0 B6R0.6 BrCCNCCBr CS-D1601 [0,0,0,0,0,0|2,0,0]=2 1 B6R0.6 C#CCCCCBr CS-0248001 [0,0,0,0,0,0|3,0,1]=4 2 B6R0.6 CCCCCCO CS-0076046 [0,0,0,0,0,0|3,0,0]=3 3 B6R0.6 NCCOCCN CS-W006284 [0,0,0,0,0,0|1,0,0]=1 4 B6R0.6 NCCOCCS CS-0115806 [0,0,0,0,0,0|2,0,0]=2 5 B5R0.2 C#CCCNN CS-0905046 [1,0,0,0,0,0|2,0,1]=4 6 B5R0.2 C=CCCCO CS-W011355 [1,0,0,0,0,0|2,0,1]=4 7 B5R0.2 N#CCCCN CS-0343605 [1,0,0,0,0,0|0,0,2]=3 8 B5R0.2 N#CCCCO CS-W001264 [1,0,0,0,0,0|1,0,2]=4 9 B7R0.1 C#CCCCCCN CS-0864774 [0,1,0,0,0,0|2,0,0]=3 10 B7R0.1 C=CCCCCCO CS-0185704 [0,1,0,0,0,0|3,0,0]=4 11 B7R0.1 COCCOCCO CS-0116091 [0,1,0,0,0,0|3,0,0]=4 12 B7R0.1 OCCSSCCO CS-0113483 [0,1,0,0,0,0|3,0,0]=4 13 B7R0.3 CCCN[C@H](C)CO CS-0626374 [0,1,0,0,0,0|2,0,0]=3 14 B7R0.4 CCCCCC(N)=O CS-0128758 [0,1,0,0,0,0|2,0,1]=4 15 B7R0.4 NCCOCC(F)F CS-0530456 [0,1,0,0,0,0|2,0,0]=3 16 B7R0.4 OCCNCC(F)F CS-0265634 [0,1,0,0,0,0|2,0,0]=3 17 B7R0.7 CCC[C@@H](N)CCO CS-0162168 [0,1,0,0,0,0|3,0,0]=4 18 B7R1.1 BrC[C@@H]1CCCO1 CS-0310762 [0,0,0,1,0,0|3,0,0]=4 19 B7R1.1 CC[C@@H]1CCCN1 CS-0452663 [0,0,0,1,0,0|2,0,0]=3 20 B7R1.1 ClCC1CCCO1 CS-W011203 [0,0,0,1,0,0|3,0,0]=4 21 B7R1.1 N#C[C@H]1CCCN1 CS-0053948 [0,0,0,1,0,0|1,0,2]=4 22 B7R1.1 NOC1CCCC1 CS-0634533 [0,0,0,1,0,0|3,0,0]=4 23 B7R1.1 OCC1CCCS1 CS-0265065 [0,0,0,1,0,0|3,0,0]=4 24 B7R1.3 NC1C=CCCC1 CS-0447132 [0,0,0,1,0,0|2,0,1]=4 25 B7R1.3 NC1CCNCC1 CS-0069687 [0,0,0,1,0,0|3,0,0]=4 26 B7R1.3 N[C@H]1CCCNC1 CS-W020063 [0,0,0,1,0,0|1,0,0]=2 27 B7R1.4 C=C1COCC1N CS-0434887 [0,0,0,1,0,0|2,0,1]=4 28 B7R1.4 C[C@H]1CNC[C@H]1O CS-0036375 [0,0,0,1,0,0|2,0,0]=3 29 B7R1.4 C[C@H]1OCC[C@H]1N CS-0038438 [0,0,0,1,0,0|3,0,0]=4 30 B7R1.4 N[C@@H]1COC[C@@H]1O CS-0139374 [0,0,0,1,0,0|2,0,0]=3 31 B7R1.4 N[C@H]1COC[C@@H]1F CS-0183120 [0,0,0,1,0,0|2,0,0]=3 32 B7R1.4 N[C@H]1COC[C@H]1O CS-0053228 [0,0,0,1,0,0|2,0,0]=3 33 B7R1.4 O[C@H]1CCC[C@H]1O CS-0132323 [0,0,0,1,0,0|3,0,0]=4 34 B7R1.7 OCCOC1CC1 CS-0432950 [0,0,0,1,0,0|3,0,0]=4 35 B4R0.2 NNCCO CS-W007663 [2,0,0,0,0,0|1,0,0]=3 36 B6R0.1 NC(CO)CCO CS-0091333 [1,1,0,0,0,0|2,0,0]=4 