0 B9R1.69 BrC1=CC(=C(C=C1)C)Cl PI-20673 [0,0,0,0,0,0|3,1,0]=4 1 B9R1.69 BrC1=CN=C(C(=C1)C)C PI-41495 [0,0,0,0,0,0|2,1,1]=4 2 B9R1.69 Brc1ccc(=O)n(C)c1 PI-35908 [0,0,0,0,0,0|3,1,0]=4 3 B9R1.69 Brc1ccc(N)c(C)c1 PI-11003 [0,0,0,0,0,0|3,1,0]=4 4 B9R1.69 Brc1ccc(N)c(N)c1 PI-34413 [0,0,0,0,0,0|3,1,0]=4 5 B9R1.69 Brc1ccc(c(c1)Br)F PI-28149 [0,0,0,0,0,0|3,1,0]=4 6 B9R1.69 Brc1ccc(c(c1)C)I PI-21533 [0,0,0,0,0,0|3,1,0]=4 7 B9R1.69 Brc1ccc(c(c1)F)Br PI-20968 [0,0,0,0,0,0|3,1,0]=4 8 B9R1.69 Brc1ccc(c(c1)F)Cl PI-28679 [0,0,0,0,0,0|3,1,0]=4 9 B9R1.69 Brc1ccc(c(c1)F)F PI-10759 [0,0,0,0,0,0|3,1,0]=4 10 B9R1.69 Brc1ccc(c(c1)F)O PI-31106 [0,0,0,0,0,0|2,1,1]=4 11 B9R1.69 Brc1ccc(c(c1)N)F PI-21432 [0,0,0,0,0,0|3,1,0]=4 12 B9R1.69 Brc1ccc(c(c1)O)F PI-33069 [0,0,0,0,0,0|2,1,0]=3 13 B9R1.69 Brc1cnc(Br)c(C)c1 PI-16819 [0,0,0,0,0,0|2,1,1]=4 14 B9R1.69 Brc1cnc(c(c1)F)Br PI-36814 [0,0,0,0,0,0|2,1,1]=4 15 B9R1.69 Brc1cnc(c(c1)F)Cl PI-36963 [0,0,0,0,0,0|2,1,1]=4 16 B9R1.69 Brc1cnc(c(c1)F)N PI-36949 [0,0,0,0,0,0|2,1,1]=4 17 B9R1.69 C1=C(C(=CC=C1Br)O)C PI-22157 [0,0,0,0,0,0|2,1,1]=4 18 B9R1.69 C1=C(C(=CC=C1F)O)C PI-16986 [0,0,0,0,0,0|2,1,1]=4 19 B9R1.69 C1=C(C(=CN=C1Cl)Br)Cl PI-43244 [0,0,0,0,0,0|4,0,0]=4 20 B9R1.69 C1=C(C(=CN=C1Cl)F)I PI-34441 [0,0,0,0,0,0|4,0,0]=4 21 B9R1.69 C1=C(C(=CN=C1Cl)I)F PI-48142 [0,0,0,0,0,0|4,0,0]=4 22 B9R1.69 C1=C(C(=CN=C1Cl)I)N PI-50551 [0,0,0,0,0,0|4,0,0]=4 23 B9R1.69 C1=C(C(=CN=C1Cl)N)Cl PI-48149 [0,0,0,0,0,0|4,0,0]=4 24 B9R1.69 C1=C(C(=CN=C1Cl)O)N PI-43996 [0,0,0,0,0,0|3,0,1]=4 25 B9R1.69 C1=C(C(=CNC1=O)Cl)O PI-33382 [0,0,0,0,0,0|4,0,0]=4 26 B9R1.69 C1=C(C(=O)NC=C1Br)Cl PI-38894 [0,0,0,0,0,0|1,1,0]=2 27 B9R1.69 C1=C(C(=O)NC=C1Br)O PI-46997 [0,0,0,0,0,0|0,1,0]=1 28 B9R1.69 C1=C(C(=O)NC=C1Cl)I PI-47309 [0,0,0,0,0,0|1,0,0]=1 29 B9R1.69 C1=C(C=NC(=C1Br)Br)Br PI-28803 [0,0,0,0,0,0|2,1,1]=4 30 B9R1.69 C1=C(C=NC(=C1Br)Cl)Br PI-10513 [0,0,0,0,0,0|2,1,1]=4 31 B9R1.69 C1=C(C=NC(=C1Br)F)Br PI-28562 [0,0,0,0,0,0|2,1,1]=4 32 B9R1.69 C1=C(C=NC(=C1Br)F)Cl PI-40457 [0,0,0,0,0,0|2,0,1]=3 33 B9R1.69 C1=C(C=NC(=C1Br)N)Br PI-16741 [0,0,0,0,0,0|2,1,1]=4 34 B9R1.69 C1=C(C=NC(=C1Cl)Cl)Cl PI-16732 [0,0,0,0,0,0|2,0,1]=3 35 B9R1.69 C1=C(C=NC(=C1Cl)N)Br PI-34981 [0,0,0,0,0,0|2,1,1]=4 36 B9R1.69 C1=C(C=NC(=C1Cl)N)Cl PI-16165 [0,0,0,0,0,0|2,0,1]=3 37 B9R1.69 C1=C(C=NC(=C1F)F)Cl PI-25958 [0,0,0,0,0,0|2,0,1]=3 38 B9R1.69 C1=C(C=NC(=C1I)Cl)F PI-32876 [0,0,0,0,0,0|2,1,1]=4 39 B9R1.69 C1=C(C=NC(=C1N)Br)Br PI-47236 [0,0,0,0,0,0|2,1,1]=4 40 B9R1.69 C1=C(C=NC(=C1N)Cl)Br PI-44963 [0,0,0,0,0,0|2,1,1]=4 41 B9R1.69 C1=C(C=NC(=C1N)Cl)Cl PI-47237 [0,0,0,0,0,0|2,0,1]=3 42 B9R1.69 C1=C(C=NC(=C1N)N)Br PI-33906 [0,0,0,0,0,0|2,1,1]=4 43 B9R1.69 C1=C(N=C(C(=N1)Br)Cl)Cl PI-45640 [0,0,0,0,0,0|3,0,1]=4 44 B9R1.69 C1=C(N=C(C(=N1)Br)N)Cl PI-44559 [0,0,0,0,0,0|3,0,1]=4 45 B9R1.69 C1=CC(=C(C=C1Br)Cl)Cl PI-21594 [0,0,0,0,0,0|3,1,0]=4 46 B9R1.69 C1=CC(=C(C=C1Br)Cl)I PI-20639 [0,0,0,0,0,0|3,1,0]=4 47 B9R1.69 C1=CC(=C(C=C1Br)Cl)N PI-20600 [0,0,0,0,0,0|3,1,0]=4 48 B9R1.69 C1=CC(=C(C=C1Br)F)N PI-21433 [0,0,0,0,0,0|3,1,0]=4 49 B9R1.69 C1=CC(=C(C=C1Br)F)N PI-32450 [0,0,0,0,0,0|3,1,0]=4 50 B9R1.69 C1=CC(=C(C=C1Br)N)O PI-33346 [0,0,0,0,0,0|2,1,1]=4 51 B9R1.69 C1=CC(=C(C=C1Br)O)Cl PI-32432 [0,0,0,0,0,0|2,1,0]=3 52 B9R1.69 C1=CC(=C(C=C1Cl)Br)O PI-33867 [0,0,0,0,0,0|2,0,1]=3 53 B9R1.69 C1=CC(=C(C=C1Cl)Cl)Br PI-21592 [0,0,0,0,0,0|3,0,0]=3 54 B9R1.69 C1=CC(=C(C=C1Cl)Cl)F PI-16889 [0,0,0,0,0,0|3,0,0]=3 55 B9R1.69 C1=CC(=C(C=C1Cl)Cl)S PI-21086 [0,0,0,0,0,0|2,1,0]=3 56 B9R1.69 C1=CC(=C(C=C1Cl)F)Cl PI-16933 [0,0,0,0,0,0|3,0,0]=3 57 B9R1.69 C1=CC(=C(C=C1Cl)F)I PI-20092 [0,0,0,0,0,0|3,0,0]=3 58 B9R1.69 C1=CC(=C(C=C1Cl)F)N PI-31238 [0,0,0,0,0,0|3,0,0]=3 59 B9R1.69 C1=CC(=C(C=C1Cl)F)O PI-28420 [0,0,0,0,0,0|2,0,1]=3 60 B9R1.69 C1=CC(=C(C=C1Cl)I)Cl PI-21046 [0,0,0,0,0,0|3,0,0]=3 61 B9R1.69 C1=CC(=C(C=C1Cl)N)F PI-28267 [0,0,0,0,0,0|3,0,0]=3 62 B9R1.69 C1=CC(=C(C=C1Cl)N)N PI-16272 [0,0,0,0,0,0|3,0,0]=3 63 B9R1.69 C1=CC(=C(C=C1Cl)O)Br PI-34266 [0,0,0,0,0,0|2,0,0]=2 64 B9R1.69 C1=CC(=C(C=C1Cl)O)N PI-11790 [0,0,0,0,0,0|2,0,0]=2 65 B9R1.69 C1=CC(=C(C=C1Cl)S)Cl PI-21357 [0,0,0,0,0,0|2,1,0]=3 66 B9R1.69 C1=CC(=C(C=C1F)Br)Br PI-20967 [0,0,0,0,0,0|3,1,0]=4 67 B9R1.69 C1=CC(=C(C=C1F)Br)Cl PI-20627 [0,0,0,0,0,0|3,1,0]=4 68 B9R1.69 C1=CC(=C(C=C1F)Br)F PI-28496 [0,0,0,0,0,0|3,1,0]=4 69 B9R1.69 C1=CC(=C(C=C1F)Br)N PI-16538 [0,0,0,0,0,0|3,1,0]=4 70 B9R1.69 C1=CC(=C(C=C1F)Cl)Br PI-20629 [0,0,0,0,0,0|3,1,0]=4 71 B9R1.69 C1=CC(=C(C=C1F)Cl)Cl PI-16890 [0,0,0,0,0,0|3,1,0]=4 