0.4 NCC(O)(C)C PI-37508 [2,0,0,0,0,0|2,0,0]=4 40 B5R0.4 OCC(F)(F)C PI-39537 [2,0,0,0,0,0|2,0,0]=4 41 B7R0.13 CC(CS)(C(=O)O)N PI-35158 [1,1,0,0,0,0|0,1,1]=4 42 B7R0.13 CCC(C)(C(=O)O)N PI-26543 [1,1,0,0,0,0|1,0,1]=4 43 B7R0.13 CCC(C)(C(=O)O)N PI-26663 [1,1,0,0,0,0|1,0,1]=4 44 B7R0.13 CCC(C)(C(=O)O)N PI-26777 [1,1,0,0,0,0|1,0,1]=4 45 B7R0.13 CCC(C)(C(=O)O)N PI-26778 [1,1,0,0,0,0|1,0,1]=4 46 B7R0.13 C[C@](N)(CS)C(=O)O PI-35159 [1,1,0,0,0,0|0,1,1]=4 47 B7R0.13 OC[C@@](C(=O)O)(N)C PI-14964 [1,1,0,0,0,0|0,0,1]=3 48 B7R0.12 CCCC(CO)CO PI-44018 [1,1,0,0,0,0|1,0,0]=3 49 B9R0.69 CCC(C)C(C)(CO)CO PI-47217 [0,2,0,0,0,0|2,0,0]=4 50 B9R0.76 OCC(C(=O)O)(C(C)C)N PI-26889 [0,2,0,0,0,0|1,0,1]=4 51 B7R1.25 CC1(COC1)CO PI-24315 [1,0,0,1,0,0|1,0,0]=3 52 B7R1.29 C1CC1(CO)CO PI-13563 [1,0,0,1,0,0|1,0,0]=3 53 B7R1.1 C1CCC(C1)CO PI-44131 [1,0,0,1,0,0|2,0,0]=4 54 B7R1.1 C1CNCC1CO PI-40189 [1,0,0,1,0,0|2,0,0]=4 55 B7R1.1 C1CNCC1CO PI-40190 [1,0,0,1,0,0|2,0,0]=4 56 B7R1.1 C1COCC1CBr PI-42703 [1,0,0,1,0,0|2,0,0]=4 57 B7R1.1 C1COCC1CCl PI-42702 [1,0,0,1,0,0|2,0,0]=4 58 B7R1.1 C1COCC1CO PI-41224 [1,0,0,1,0,0|1,0,0]=3 59 B7R1.1 ICC1COCC1 PI-42704 [1,0,0,1,0,0|2,0,0]=4 60 B7R1.1 OCC1CC=CC1 PI-35499 [1,0,0,1,0,0|2,0,0]=4 61 B9R1.204 NCC1(CO)CCCC1 PI-36303 [0,1,0,1,0,0|2,0,0]=4 62 B9R1.163 O=C(C1(N)COCC1)O PI-40281 [0,1,0,1,0,0|1,0,1]=4