37 B6R0.1 OC(CBr)CCBr CS-0449071 [1,1,0,0,0,0|2,0,0]=4 38 B6R0.1 OCC[C@@H](Br)CO CS-1141050 [1,1,0,0,0,0|2,0,0]=4 39 B6R0.4 CC(C)CCCN CS-0252871 [1,1,0,0,0,0|1,0,0]=3 40 B8R0.4 C#CCCCCCCN CS-0110134 [0,2,0,0,0,0|2,0,0]=4 41 B8R0.4 COCCOCCON CS-0114359 [0,2,0,0,0,0|2,0,0]=4 42 B8R0.4 NCCCNCCCCl CS-0885982 [0,2,0,0,0,0|1,0,0]=3 43 B8R0.4 NOCCOCCON CS-0114992 [0,2,0,0,0,0|1,0,0]=3 44 B8R0.4 [N-]=[N+]=NCCCCCN CS-0567250 [0,2,0,0,0,0|1,0,1]=4 45 B8R0.7 NCCCNCC(=O)O CS-0119868 [0,2,0,0,0,0|1,0,1]=4 46 B8R0.7 NCCNCCC(=O)[O-] CS-0162521 [0,2,0,0,0,0|1,0,0]=3 47 B8R0.7 NCCOCCC(=O)O CS-0114519 [0,2,0,0,0,0|2,0,0]=4 48 B8R0.9 NCC(=O)NCC(F)F CS-0618168 [0,2,0,0,0,0|1,0,1]=4 49 B8R0.11 CCCCC(CC)CN CS-W016071 [0,2,0,0,0,0|2,0,0]=4 50 B8R0.22 CCN(CCCl)CCCl CS-0539585 [0,2,0,0,0,0|2,0,0]=4 51 B6R1.1 C1C[Se]CCN1 CS-0371384 [1,0,0,1,0,0|1,0,0]=3 52 B6R1.2 CC1NCCS1 CS-0206098 [1,0,0,1,0,0|1,0,0]=3 53 B6R1.2 NC1CSSC1 CS-0342808 [1,0,0,1,0,0|2,0,0]=4 54 B6R1.2 NN1CCCC1 CS-W001610 [1,0,0,1,0,0|2,0,0]=4 55 B6R1.3 NNCC1CC1 CS-0053098 [1,0,0,1,0,0|2,0,0]=4 56 B6R1.3 OCC[C@H]1CO1 CS-0081472 [1,0,0,1,0,0|2,0,0]=4 57 B6R1.4 N[C@@H]1CC[C@@H]1O CS-0184482 [1,0,0,1,0,0|1,0,0]=3 58 B6R1.4 N[C@@H]1CNC1=O CS-0185261 [1,0,0,1,0,0|1,0,1]=4 59 B6R1.4 N[C@H]1CNC1=O CS-0053270 [1,0,0,1,0,0|1,0,1]=4 60 B6R1.6 N#C[C@H]1CCN1 CS-0172824 [1,0,0,1,0,0|0,0,2]=4 61 B6R1.6 OC[C@@H]1CCO1 CS-0099311 [1,0,0,1,0,0|2,0,0]=4 62 B6R1.6 OC[C@H]1CCN1 CS-0053482 [1,0,0,1,0,0|1,0,0]=3 63 B8R1.2 CCC1CNCCO1 CS-0184012 [0,1,0,1,0,0|2,0,0]=4 64 B8R1.2 CC[C@@H]1CNCCN1 CS-M3408 [0,1,0,1,0,0|1,0,0]=3 65 B8R1.2 CC[C@H]1CNCCN1 CS-W023213 [0,1,0,1,0,0|1,0,0]=3 66 B8R1.2 CC[C@H]1COCCN1 CS-0146947 [0,1,0,1,0,0|2,0,0]=4 67 B8R1.2 FC[C@@H]1CNCCO1 CS-0566523 [0,1,0,1,0,0|2,0,0]=4 68 B8R1.2 FC[C@H]1CCCNC1 CS-0435451 [0,1,0,1,0,0|2,0,0]=4 69 B8R1.2 FC[C@H]1CNCCO1 CS-0566313 [0,1,0,1,0,0|2,0,0]=4 70 B8R1.2 N#C[C@@H]1COCCN1 CS-0103647 [0,1,0,1,0,0|1,0,1]=4 71 B8R1.2 N#C[C@H]1CCCCN1 CS-0054004 [0,1,0,1,0,0|1,0,1]=4 72 B8R1.2 N#C[C@H]1CNCCO1 CS-0652638 [0,1,0,1,0,0|1,0,1]=4 73 B8R1.2 NC[C@@H]1CCCNC1 CS-0169043 [0,1,0,1,0,0|1,0,0]=3 74 B8R1.2 NC[C@H]1CCCNC1 CS-0169042 [0,1,0,1,0,0|1,0,0]=3 75 B8R1.2 NC[C@H]1CCCNC1 CS-0173371 [0,1,0,1,0,0|1,0,0]=3 76 B8R1.2 OC[C@@H]1CNCCO1 CS-0020036 [0,1,0,1,0,0|2,0,0]=4 77 B8R1.5 O[C@@H]1CCNC[C@H]1F CS-0368740 [0,1,0,1,0,0|2,0,0]=4 78 B8R1.5 O[C@@H]1CNCC[C@@H]1F CS-0502796 [0,1,0,1,0,0|2,0,0]=4 79 B8R1.8 C=CC[C@@H]1CCCN1 CS-0158619 [0,1,0,1,0,0|2,0,0]=4 80 B8R1.8 NNCC1CCCC1 CS-0049621 [0,1,0,1,0,0|2,0,0]=4 81 B8R1.8 OCCN1CCCC1 CS-W011235 [0,1,0,1,0,0|2,0,0]=4 82 B8R1.11 CO[C@@H]1CCC[C@H]1N CS-0183718 [0,1,0,1,0,0|2,0,0]=4 83 B8R1.11 CO[C@@H]1CCC[C@H]1N CS-0737895 [0,1,0,1,0,0|2,0,0]=4 84 B8R1.11 CO[C@@H]1CNC[C@@H]1F CS-0628353 [0,1,0,1,0,0|2,0,0]=4 85 B8R1.11 NCC1CCCC1O CS-0260689 [0,1,0,1,0,0|2,0,0]=4 86 B8R1.11 NCC1CCCC1O CS-0459964 [0,1,0,1,0,0|2,0,0]=4 87 B8R1.11 NC[C@H]1COC[C@@H]1O CS-0054588 [0,1,0,1,0,0|2,0,0]=4 88 B8R1.11 N[C@H]1COC[C@H]1CO CS-0613627 [0,1,0,1,0,0|2,0,0]=4 89 B8R1.13 COC[C@H]1CC[C@@H]1N CS-0433333 [0,1,0,1,0,0|2,0,0]=4 90 B8R1.13 COC[C@H]1CC[C@H]1N CS-0184248 [0,1,0,1,0,0|2,0,0]=4 91 B8R1.36 C#CCCNC1CC1 CS-0835641 [0,1,0,1,0,0|2,0,0]=4 92 B8R1.1 FC[C@@H]1C[C@H](F)CN1 CS-0039722 [0,1,0,1,0,0|2,0,0]=4 93 B8R1.3 C[C@H]1CO[C@H](C)CN1 CS-0183890 [0,1,0,1,0,0|2,0,0]=4 94 B8R1.4 C[C@@H]1CCC[C@H](N)C1 CS-0309584 [0,1,0,1,0,0|2,0,0]=4 95 B8R1.4 C[C@H]1CNC[C@H](C)N1 CS-0001867 [0,1,0,1,0,0|1,0,0]=3 96 B8R1.4 N[C@H]1CCC[C@@H](O)C1 CS-0042346 [0,1,0,1,0,0|2,0,0]=4 97 B8R1.6 NC1CN(CCF)C1 CS-0506107 [0,1,0,1,0,0|1,0,0]=3 98 B8R1.7 C[C@@H](N)C1CCCC1 CS-0135387 [0,1,0,1,0,0|2,0,0]=4 99 B8R1.7 N=C(N)C1CCCN1 CS-WAA0204 [0,1,0,1,0,0|1,0,1]=4 100 B8R1.19 OC1CNCC1(F)F CS-0051119 [0,1,0,1,0,0|2,0,0]=4 101 B8R1.72 CC1(C)CNCCO1 CS-0052185 [0,1,0,1,0,0|2,0,0]=4 102 B8R2.25 C1CC2CC2CN1 CS-0059003 [0,0,0,2,0,0|2,0,0]=4 103 B8R2.42 C1CC2(C1)CCN2 CS-0131307 [0,0,0,2,0,0|2,0,0]=4 104 B8R2.19 NC1CCC12CC2 CS-0109007 [0,0,0,2,0,0|2,0,0]=4 105 B8R2.24 C1CC1NC2CC2 CS-W019025 [0,0,0,2,0,0|2,0,0]=4