72 B9R1.69 C1=CC(=C(C=C1F)Cl)O PI-16901 [0,0,0,0,0,0|2,1,1]=4 73 B9R1.69 C1=CC(=C(C=C1F)F)Cl PI-16888 [0,0,0,0,0,0|3,1,0]=4 74 B9R1.69 C1=CC(=C(C=C1F)F)O PI-16940 [0,0,0,0,0,0|2,1,1]=4 75 B9R1.69 C1=CC(=C(C=C1F)I)Br PI-14444 [0,0,0,0,0,0|3,1,0]=4 76 B9R1.69 C1=CC(=C(C=C1F)I)N PI-10294 [0,0,0,0,0,0|3,1,0]=4 77 B9R1.69 C1=CC(=C(C=C1F)N)Cl PI-28546 [0,0,0,0,0,0|3,1,0]=4 78 B9R1.69 C1=CC(=C(C=C1F)N)I PI-10621 [0,0,0,0,0,0|3,1,0]=4 79 B9R1.69 C1=CC(=C(C=C1F)N)N PI-30535 [0,0,0,0,0,0|3,1,0]=4 80 B9R1.69 C1=CC(=C(C=C1F)O)N PI-28627 [0,0,0,0,0,0|2,1,0]=3 81 B9R1.69 C1=CC(=C(C=C1I)Cl)Cl PI-30279 [0,0,0,0,0,0|3,1,0]=4 82 B9R1.69 C1=CC(=C(C=C1I)Cl)F PI-17308 [0,0,0,0,0,0|3,1,0]=4 83 B9R1.69 C1=CC(=C(C=C1I)Cl)N PI-12088 [0,0,0,0,0,0|3,1,0]=4 84 B9R1.69 C1=CC(=C(C=C1I)F)F PI-28714 [0,0,0,0,0,0|3,1,0]=4 85 B9R1.69 C1=CC(=C(C=C1I)F)N PI-16385 [0,0,0,0,0,0|3,1,0]=4 86 B9R1.69 C1=CC(=C(C=C1I)F)O PI-43132 [0,0,0,0,0,0|2,1,1]=4 87 B9R1.69 C1=CC(=C(C=C1N)Cl)F PI-15213 [0,0,0,0,0,0|4,0,0]=4 88 B9R1.69 C1=CC(=C(C=C1N)Cl)N PI-30776 [0,0,0,0,0,0|4,0,0]=4 89 B9R1.69 C1=CC(=C(C=C1N)F)Cl PI-28447 [0,0,0,0,0,0|4,0,0]=4 90 B9R1.69 C1=CC(=C(C=C1N)I)N PI-34733 [0,0,0,0,0,0|4,0,0]=4 91 B9R1.69 C1=CC(=C(C=C1N)N)F PI-28702 [0,0,0,0,0,0|4,0,0]=4 92 B9R1.69 C1=CC(=C(C=C1N)N)N PI-30777 [0,0,0,0,0,0|4,0,0]=4 93 B9R1.69 C1=CC(=C(C=C1O)Cl)F PI-16912 [0,0,0,0,0,0|4,0,0]=4 94 B9R1.69 C1=CC(=C(C=C1O)F)Cl PI-10651 [0,0,0,0,0,0|4,0,0]=4 95 B9R1.69 C1=CC(=C(C=C1O)F)N PI-16958 [0,0,0,0,0,0|4,0,0]=4 96 B9R1.69 C1=CC(=C(C=C1S)Cl)Cl PI-21087 [0,0,0,0,0,0|4,0,0]=4 97 B9R1.69 C1=CC(=C(C=C1S)Cl)F PI-20118 [0,0,0,0,0,0|4,0,0]=4 98 B9R1.69 C1=CC(=C(C=C1S)F)F PI-28680 [0,0,0,0,0,0|4,0,0]=4 99 B9R1.69 C1=CC(=C(C=C1S)S)Cl PI-11011 [0,0,0,0,0,0|3,1,0]=4 100 B9R1.69 C1=CC(=NC(=C1N)Cl)Cl PI-30798 [0,0,0,0,0,0|4,0,0]=4 101 B9R1.69 C1=CC(=NC(=C1N)N)Cl PI-32634 [0,0,0,0,0,0|4,0,0]=4 102 B9R1.69 C1=CC(=O)C(=CC1=O)Cl PI-17305 [0,0,0,0,0,0|3,0,0]=3 103 B9R1.69 CC1=C(C=C(C=C1)Br)N PI-31358 [0,0,0,0,0,0|3,1,0]=4 104 B9R1.69 CC1=C(C=C(C=C1)Cl)Br PI-20668 [0,0,0,0,0,0|3,0,0]=3 105 B9R1.69 CC1=C(C=C(C=C1)Cl)F PI-16988 [0,0,0,0,0,0|3,0,0]=3 106 B9R1.69 CC1=C(C=C(C=C1)Cl)I PI-19456 [0,0,0,0,0,0|3,0,0]=3 107 B9R1.69 CC1=C(C=C(C=C1)Cl)O PI-28617 [0,0,0,0,0,0|2,0,0]=2 108 B9R1.69 CC1=C(C=C(C=C1)F)C PI-11592 [0,0,0,0,0,0|3,1,0]=4 109 B9R1.69 CC1=C(C=C(C=C1)F)Cl PI-28544 [0,0,0,0,0,0|3,1,0]=4 110 B9R1.69 CC1=C(C=C(C=C1)F)F PI-28545 [0,0,0,0,0,0|3,1,0]=4 111 B9R1.69 CC1=C(C=C(C=C1)F)I PI-10676 [0,0,0,0,0,0|3,1,0]=4 112 B9R1.69 CC1=C(C=C(C=C1)F)N PI-16382 [0,0,0,0,0,0|3,1,0]=4 113 B9R1.69 CC1=C(C=C(C=C1)I)F PI-10672 [0,0,0,0,0,0|3,1,0]=4 114 B9R1.69 CC1=C(C=C(C=C1)I)N PI-19927 [0,0,0,0,0,0|3,1,0]=4 115 B9R1.69 CC1=C(C=C(C=C1)N)Br PI-10966 [0,0,0,0,0,0|4,0,0]=4 116 B9R1.69 CC1=C(C=C(C=C1)N)Cl PI-34322 [0,0,0,0,0,0|4,0,0]=4 117 B9R1.69 CC1=C(C=C(C=C1)N)F PI-16383 [0,0,0,0,0,0|4,0,0]=4 118 B9R1.69 CC1=C(C=C(C=C1)N)I PI-19496 [0,0,0,0,0,0|4,0,0]=4 119 B9R1.69 CC1=C(C=C(C=C1)N)O PI-11314 [0,0,0,0,0,0|3,0,0]=3 120 B9R1.69 CC1=C(C=C(C=C1)O)N PI-11312 [0,0,0,0,0,0|4,0,0]=4 121 B9R1.69 CC1=C(C=C(C=C1)S)C PI-11009 [0,0,0,0,0,0|4,0,0]=4 122 B9R1.69 CC1=C(C=C(C=N1)Br)N PI-40246 [0,0,0,0,0,0|2,1,1]=4 123 B9R1.69 CC1=C(C=CC(=C1)Br)Cl PI-20675 [0,0,0,0,0,0|3,1,0]=4 124 B9R1.69 CC1=C(C=CC(=C1)Br)F PI-31216 [0,0,0,0,0,0|3,1,0]=4 125 B9R1.69 CC1=C(C=CC(=C1)Cl)F PI-28542 [0,0,0,0,0,0|3,0,0]=3 126 B9R1.69 CC1=C(C=CC(=C1)Cl)N PI-34323 [0,0,0,0,0,0|3,0,0]=3 127 B9R1.69 CC1=C(C=CC(=C1)Cl)O PI-11333 [0,0,0,0,0,0|2,0,1]=3 128 B9R1.69 CC1=C(C=CC(=C1)F)Br PI-16983 [0,0,0,0,0,0|3,1,0]=4 129 B9R1.69 CC1=C(C=CC(=C1)F)Cl PI-16931 [0,0,0,0,0,0|3,1,0]=4 130 B9R1.69 CC1=C(C=CC(=C1)F)F PI-28543 [0,0,0,0,0,0|3,1,0]=4 131 B9R1.69 CC1=C(C=CC(=C1)F)I PI-10678 [0,0,0,0,0,0|3,1,0]=4 132 B9R1.69 CC1=C(C=CC(=C1)F)N PI-16985 [0,0,0,0,0,0|3,1,0]=4 133 B9R1.69 CC1=C(C=CC(=C1)I)Cl PI-19072 [0,0,0,0,0,0|3,1,0]=4 134 B9R1.69 CC1=C(C=CC(=C1)I)F PI-10673 [0,0,0,0,0,0|3,1,0]=4 135 B9R1.69 CC1=C(C=CC(=C1)I)N PI-30113 [0,0,0,0,0,0|3,1,0]=4 136 B9R1.69 CC1=C(C=CC(=C1)N)Cl PI-24577 [0,0,0,0,0,0|4,0,0]=4 137 B9R1.69 CC1=C(C=CC(=C1)N)F PI-16984 [0,0,0,0,0,0|4,0,0]=4 138 B9R1.69 CC1=C(C=CC(=C1)N)O PI-10082 [0,0,0,0,0,0|3,0,1]=4 139 B9R1.69 CC1=C(C=CC(=C1)O)F PI-10655 [0,0,0,0,0,0|4,0,0]=4 140 B9R1.69 CC1=C(C=CC(=C1)O)N PI-11473 [0,0,0,0,0,0|4,0,0]=4 141 B9R1.69 CC1=C(C=CC(=C1)S)F PI-23789 [0,0,0,0,0,0|4,0,0]=4 142 B9R1.69 CC1=C(C=CC(=N1)Cl)F PI-34442 [0,0,0,0,0,0|4,0,0]=4 143 B9R1.69 CC1=CC(=C(C=C1)Br)Cl PI-20674 [0,0,0,0,0,0|4,0,0]=4 144 B9R1.69 CC1=CC(=C(C=C1)C)O PI-33176 [0,0,0,0,0,0|3,0,0]=3 145 B9R1.69 CC1=CC(=C(C=C1)C)S PI-21355 [0,0,0,0,0,0|3,1,0]=4 146 B9R1.69 CC1=CC(=C(C=C1)Cl)Br PI-20672 [0,0,0,0,0,0|4,0,0]=4 147 B9R1.69 CC1=CC(=C(C=C1)Cl)C PI-24680 [0,0,0,0,0,0|4,0,0]=4 148 B9R1.69 CC1=CC(=C(C=C1)Cl)F PI-10669 [0,0,0,0,0,0|4,0,0]=4 149 B9R1.69 CC1=CC(=C(C=C1)Cl)N PI-17325 [0,0,0,0,0,0|4,0,0]=4 150 B9R1.69 CC1=CC(=C(C=C1)Cl)O PI-42096 [0,0,0,0,0,0|3,0,0]=3 151 B9R1.69 CC1=CC(=C(C=C1)F)Cl PI-10668 [0,0,0,0,0,0|4,0,0]=4 152 B9R1.69 CC1=CC(=C(C=C1)F)F PI-16918 [0,0,0,0,0,0|4,0,0]=4 153 B9R1.69 CC1=CC(=C(C=C1)F)I PI-10677 [0,0,0,0,0,0|4,0,0]=4 154 B9R1.69 CC1=CC(=C(C=C1)F)N PI-16989 [0,0,0,0,0,0|4,0,0]=4 155 B9R1.69 CC1=CC(=C(C=C1)F)O PI-10653 [0,0,0,0,0,0|3,0,0]=3 156 B9R1.69 CC1=CC(=C(C=C1)I)Br PI-21532 [0,0,0,0,0,0|4,0,0]=4 157 B9R1.69 CC1=CC(=C(C=C1)I)Cl PI-19073 [0,0,0,0,0,0|4,0,0]=4 158 B9R1.69 CC1=CC(=C(C=C1)I)F PI-10675 [0,0,0,0,0,0|4,0,0]=4 159 B9R1.69 CC1=CC(=C(C=C1)I)I PI-19174 [0,0,0,0,0,0|4,0,0]=4 160 B9R1.69 CC1=CC(=C(C=C1)N)C PI-27338 [0,0,0,0,0,0|4,0,0]=4 161 B9R1.69 CC1=CC(=C(C=C1)N)Cl PI-20150 [0,0,0,0,0,0|4,0,0]=4 162 B9R1.69 CC1=CC(=C(C=C1)N)O PI-28344 [0,0,0,0,0,0|3,0,0]=3 163 B9R1.69 CC1=CC(=C(C=C1)N)S PI-41435 [0,0,0,0,0,0|3,1,0]=4 164 B9R1.69 CC1=CC(=C(C=C1)O)Cl PI-19823 [0,0,0,0,0,0|3,0,1]=4 165 B9R1.69 CC1=CC(=C(C=C1)O)N PI-44624 [0,0,0,0,0,0|3,0,1]=4 166 B9R1.69 CC1=CC(=C(C=C1)S)C PI-21999 [0,0,0,0,0,0|3,1,0]=4 167 B9R1.69 CC1=CC(=C(C=C1)[S-])[S-] PI-30102 [0,0,0,0,0,0|2,2,0]=4 168 B9R1.69 CC1=CC(=C(C=C1)[S-])[S-] PI-30441 [0,0,0,0,0,0|2,2,0]=4 169 B9R1.69 CC1=CC(=C(N=C1)C)C PI-16692 [0,0,0,0,0,0|3,0,1]=4 170 B9R1.69 CC1=CC(=C(N=C1)Cl)F PI-16765 [0,0,0,0,0,0|3,0,1]=4 171 B9R1.69 CC1=CC(=C(N=C1)Cl)N PI-30504 [0,0,0,0,0,0|3,0,1]=4 172 B9R1.69 CC1=CC(=C(N=C1)F)Br PI-34448 [0,0,0,0,0,0|3,0,1]=4 173 B9R1.69 CC1=CC(=C(N=C1)N)Br PI-24152 [0,0,0,0,0,0|3,0,1]=4 174 B9R1.69 CC1=CC(=CN=C1Br)N PI-27538 [0,0,0,0,0,0|3,0,1]=4 175 B9R1.69 CC1=CC(=CN=C1Cl)Br PI-24299 [0,0,0,0,0,0|2,1,1]=4 176 B9R1.69 CC1=CC(=CN=C1Cl)F PI-32877 [0,0,0,0,0,0|2,1,1]=4 177 B9R1.69 CC1=CC(=CN=C1Cl)N PI-34979 [0,0,0,0,0,0|3,0,1]=4 178 B9R1.69 CC1=CC(=CN=C1F)Br PI-32872 [0,0,0,0,0,0|2,1,1]=4 179 B9R1.69 CC1=CC(=CN=C1F)N PI-32878 [0,0,0,0,0,0|3,0,1]=4 180 B9R1.69 CC1=CC(=CN=C1N)Br PI-25459 [0,0,0,0,0,0|2,1,1]=4 181 B9R1.69 CC1=CC(=NC=C1N)Cl PI-30838 [0,0,0,0,0,0|4,0,0]=4 182 B9R1.69 CC1=CC(=NN=C1Cl)Cl PI-41115 [0,0,0,0,0,0|3,0,1]=4 183 B9R1.69 CC1=CC(=O)NNC1=O PI-44271 [0,0,0,0,0,0|3,0,0]=3 184 B9R1.69 Cc1ccc(Br)cc1F PI-31215 [0,0,0,0,0,0|3,1,0]=4 185 B9R1.69 Cc1ccc(I)c(N)c1 PI-13704 [0,0,0,0,0,0|4,0,0]=4 186 B9R1.69 Cc1ccc(N)c(Br)c1 PI-21582 [0,0,0,0,0,0|4,0,0]=4 187 B9R1.69 Cc1ccc(c(c1)Br)F PI-28541 [0,0,0,0,0,0|4,0,0]=4 188 B9R1.69 Cc1ccc(c(c1)C)Br PI-38906 [0,0,0,0,0,0|4,0,0]=4 189 B9R1.69 Cc1ccc(c(c1)F)Br PI-16987 [0,0,0,0,0,0|4,0,0]=4 190 B9R1.69 Cc1ccc(c(c1)F)N PI-16381 [0,0,0,0,0,0|4,0,0]=4 191 B9R1.69 Cc1ccc(c(c1)N)Br PI-32614 [0,0,0,0,0,0|4,0,0]=4 192 B9R1.69 Cc1ccc(c(c1)N)N PI-33398 [0,0,0,0,0,0|4,0,0]=4 193 B9R1.69 Cc1ccc(c(c1)O)O PI-11188 [0,0,0,0,0,0|2,0,1]=3 194 B9R1.69 Cc1cnc(Br)c(F)c1 PI-34446 [0,0,0,0,0,0|3,0,1]=4 195 B9R1.69 Cc1cnc(c(c1)I)F PI-32874 [0,0,0,0,0,0|3,0,1]=4 196 B9R1.69 ClC1=CC(=C(C=C1)F)O PI-10650 [0,0,0,0,0,0|2,0,0]=2 197 B9R1.69 ClC1=CC(I)=CC=C1Br PI-41927 [0,0,0,0,0,0|3,1,0]=4 198 B9R1.69 ClC1=NC=C(Br)C(N)=C1 PI-39470 [0,0,0,0,0,0|4,0,0]=4 199 B9R1.69 Clc1ccc(c(c1)Br)Cl PI-21593 [0,0,0,0,0,0|3,0,0]=3 200 B9R1.69 Clc1ccc(c(c1)Br)F PI-20628 [0,0,0,0,0,0|3,0,0]=3 201 B9R1.69 Clc1ccc(c(c1)Br)I PI-38902 [0,0,0,0,0,0|3,0,0]=3 202 B9R1.69 Clc1ccc(c(c1)Br)N PI-21370 [0,0,0,0,0,0|3,0,0]=3 203 B9R1.69 Clc1ccc(c(c1)C)Br PI-20669 [0,0,0,0,0,0|3,0,0]=3 204 B9R1.69 Clc1ccc(c(c1)C)C PI-11593 [0,0,0,0,0,0|3,0,0]=3 205 B9R1.69 Clc1ccc(c(c1)C)I PI-30351 [0,0,0,0,0,0|3,0,0]=3 206 B9R1.69 Clc1ccc(c(c1)F)Br PI-20626 [0,0,0,0,0,0|3,0,0]=3 207 B9R1.69 Clc1ccc(c(c1)F)F PI-12302 [0,0,0,0,0,0|3,0,0]=3 208 B9R1.69 Clc1ccc(c(c1)N)S PI-14245 [0,0,0,0,0,0|2,1,0]=3 209 B9R1.69 Clc1ccc(c(c1)O)O PI-11978 [0,0,0,0,0,0|1,0,1]=2 210 B9R1.69 Clc1ccc(c(n1)C)N PI-38623 [0,0,0,0,0,0|4,0,0]=4 211 B9R1.69 Clc1ccc(c(n1)Cl)F PI-36904 [0,0,0,0,0,0|4,0,0]=4 212 B9R1.69 Clc1ccc(c(n1)Cl)I PI-10338 [0,0,0,0,0,0|4,0,0]=4 213 B9R1.69 Clc1cnc(Br)c(C)c1 PI-35935 [0,0,0,0,0,0|2,0,1]=3 214 B9R1.69 Clc1cnc(Br)c(Cl)c1 PI-16039 [0,0,0,0,0,0|2,0,1]=3 215 B9R1.69 Clc1cnc(c(c1)F)N PI-36849 [0,0,0,0,0,0|2,0,1]=3 216 B9R1.69 Clc1cnc(c(c1)I)N PI-38332 [0,0,0,0,0,0|2,0,1]=3 217 B9R1.69 Clc1cnc(c(n1)Cl)N PI-38202 [0,0,0,0,0,0|3,0,1]=4 218 B9R1.69 Clc1ncc(c(c1)C)Br PI-38910 [0,0,0,0,0,0|4,0,0]=4 219 B9R1.69 Clc1nnc(Cl)c(Cl)c1 PI-35937 [0,0,0,0,0,0|3,0,1]=4 220 B9R1.69 Clc1nnc(N)c(Br)c1 PI-36364 [0,0,0,0,0,0|3,0,1]=4 221 B9R1.69 Fc1ccc(C)c(S)c1 PI-23790 [0,0,0,0,0,0|2,2,0]=4 222 B9R1.69 Fc1ccc(I)c(Br)c1 PI-14445 [0,0,0,0,0,0|3,1,0]=4 223 B9R1.69 Fc1ccc(N)c(F)c1 PI-15215 [0,0,0,0,0,0|3,1,0]=4 224 B9R1.69 Fc1ccc(S)c(C)c1 PI-23788 [0,0,0,0,0,0|2,2,0]=4 225 B9R1.69 Fc1ccc(c(c1)Br)C PI-16886 [0,0,0,0,0,0|3,1,0]=4 226 B9R1.69 Fc1ccc(c(c1)Br)O PI-21470 [0,0,0,0,0,0|2,1,1]=4 227 B9R1.69 Fc1ccc(c(c1)Cl)F PI-28303 [0,0,0,0,0,0|3,1,0]=4 228 B9R1.69 Fc1ccc(c(c1)Cl)S PI-20117 [0,0,0,0,0,0|2,2,0]=4 229 B9R1.69 Fc1ccc(c(c1)F)Br PI-32222 [0,0,0,0,0,0|3,1,0]=4 230 B9R1.69 Fc1ccc(c(c1)F)F PI-10729 [0,0,0,0,0,0|3,1,0]=4 231 B9R1.69 Fc1ccc(c(c1)F)S PI-16902 [0,0,0,0,0,0|2,2,0]=4 232 B9R1.69 Fc1ccc(c(c1)N)Br PI-10617 [0,0,0,0,0,0|3,1,0]=4 233 B9R1.69 Fc1ccc(c(c1)N)F PI-16941 [0,0,0,0,0,0|3,1,0]=4 234 B9R1.69 Fc1ccc(c(c1)N)O PI-15926 [0,0,0,0,0,0|2,1,1]=4 235 B9R1.69 Fc1ccc(c(c1)O)Br PI-31067 [0,0,0,0,0,0|2,1,0]=3 236 B9R1.69 Fc1ccc(c(c1)O)C PI-10656 [0,0,0,0,0,0|2,1,0]=3 237 B9R1.69 Fc1ccc(c(c1)O)Cl PI-10649 [0,0,0,0,0,0|2,1,0]=3 238 B9R1.69 Fc1ccc(c(c1)O)F PI-16913 [0,0,0,0,0,0|2,1,0]=3 239 B9R1.69 Fc1ccc(c(c1)O)O PI-16942 [0,0,0,0,0,0|1,1,1]=3 240 B9R1.69 Fc1cnc(N)c(Br)c1 PI-32880 [0,0,0,0,0,0|2,1,1]=4 241 B9R1.69 Fc1cnc(c(c1)C)Br PI-34447 [0,0,0,0,0,0|2,1,1]=4 242 B9R1.69 Fc1cnc(c(c1)F)F PI-33059 [0,0,0,0,0,0|2,1,1]=4 243 B9R1.69 IC1=CC(Br)=CN=C1N PI-46623 [0,0,0,0,0,0|2,1,1]=4 244 B9R1.69 IC1=CC(O)=C(Cl)C=C1 PI-46497 [0,0,0,0,0,0|2,1,0]=3 245 B9R1.69 IC1=CC=C(Br)C(Br)=C1 PI-41928 [0,0,0,0,0,0|3,1,0]=4 246 B9R1.69 IC1=CC=C(Br)C=C1F PI-21451 [0,0,0,0,0,0|3,1,0]=4 247 B9R1.69 IC1=CC=C(F)C=C1F PI-28291 [0,0,0,0,0,0|3,1,0]=4 248 B9R1.69 Ic1ccc(Br)c(C)c1 PI-21531 [0,0,0,0,0,0|3,1,0]=4 249 B9R1.69 Ic1ccc(F)c(Br)c1 PI-21453 [0,0,0,0,0,0|3,1,0]=4 250 B9R1.69 Ic1ccc(c(c1)F)Br PI-14443 [0,0,0,0,0,0|3,1,0]=4 251 B9R1.69 NC1=C(Cl)C=C(O)C=C1 PI-39809 [0,0,0,0,0,0|4,0,0]=4 252 B9R1.69 NC1=CC(Br)=CC=C1Cl PI-20602 [0,0,0,0,0,0|3,1,0]=4 253 B9R1.69 NC1=CC=C(Br)C=C1I PI-39519 [0,0,0,0,0,0|3,1,0]=4 254 B9R1.69 NC1=CC=C(Cl)C(N)=C1 PI-11322 [0,0,0,0,0,0|4,0,0]=4 255 B9R1.69 NC1=NC=C(N=C1Br)Cl PI-41714 [0,0,0,0,0,0|3,0,1]=4 256 B9R1.69 Nc1ccc(Br)c(C)c1 PI-21584 [0,0,0,0,0,0|4,0,0]=4 257 B9R1.69 Nc1ccc(C)c(O)c1 PI-11313 [0,0,0,0,0,0|3,0,0]=3 258 B9R1.69 Nc1ccc(O)c(Cl)c1 PI-11818 [0,0,0,0,0,0|3,0,1]=4 259 B9R1.69 Nc1ccc(O)c(F)c1 PI-28497 [0,0,0,0,0,0|3,0,1]=4 260 B9R1.69 Nc1ccc(c(c1)Br)F PI-12304 [0,0,0,0,0,0|4,0,0]=4 261 B9R1.69 Nc1ccc(c(c1)C)N PI-19993 [0,0,0,0,0,0|4,0,0]=4 262 B9R1.69 Nc1ccc(c(c1)Cl)Br PI-20601 [0,0,0,0,0,0|4,0,0]=4 263 B9R1.69 Nc1ccc(c(c1)Cl)I PI-30125 [0,0,0,0,0,0|4,0,0]=4 264 B9R1.69 Nc1ccc(c(c1)Cl)N PI-38011 [0,0,0,0,0,0|4,0,0]=4 265 B9R1.69 Nc1ccc(c(c1)Cl)N PI-38070 [0,0,0,0,0,0|4,0,0]=4 266 B9R1.69 Nc1ccc(c(c1)F)Br PI-10618 [0,0,0,0,0,0|4,0,0]=4 267 B9R1.69 Nc1ccc(c(c1)F)I PI-10620 [0,0,0,0,0,0|4,0,0]=4 268 B9R1.69 O=C1C=CC(N)=CN1C PI-46613 [0,0,0,0,0,0|4,0,0]=4 269 B9R1.69 OC1=CC(Cl)=CC=C1I PI-40949 [0,0,0,0,0,0|2,0,0]=2 270 B9R1.69 OC1=CC=C(Br)C=C1O PI-37116 [0,0,0,0,0,0|1,1,1]=3 271 B9R1.69 OC1=CC=C(C)C=C1Br PI-14476 [0,0,0,0,0,0|3,0,1]=4 272 B9R1.69 OC1=CC=C(N)C(Cl)=C1 PI-42395 [0,0,0,0,0,0|4,0,0]=4 273 B9R1.69 OC1=CC=C(N)C=C1N PI-32464 [0,0,0,0,0,0|3,0,1]=4 274 B9R1.69 Oc1cc(Cl)ccc1Cl PI-34659 [0,0,0,0,0,0|2,0,0]=2 275 B9R1.69 Oc1ccc(Br)c(F)c1 PI-10426 [0,0,0,0,0,0|4,0,0]=4 276 B9R1.69 Oc1ccc(Br)c(O)c1 PI-28737 [0,0,0,0,0,0|3,0,0]=3 277 B9R1.69 Oc1ccc(C)c(C)c1 PI-34164 [0,0,0,0,0,0|4,0,0]=4 278 B9R1.69 Oc1ccc(C)c(F)c1 PI-10654 [0,0,0,0,0,0|4,0,0]=4 279 B9R1.69 Oc1ccc(F)c(N)c1 PI-33926 [0,0,0,0,0,0|4,0,0]=4 280 B9R1.69 Oc1ccc(c(c1)Br)Cl PI-39217 [0,0,0,0,0,0|4,0,0]=4 281 B9R1.69 Oc1ccc(c(c1)Br)F PI-10647 [0,0,0,0,0,0|4,0,0]=4 282 B9R1.69 Oc1ccc(c(c1)C)Br PI-14477 [0,0,0,0,0,0|4,0,0]=4 283 B9R1.69 Oc1ccc(c(c1)F)F PI-16914 [0,0,0,0,0,0|4,0,0]=4 284 B9R1.69 Oc1ccc(c(c1)O)C PI-19649 [0,0,0,0,0,0|3,0,0]=3 285 B9R1.69 Oc1ccc(c(c1)O)F PI-10442 [0,0,0,0,0,0|3,0,0]=3 286 B9R1.69 Oc1ccc(c(c1)O)O PI-31220 [0,0,0,0,0,0|2,0,1]=3 287 B9R1.69 Oc1cnc(c(c1)Br)Cl PI-39120 [0,0,0,0,0,0|3,0,1]=4 288 B9R1.69 Sc1ccc(C)c(F)c1 PI-23787 [0,0,0,0,0,0|4,0,0]=4 289 B9R1.69 Sc1ccc(c(c1)C)O PI-18459 [0,0,0,0,0,0|3,0,1]=4 290 B8R1.3 Brc1ccc(C)cn1 PI-10149 [1,0,0,0,0,0|2,0,1]=4 291 B8R1.3 Brc1ccc(I)cc1 PI-21525 [1,0,0,0,0,0|2,1,0]=4 292 B8R1.3 Brc1ccc(cn1)F PI-23448 [1,0,0,0,0,0|1,1,1]=4 293 B8R1.3 Brc1ccc(cn1)N PI-31056 [1,0,0,0,0,0|2,0,1]=4 294 B8R1.3 C1=C(C=NC(=N1)Cl)Cl PI-32939 [1,0,0,0,0,0|2,0,1]=4 295 B8R1.3 C1=C(C=NC(=N1)N)Cl PI-30697 [1,0,0,0,0,0|2,0,1]=4 296 B8R1.3 C1=C(C=NC(=O)N1)Br PI-31176 [1,0,0,0,0,0|1,1,0]=3 297 B8R1.3 C1=C(C=NC(=O)N1)I PI-32628 [1,0,0,0,0,0|1,1,0]=3 298 B8R1.3 C1=C(I)C=CC(=N1)Br PI-38918 [1,0,0,0,0,0|1,1,1]=4 299 B8R1.3 C1=C(N=CC(=N1)Cl)Cl PI-43294 [1,0,0,0,0,0|2,0,1]=4 300 B8R1.3 C1=C(N=CC(=N1)Cl)N PI-44940 [1,0,0,0,0,0|2,0,1]=4 301 B8R1.3 C1=C(N=CC(=O)N1)Cl PI-45666 [1,0,0,0,0,0|1,0,0]=2 302 B8R1.3 C1=CC(=CC=C1Cl)Br PI-48678 [1,0,0,0,0,0|2,0,0]=3 303 B8R1.3 C1=CC(=CC=C1Cl)I PI-20137 [1,0,0,0,0,0|2,0,0]=3 304 B8R1.3 C1=CC(=CC=C1F)S PI-17595 [1,0,0,0,0,0|1,2,0]=4 305 B8R1.3 C1=CC(=CC=C1F)[S-] PI-28110 [1,0,0,0,0,0|1,2,0]=4 306 B8R1.3 C1=CC(=CC=C1N)S PI-14246 [1,0,0,0,0,0|2,1,0]=4 307 B8R1.3 C1=CC(=CC=C1S)Br PI-21352 [1,0,0,0,0,0|1,2,0]=4 308 B8R1.3 C1=CC(=NC=C1Br)F PI-23450 [1,0,0,0,0,0|1,1,1]=4 309 B8R1.3 C1=CC(=NC=C1Br)I PI-22827 [1,0,0,0,0,0|1,1,1]=4 310 B8R1.3 C1=CC(=NC=C1Cl)Br PI-10389 [1,0,0,0,0,0|1,0,1]=3 311 B8R1.3 C1=CC(=NC=C1Cl)F PI-16762 [1,0,0,0,0,0|1,0,1]=3 312 B8R1.3 C1=CC(=NC=C1Cl)I PI-34652 [1,0,0,0,0,0|1,0,1]=3 313 B8R1.3 C1=CC(=NC=C1F)Cl PI-10085 [1,0,0,0,0,0|1,1,1]=4 314 B8R1.3 C1=CC(=NC=C1F)N PI-23434 [1,0,0,0,0,0|1,1,1]=4 315 B8R1.3 C1=CC(=NC=C1I)Cl PI-20140 [1,0,0,0,0,0|1,1,1]=4 316 B8R1.3 C1=CC(=NC=C1I)F PI-16769 [1,0,0,0,0,0|1,1,1]=4 317 B8R1.3 C1=CC(=NC=C1N)N PI-33879 [1,0,0,0,0,0|2,0,1]=4 318 B8R1.3 C1=CC(=NC=C1O)Cl PI-10086 [1,0,0,0,0,0|2,0,1]=4 319 B8R1.3 C1=CC(=NC=C1O)I PI-34186 [1,0,0,0,0,0|2,0,1]=4 320 B8R1.3 C1=CC(=NC=C1O)N PI-34189 [1,0,0,0,0,0|2,0,1]=4 321 B8R1.3 C1=CC(=NN=C1Cl)I PI-40021 [1,0,0,0,0,0|2,0,1]=4 322 B8R1.3 C1=CC(=NN=C1N)Cl PI-30704 [1,0,0,0,0,0|2,0,1]=4 323 B8R1.3 C1=CC(=NNC1=O)Cl PI-48747 [1,0,0,0,0,0|1,0,0]=2 324 B8R1.3 CC1=CN=C(C=C1)F PI-34372 [1,0,0,0,0,0|2,0,1]=4 325 B8R1.3 CC1=CNC(=O)C=C1 PI-15774 [1,0,0,0,0,0|1,0,0]=2 326 B8R1.3 CC1=NC=C(C=C1)F PI-16773 [1,0,0,0,0,0|1,1,1]=4 327 B8R1.3 CC1=NC=C(C=C1)O PI-11928 [1,0,0,0,0,0|2,0,1]=4 328 B8R1.3 CC1=NNC(=O)C=C1 PI-44765 [1,0,0,0,0,0|2,0,0]=3 329 B8R1.3 Cc1ccc(Cl)cn1 PI-36942 [1,0,0,0,0,0|1,0,1]=3 330 B8R1.3 Cc1ccc(Cl)nn1 PI-30064 [1,0,0,0,0,0|2,0,1]=4 331 B8R1.3 Cc1ccc(F)cc1 PI-34120 [1,0,0,0,0,0|2,1,0]=4 332 B8R1.3 Cc1ccc(I)cc1 PI-13709 [1,0,0,0,0,0|2,1,0]=4 333 B8R1.3 Cc1ccc(cn1)Br PI-23479 [1,0,0,0,0,0|1,1,1]=4 334 B8R1.3 Cc1ccc(cn1)N PI-13104 [1,0,0,0,0,0|2,0,1]=4 335 B8R1.3 ClC1=NN=C(Cl)C=C1 PI-16281 [1,0,0,0,0,0|2,0,1]=4 336 B8R1.3 Clc1ccc(Br)cn1 PI-31223 [1,0,0,0,0,0|1,1,1]=4 337 B8R1.3 Clc1ccc(Cl)nc1 PI-10179 [1,0,0,0,0,0|1,0,1]=3 338 B8R1.3 Clc1ccc(cn1)C PI-16696 [1,0,0,0,0,0|2,0,1]=4 339 B8R1.3 Clc1ccc(cn1)N PI-10026 [1,0,0,0,0,0|2,0,1]=4 340 B8R1.3 Clc1cnc(O)nc1 PI-21321 [1,0,0,0,0,0|1,0,2]=4 341 B8R1.3 Clc1cnc(nc1)I PI-38331 [1,0,0,0,0,0|2,0,1]=4 342 B8R1.3 Clc1ncc(nc1)Br PI-39468 [1,0,0,0,0,0|2,0,1]=4 343 B8R1.3 FC1=CC=C(Br)C=C1 PI-33066 [1,0,0,0,0,0|2,1,0]=4 344 B8R1.3 FC1=NC=C(C=C1)O PI-40204 [1,0,0,0,0,0|2,0,1]=4 345 B8R1.3 Fc1ccc(I)cc1 PI-15769 [1,0,0,0,0,0|2,1,0]=4 346 B8R1.3 Fc1ccc(N)cn1 PI-10292 [1,0,0,0,0,0|2,0,1]=4 347 B8R1.3 Fc1ccc(cc1)F PI-11683 [1,0,0,0,0,0|2,1,0]=4 348 B8R1.3 Fc1ccc(cn1)F PI-35922 [1,0,0,0,0,0|1,1,1]=4 349 B8R1.3 Ic1ccc(cc1)I PI-10976 [1,0,0,0,0,0|2,1,0]=4 350 B8R1.3 Ic1ccc(cn1)I PI-32190 [1,0,0,0,0,0|1,1,1]=4 351 B8R1.3 NC1=CN=C(N)C=C1 PI-16689 [1,0,0,0,0,0|2,0,1]=4 352 B8R1.3 Nc1ccc(O)cc1 PI-34110 [1,0,0,0,0,0|2,0,1]=4 353 B8R1.3 Nc1ccc(cc1)F PI-33065 [1,0,0,0,0,0|2,1,0]=4 354 B8R1.3 Nc1ccc(cc1)I PI-25653 [1,0,0,0,0,0|2,1,0]=4 355 B8R1.3 Nc1ccc(cn1)Br PI-22846 [1,0,0,0,0,0|1,1,1]=4 356 B8R1.3 Nc1ccc(cn1)C PI-25208 [1,0,0,0,0,0|2,0,1]=4 357 B8R1.3 Nc1ccc(cn1)Cl PI-31015 [1,0,0,0,0,0|1,0,1]=3 358 B8R1.3 Nc1ccc(cn1)I PI-10252 [1,0,0,0,0,0|1,1,1]=4 359 B8R1.3 OC1=CN=C(Br)C=C1 PI-40203 [1,0,0,0,0,0|2,0,1]=4 360 B8R1.3 OC1=NC=C(N)C=C1 PI-37317 [1,0,0,0,0,0|1,0,2]=4 361 B8R1.3 Oc1ccc(Br)cc1 PI-22230 [1,0,0,0,0,0|1,1,1]=4 362 B8R1.3 Oc1ccc(I)cc1 PI-10956 [1,0,0,0,0,0|1,1,1]=4 363 B8R1.3 Oc1ccc(cc1)F PI-27532 [1,0,0,0,0,0|1,1,1]=4 364 B8R1.3 Oc1ccc(cc1)S PI-21361 [1,0,0,0,0,0|2,0,1]=4 365 B8R1.3 Oc1ccc(cn1)Br PI-16568 [1,0,0,0,0,0|0,1,2]=4 366 B8R1.3 Oc1ccc(cn1)C PI-37410 [1,0,0,0,0,0|1,0,2]=4 367 B8R1.3 Oc1ccc(cn1)Cl PI-15823 [1,0,0,0,0,0|0,0,2]=3 368 B8R1.3 Oc1ccc(cn1)F PI-34437 [1,0,0,0,0,0|0,1,2]=4 369 B8R1.3 Oc1ccc(cn1)N PI-28402 [1,0,0,0,0,0|1,0,2]=4 370 B8R1.4 Brc1cccc(I)c1 PI-21524 [1,0,0,0,0,0|2,1,0]=4 371 B8R1.4 Brc1cccc(c1)Br PI-11676 [1,0,0,0,0,0|2,1,0]=4 372 B8R1.4 Brc1ccnc(c1)Cl PI-31296 [1,0,0,0,0,0|3,0,0]=4 373 B8R1.4 Brc1cncc(Br)c1 PI-10080 [1,0,0,0,0,0|1,1,1]=4 374 B8R1.4 C1=C(C=NC=C1Br)Cl PI-34454 [1,0,0,0,0,0|1,0,1]=3 375 B8R1.4 C1=C(C=NC=C1Br)F PI-10088 [1,0,0,0,0,0|1,1,1]=4 376 B8R1.4 C1=C(C=NC=C1Br)N PI-10515 [1,0,0,0,0,0|1,1,1]=4 377 B8R1.4 C1=C(C=NC=C1Cl)Cl PI-32420 [1,0,0,0,0,0|1,0,1]=3 378 B8R1.4 C1=C(C=NC=C1Cl)F PI-34439 [1,0,0,0,0,0|1,0,1]=3 379 B8R1.4 C1=C(C=NC=C1Cl)O PI-40461 [1,0,0,0,0,0|0,0,1]=2 380 B8R1.4 C1=C(N=C(C=N1)Cl)N PI-30484 [1,0,0,0,0,0|2,0,1]=4 381 B8R1.4 C1=CC(=CC(=C1)Br)F PI-12279 [1,0,0,0,0,0|2,1,0]=4 382 B8R1.4 C1=CC(=CC(=C1)Br)S PI-15584 [1,0,0,0,0,0|1,2,0]=4 383 B8R1.4 C1=CC(=CC(=C1)F)O PI-16947 [1,0,0,0,0,0|1,1,0]=3 384 B8R1.4 C1=CC(=CC(=C1)I)F PI-12350 [1,0,0,0,0,0|2,1,0]=4 385 B8R1.4 C1=CC(=CC(=C1)I)N PI-41422 [1,0,0,0,0,0|2,1,0]=4 386 B8R1.4 C1=CC(=C[N+](=C1)[O-])Cl PI-42572 [1,0,0,0,0,0|2,0,1]=4 387 B8R1.4 C1=CC(=C[N+](=C1)[O-])O PI-13309 [1,0,0,0,0,0|3,0,0]=4 388 B8R1.4 C1=CC(=NC(=C1)Cl)F PI-34440 [1,0,0,0,0,0|3,0,0]=4 389 B8R1.4 C1=CC(=O)NC(=C1)O PI-11767 [1,0,0,0,0,0|3,0,0]=4 390 B8R1.4 C1=CN=C(C=C1I)Cl PI-11387 [1,0,0,0,0,0|3,0,0]=4 391 B8R1.4 C1=CNC(=CC1=O)Cl PI-11015 [1,0,0,0,0,0|2,0,1]=4 392 B8R1.4 C1=CNC(=O)C=C1O PI-10171 [1,0,0,0,0,0|3,0,0]=4 393 B8R1.4 CC1=CC(=CC=C1)I PI-10981 [1,0,0,0,0,0|2,1,0]=4 394 B8R1.4 CC1=CC(=CN=C1)Br PI-27499 [1,0,0,0,0,0|1,1,1]=4 395 B8R1.4 CC1=CC(=CN=C1)F PI-16772 [1,0,0,0,0,0|1,1,1]=4 396 B8R1.4 CC1=CC(=NC=C1)Cl PI-16626 [1,0,0,0,0,0|3,0,0]=4 397 B8R1.4 Cc1cccc(n1)Cl PI-28225 [1,0,0,0,0,0|3,0,0]=4 398 B8R1.4 Clc1cccc(c1)I PI-39251 [1,0,0,0,0,0|2,0,0]=3 399 B8R1.4 Clc1ccnc(Cl)c1 PI-16701 [1,0,0,0,0,0|3,0,0]=4 400 B8R1.4 Clc1ccnc(c1)N PI-11783 [1,0,0,0,0,0|3,0,0]=4 401 B8R1.4 Clc1cncc(Cl)n1 PI-16282 [1,0,0,0,0,0|2,0,1]=4 402 B8R1.4 FC1=CC(=CN=C1)O PI-40460 [1,0,0,0,0,0|0,1,1]=3 403 B8R1.4 Fc1cccc(Cl)c1 PI-33064 [1,0,0,0,0,0|2,0,0]=3 404 B8R1.4 Fc1cccc(c1)F PI-11677 [1,0,0,0,0,0|2,1,0]=4 405 B8R1.4 Fc1cccc(c1)S PI-16910 [1,0,0,0,0,0|1,2,0]=4 406 B8R1.4 Fc1ccnc(Cl)c1 PI-16761 [1,0,0,0,0,0|3,0,0]=4 407 B8R1.4 Fc1cncc(c1)F PI-33060 [1,0,0,0,0,0|1,1,1]=4 408 B8R1.4 NC1=CC(=CN=C1)F PI-40469 [1,0,0,0,0,0|1,1,1]=4 409 B8R1.4 Nc1cccc(F)c1 PI-16946 [1,0,0,0,0,0|2,1,0]=4 410 B8R1.4 Nc1cccc(S)c1 PI-21351 [1,0,0,0,0,0|2,1,0]=4 411 B8R1.4 Nc1cccc(n1)Cl PI-27605 [1,0,0,0,0,0|3,0,0]=4 412 B8R1.4 Nc1ccnc(c1)Cl PI-23438 [1,0,0,0,0,0|3,0,0]=4 413 B8R1.4 Nc1cnnc(c1)Cl PI-39012 [1,0,0,0,0,0|2,0,1]=4 414 B8R1.4 O=C1C=CC=C(Cl)N1 PI-35283 [1,0,0,0,0,0|2,0,1]=4 415 B8R1.4 OC1=NC=CC(C)=C1 PI-28120 [1,0,0,0,0,0|3,0,0]=4 416 B8R1.4 Oc1cccc(c1)I PI-10955 [1,0,0,0,0,0|1,1,0]=3 417 B8R1.4 Oc1cccc(c1)S PI-21360 [1,0,0,0,0,0|2,0,0]=3 418 B8R1.4 Oc1ccnc(c1)N PI-34188 [1,0,0,0,0,0|3,0,0]=4 419 B8R1.4 Oc1ccnc(n1)Cl PI-38931 [1,0,0,0,0,0|3,0,0]=4 420 B8R1.4 Oc1cncc(c1)Br PI-27886 [1,0,0,0,0,0|0,1,1]=3 421 B8R1.4 Sc1cccc(Cl)c1 PI-11010 [1,0,0,0,0,0|1,1,0]=3 422 B8R1.5 BrC1=NC=CC=C1N PI-28492 [1,0,0,0,0,0|2,0,1]=4 423 B8R1.5 Brc1ccccc1Br PI-38145 [1,0,0,0,0,0|3,0,0]=4 424 B8R1.5 Brc1cccnc1Cl PI-28602 [1,0,0,0,0,0|2,0,1]=4 425 B8R1.5 Brc1cccnc1N PI-30126 [1,0,0,0,0,0|2,0,1]=4 426 B8R1.5 C1=C(C(=O)NC=N1)Br PI-45070 [1,0,0,0,0,0|2,0,0]=3 427 B8R1.5 C1=C(C(=O)NC=N1)F PI-15254 [1,0,0,0,0,0|2,0,0]=3 428 B8R1.5 C1=C(C(=O)NC=N1)N PI-45141 [1,0,0,0,0,0|2,0,0]=3 429 B8R1.5 C1=CC(=C(N=C1)Br)Br PI-28122 [1,0,0,0,0,0|2,0,1]=4 430 B8R1.5 C1=CC(=C(N=C1)Br)Cl PI-27992 [1,0,0,0,0,0|2,0,1]=4 431 B8R1.5 C1=CC(=C(N=C1)Br)F PI-34450 [1,0,0,0,0,0|2,0,1]=4 432 B8R1.5 C1=CC(=C(N=C1)Cl)Cl PI-10112 [1,0,0,0,0,0|2,0,1]=4 433 B8R1.5 C1=CC(=C(N=C1)Cl)F PI-16375 [1,0,0,0,0,0|2,0,1]=4 434 B8R1.5 C1=CC(=C(N=C1)Cl)I PI-11389 [1,0,0,0,0,0|2,0,1]=4 435 B8R1.5 C1=CC(=C(N=C1)Cl)O PI-16697 [1,0,0,0,0,0|1,0,1]=3 436 B8R1.5 C1=CC(=C(N=C1)F)I PI-16040 [1,0,0,0,0,0|2,0,1]=4 437 B8R1.5 C1=CC(=C(N=C1)F)N PI-16374 [1,0,0,0,0,0|2,0,1]=4 438 B8R1.5 C1=CC(=C(N=C1)F)O PI-40205 [1,0,0,0,0,0|1,0,1]=3 439 B8R1.5 C1=CC(=C(N=C1)N)Cl PI-31793 [1,0,0,0,0,0|2,0,1]=4 440 B8R1.5 C1=CC(=O)N(C=C1)O PI-43160 [1,0,0,0,0,0|2,0,0]=3 441 B8R1.5 C1=CC(=S)N(C=C1)O PI-13313 [1,0,0,0,0,0|2,1,0]=4 442 B8R1.5 C1=CC(=S)N(C=C1)O PI-15830 [1,0,0,0,0,0|2,1,0]=4 443 B8R1.5 C1=CC=C(C(=C1)Cl)Br PI-41004 [1,0,0,0,0,0|3,0,0]=4 444 B8R1.5 C1=CC=C(C(=C1)Cl)Cl PI-21004 [1,0,0,0,0,0|3,0,0]=4 445 B8R1.5 C1=CC=C(C(=C1)F)I PI-23606 [1,0,0,0,0,0|3,0,0]=4 446 B8R1.5 C1=CC=C(C(=C1)F)S PI-16911 [1,0,0,0,0,0|2,1,0]=4 447 B8R1.5 C1=CC=C(C(=C1)N)I PI-10964 [1,0,0,0,0,0|3,0,0]=4 448 B8R1.5 C1=CC=C(C(=C1)N)N PI-17100 [1,0,0,0,0,0|3,0,0]=4 449 B8R1.5 C1=CC=C(C(=C1)O)F PI-11848 [1,0,0,0,0,0|2,0,0]=3 450 B8R1.5 C1=CNC(=O)C(=C1)Cl PI-35282 [1,0,0,0,0,0|1,0,0]=2 451 B8R1.5 C1=CNC(=O)C(=C1)F PI-34509 [1,0,0,0,0,0|1,0,0]=2 452 B8R1.5 C1=CNC(=O)C(=C1)N PI-10375 [1,0,0,0,0,0|1,0,0]=2 453 B8R1.5 C1=CNC(=S)C(=C1)N PI-36113 [1,0,0,0,0,0|1,1,0]=3 454 B8R1.5 C1=CNC=C(C1=O)N PI-28705 [1,0,0,0,0,0|3,0,0]=4 455 B8R1.5 CC1=C(C=CC=N1)Br PI-23460 [1,0,0,0,0,0|2,0,1]=4 456 B8R1.5 CC1=C(C=NC=C1)O PI-34258 [1,0,0,0,0,0|3,0,0]=4 457 B8R1.5 CC1=C(N=CC=C1)F PI-16763 [1,0,0,0,0,0|2,0,1]=4 458 B8R1.5 CC1=C(N=CC=C1)N PI-33812 [1,0,0,0,0,0|2,0,1]=4 459 B8R1.5 CC1=CC=CC=C1I PI-10980 [1,0,0,0,0,0|3,0,0]=4 460 B8R1.5 CC1=NC=CNC1=O PI-40998 [1,0,0,0,0,0|2,0,0]=3 461 B8R1.5 Cc1ccccc1F PI-34118 [1,0,0,0,0,0|3,0,0]=4 462 B8R1.5 Cc1cccnc1Br PI-28405 [1,0,0,0,0,0|2,0,1]=4 463 B8R1.5 Cc1cccnc1Cl PI-33878 [1,0,0,0,0,0|2,0,1]=4 464 B8R1.5 Cc1cnccc1O PI-38275 [1,0,0,0,0,0|3,0,0]=4 465 B8R1.5 FC1=NC=CC=C1Br PI-34449 [1,0,0,0,0,0|2,0,1]=4 466 B8R1.5 Fc1ccccc1Br PI-33063 [1,0,0,0,0,0|3,0,0]=4 467 B8R1.5 Fc1ccccc1F PI-11671 [1,0,0,0,0,0|3,0,0]=4 468 B8R1.5 Fc1ncccc1F PI-16764 [1,0,0,0,0,0|2,0,1]=4 469 B8R1.5 IC1=CC=CC=C1Br PI-21523 [1,0,0,0,0,0|3,0,0]=4 470 B8R1.5 IC1=CC=CC=C1I PI-21274 [1,0,0,0,0,0|3,0,0]=4 471 B8R1.5 Ic1cccnc1N PI-36512 [1,0,0,0,0,0|2,0,1]=4 472 B8R1.5 Nc1cccnc1C PI-13066 [1,0,0,0,0,0|2,0,1]=4 473 B8R1.5 Nc1cccnc1Cl PI-24529 [1,0,0,0,0,0|2,0,1]=4 474 B8R1.5 Nc1cccnc1N PI-10159 [1,0,0,0,0,0|2,0,1]=4 475 B8R1.5 O=c1[nH]cccc1C PI-16687 [1,0,0,0,0,0|1,0,0]=2 476 B8R1.5 O=c1ccccn1C PI-10985 [1,0,0,0,0,0|3,0,0]=4 477 B8R1.5 OC1=C(I)C=CC=C1 PI-10953 [1,0,0,0,0,0|2,0,0]=3 478 B8R1.5 OC1=NC=CC=C1Br PI-37057 [1,0,0,0,0,0|1,0,2]=4 479 B8R1.5 Oc1ccccc1Br PI-10952 [1,0,0,0,0,0|2,0,0]=3 480 B8R1.5 Oc1ccccc1O PI-31351 [1,0,0,0,0,0|1,0,1]=3 481 B8R1.5 Oc1ccccc1S PI-20878 [1,0,0,0,0,0|1,1,0]=3 482 B8R1.5 Oc1cccnc1Br PI-16727 [1,0,0,0,0,0|1,0,1]=3 483 B8R1.5 Oc1cccnc1C PI-13315 [1,0,0,0,0,0|1,0,1]=3 484 B8R1.5 Oc1cccnc1N PI-16260 [1,0,0,0,0,0|1,0,1]=3 485 B8R1.5 Oc1ccncc1Br PI-38971 [1,0,0,0,0,0|3,0,0]=4 486 B8R1.5 Oc1ncccc1O PI-11386 [1,0,0,0,0,0|0,0,2]=3 487 B10R1.22 C1=C(C=C(C(=C1Br)Cl)Br)Cl PI-45728 [0,1,0,0,0,0|3,0,0]=4 488 B10R1.22 C1=C(C=C(C(=C1Cl)Br)Cl)Cl PI-22627 [0,1,0,0,0,0|3,0,0]=4 489 B10R1.22 C1=C(C=C(C(=C1Cl)N)Br)Cl PI-14399 [0,1,0,0,0,0|3,0,0]=4 490 B10R1.22 C1=C(C=C(C(=C1F)Br)F)Cl PI-42944 [0,1,0,0,0,0|3,0,0]=4 491 B10R1.22 C1=C(C=C(C(=C1F)Cl)Br)Cl PI-14401 [0,1,0,0,0,0|3,0,0]=4 492 B10R1.22 C1=C(C=C(C(=C1F)N)Br)Cl PI-14391 [0,1,0,0,0,0|3,0,0]=4 493 B10R1.22 C1=C(C=C(C(=C1F)N)I)Cl PI-17576 [0,1,0,0,0,0|3,0,0]=4 494 B10R1.22 C1=C(C=C(C(=C1N)O)Cl)Cl PI-10562 [0,1,0,0,0,0|2,0,1]=4 495 B10R1.22 C1=C(C=C(C(=C1O)F)F)Br PI-14414 [0,1,0,0,0,0|2,1,0]=4 496 B10R1.22 CC1=C(Br)C(C)=CC(Cl)=C1 PI-46853 [0,1,0,0,0,0|3,0,0]=4 497 B10R1.22 CC1=CC(=C(C(=C1)O)C)C PI-11725 [0,1,0,0,0,0|3,0,0]=4 498 B10R1.22 CC1=CC(=C(C(=C1)O)O)O PI-19757 [0,1,0,0,0,0|2,0,1]=4 499 B10R1.22 CC1=CC(=CC(=C1N)C)Cl PI-30373 [0,1,0,0,0,0|3,0,0]=4 500 B10R1.22 CC1=CC(=CC(=C1N)C)Cl PI-30732 [0,1,0,0,0,0|3,0,0]=4 501 B10R1.22 CC1=CC(=CC(=C1N)Cl)Cl PI-30446 [0,1,0,0,0,0|3,0,0]=4 502 B10R1.22 CC1=CC(=CC(=C1O)C)Cl PI-30067 [0,1,0,0,0,0|2,0,1]=4 503 B10R1.22 CN1C=C(N=C(C1=O)Br)Br PI-38695 [0,1,0,0,0,0|2,1,0]=4 504 B10R1.22 Cc1cc(O)c(C)c(O)c1 PI-19644 [0,1,0,0,0,0|3,0,0]=4 505 B10R1.22 Clc1cc(C)c(c(c1)Cl)I PI-19228 [0,1,0,0,0,0|3,0,0]=4 506 B10R1.22 Clc1cc(F)c(I)c(Br)c1 PI-20632 [0,1,0,0,0,0|3,0,0]=4 507 B10R1.22 FC1=C(Br)C(Br)=CC(Cl)=C1 PI-20021 [0,1,0,0,0,0|3,0,0]=4 508 B10R1.22 NC1=CC(Cl)=CC(Cl)=C1N PI-46840 [0,1,0,0,0,0|3,0,0]=4 509 B10R1.22 O=C1C(Br)=CC(Br)=CN1C PI-46656 [0,1,0,0,0,0|1,1,0]=3 510 B10R1.22 O=C1C=C(C)C(=O)C(=C1)C PI-29659 [0,1,0,0,0,0|3,0,0]=4 511 B10R1.25 C1=CC(=C(C=C1Br)Cl)C=O PI-38898 [0,1,0,0,0,0|2,1,0]=4 512 B10R1.25 C1=CC(=C(C=C1Br)O)C#N PI-43950 [0,1,0,0,0,0|2,1,0]=4 513 B10R1.25 C1=CC(=C(C=C1Cl)Cl)C#N PI-16132 [0,1,0,0,0,0|3,0,0]=4 514 B10R1.25 C1=CC(=C(C=C1Cl)Cl)CCl PI-33404 [0,1,0,0,0,0|3,0,0]=4 515 B10R1.25 C1=CC(=C(C=C1Cl)Cl)NN PI-11745 [0,1,0,0,0,0|3,0,0]=4 516 B10R1.25 C1=CC(=C(C=C1Cl)Cl)NN PI-34158 [0,1,0,0,0,0|3,0,0]=4 517 B10R1.25 C1=CC(=C(C=C1Cl)F)C#N PI-10694 [0,1,0,0,0,0|3,0,0]=4 518 B10R1.25 C1=CC(=C(C=C1Cl)F)C=O PI-28681 [0,1,0,0,0,0|2,0,0]=3 519 B10R1.25 C1=CC(=C(C=C1Cl)F)CO PI-40484 [0,1,0,0,0,0|2,0,1]=4 520 B10R1.25 C1=CC(=C(C=C1Cl)F)NN PI-50547 [0,1,0,0,0,0|3,0,0]=4 521 B10R1.25 C1=CC(=C(C=C1F)Br)C=O PI-10440 [0,1,0,0,0,0|2,1,0]=4 522 B10R1.25 C1=CC(=C(C=C1F)Cl)C=O PI-28857 [0,1,0,0,0,0|2,1,0]=4 523 B10R1.25 C1=CC(=C(C=C1F)N)C=O PI-44252 [0,1,0,0,0,0|2,1,0]=4 524 B10R1.25 C1=CC(=C(C=C1F)O)C=O PI-18485 [0,1,0,0,0,0|1,1,0]=3 525 B10R1.25 C1=CC(=C(C=C1I)Br)C=O PI-26357 [0,1,0,0,0,0|2,1,0]=4 526 B10R1.25 C1=CC(=C(C=C1I)F)C=O PI-28942 [0,1,0,0,0,0|2,1,0]=4 527 B10R1.25 C1=CC(=C(C=C1N)N)C=O PI-44093 [0,1,0,0,0,0|3,0,0]=4 528 B10R1.25 C1=CC(=C(C=C1O)O)CO PI-11751 [0,1,0,0,0,0|2,0,1]=4 529 B10R1.25 CC1=C(C=CC(=C1)Cl)NN PI-29295 [0,1,0,0,0,0|3,0,0]=4 530 B10R1.25 CC1=C(C=CC(=C1)Cl)OC PI-19447 [0,1,0,0,0,0|2,0,1]=4 531 B10R1.25 CC1=C(C=CC(=C1)F)C=O PI-10459 [0,1,0,0,0,0|2,1,0]=4 532 B10R1.25 CC1=CC(=C(C=C1)C=O)Br PI-26931 [0,1,0,0,0,0|3,0,0]=4 533 B10R1.25 CC1=CC(=C(C=C1)C=O)F PI-31460 [0,1,0,0,0,0|3,0,0]=4 534 B10R1.25 CC1=CC(=CN=C1C=O)Br PI-41887 [0,1,0,0,0,0|1,1,1]=4 535 B10R1.25 CCC1=C(C=C(C=C1)O)O PI-27436 [0,1,0,0,0,0|3,0,0]=4 536 B10R1.25 COC1=C(C=C(C=C1)Cl)F PI-33133 [0,1,0,0,0,0|2,0,1]=4 537 B10R1.25 COC1=C(C=C(C=C1)F)O PI-34264 [0,1,0,0,0,0|1,1,1]=4 538 B10R1.25 COC1=C(O)C=C(N)C=C1 PI-27246 [0,1,0,0,0,0|2,0,1]=4 539 B10R1.25 COc1ccc(cc1Br)Cl PI-20603 [0,1,0,0,0,0|2,0,1]=4 540 B10R1.25 ClC1=CC(=C(C=O)C=C1)O PI-26343 [0,1,0,0,0,0|1,0,0]=2 541 B10R1.25 ClC1=NC(=CC=C1C=O)Cl PI-41418 [0,1,0,0,0,0|3,0,0]=4 542 B10R1.25 FC1=C(C=O)C=CC(=C1)O PI-28419 [0,1,0,0,0,0|3,0,0]=4 543 B10R1.25 N#Cc1ccc(Cl)cc1N PI-11782 [0,1,0,0,0,0|3,0,0]=4 544 B10R1.25 N#Cc1ccc(O)cc1O PI-11750 [0,1,0,0,0,0|3,0,0]=4 545 B10R1.25 N#Cc1ncc(cc1Cl)Cl PI-16033 [0,1,0,0,0,0|2,0,1]=4 546 B10R1.25 NC1=C(C=O)C=CC(=C1)Br PI-41093 [0,1,0,0,0,0|2,1,0]=4 547 B10R1.25 O=CC1=CC=C(F)C=C1F PI-16892 [0,1,0,0,0,0|2,1,0]=4 548 B10R1.25 O=Cc1ccc(Br)cc1F PI-31236 [0,1,0,0,0,0|2,1,0]=4 549 B10R1.25 O=Cc1ccc(C)cc1O PI-20805 [0,1,0,0,0,0|2,0,0]=3 550 B10R1.25 O=Cc1ccc(O)cc1Cl PI-10303 [0,1,0,0,0,0|3,0,0]=4 551 B10R1.25 O=Cc1ccc(O)cc1O PI-11749 [0,1,0,0,0,0|2,0,0]=3 552 B10R1.25 O=Cc1ccc(cc1Br)Cl PI-36966 [0,1,0,0,0,0|2,0,0]=3 553 B10R1.25 O=Cc1ccc(cc1C)C PI-27218 [0,1,0,0,0,0|3,0,0]=4 554 B10R1.25 O=Cc1ccc(cc1C)Cl PI-27562 [0,1,0,0,0,0|2,0,0]=3 555 B10R1.25 O=Cc1ccc(cc1O)Br PI-26320 [0,1,0,0,0,0|1,1,0]=3 556 B10R1.25 OC1=CC(=C(C=O)C=C1)C PI-18542 [0,1,0,0,0,0|3,0,0]=4 557 B10R1.25 OCc1ccc(Cl)cc1Cl PI-12129 [0,1,0,0,0,0|2,0,1]=4 558 B10R1.30 BrC1=C(C=C(C=C1)Cl)OC PI-41885 [0,1,0,0,0,0|2,0,0]=3 559 B10R1.30 BrCc1cc(Cl)ccc1Cl PI-38192 [0,1,0,0,0,0|3,0,0]=4 560 B10R1.30 BrCc1cc(Cl)ccc1F PI-20079 [0,1,0,0,0,0|3,0,0]=4 561 B10R1.30 C1=C(Br)C=CC(=C1CO)O PI-12023 [0,1,0,0,0,0|1,1,1]=4 562 B10R1.30 C1=C(C=NC(=C1CO)N)Br PI-34708 [0,1,0,0,0,0|1,1,1]=4 563 B10R1.30 C1=C(Cl)C=CC(=C1C#N)F PI-28659 [0,1,0,0,0,0|3,0,0]=4 564 B10R1.30 C1=C(Cl)C=CC(=C1C#N)N PI-11788 [0,1,0,0,0,0|3,0,0]=4 565 B10R1.30 C1=CC(=C(C=C1Br)CO)F PI-14437 [0,1,0,0,0,0|2,1,0]=4 566 B10R1.30 C1=CC(=C(C=C1Br)CO)N PI-46965 [0,1,0,0,0,0|2,1,0]=4 567 B10R1.30 C1=CC(=C(C=C1Cl)C#N)Cl PI-11756 [0,1,0,0,0,0|3,0,0]=4 568 B10R1.30 C1=CC(=C(C=C1Cl)C#N)O PI-44911 [0,1,0,0,0,0|2,0,1]=4 569 B10R1.30 C1=CC(=C(C=C1Cl)C=O)Cl PI-16092 [0,1,0,0,0,0|2,0,1]=4 570 B10R1.30 C1=CC(=C(C=C1Cl)C=O)F PI-10455 [0,1,0,0,0,0|2,0,1]=4 571 B10R1.30 C1=CC(=C(C=C1Cl)C=O)O PI-12029 [0,1,0,0,0,0|1,0,2]=4 572 B10R1.30 C1=CC(=C(C=C1Cl)CCl)Cl PI-27419 [0,1,0,0,0,0|3,0,0]=4 573 B10R1.30 C1=CC(=C(C=C1Cl)CO)Cl PI-30501 [0,1,0,0,0,0|2,0,0]=3 574 B10R1.30 C1=CC(=C(C=C1Cl)CO)O PI-12028 [0,1,0,0,0,0|1,0,1]=3 575 B10R1.30 C1=CC(=C(C=C1Cl)NN)Cl PI-29450 [0,1,0,0,0,0|3,0,0]=4 576 B10R1.30 C1=CC(=C(C=C1Cl)NN)Cl PI-29640 [0,1,0,0,0,0|3,0,0]=4 577 B10R1.30 C1=CC(=C(C=C1F)CO)Br PI-42946 [0,1,0,0,0,0|2,1,0]=4 578 B10R1.30 C1=CC(=C(C=C1F)CO)F PI-33073 [0,1,0,0,0,0|2,1,0]=4 579 B10R1.30 C1=CC(=C(C=C1I)CO)Br PI-41207 [0,1,0,0,0,0|2,1,0]=4 580 B10R1.30 CC1=C(C=C(C=C1)Cl)OC PI-10564 [0,1,0,0,0,0|2,0,0]=3 581 B10R1.30 COC1=C(C=CC(=C1)Br)N PI-44941 [0,1,0,0,0,0|2,1,0]=4 582 B10R1.30 COC1=C(C=CC(=C1)Cl)Cl PI-21000 [0,1,0,0,0,0|2,0,0]=3 583 B10R1.30 COC1=C(C=CC(=C1)Cl)N PI-11332 [0,1,0,0,0,0|2,0,0]=3 584 B10R1.30 COC1=C(C=CC(=C1)F)Br PI-21434 [0,1,0,0,0,0|2,1,0]=4 585 B10R1.30 COC1=C(C=CC(=C1)F)F PI-12727 [0,1,0,0,0,0|2,1,0]=4 586 B10R1.30 COC1=C(C=CC(=C1)N)Br PI-33359 [0,1,0,0,0,0|3,0,0]=4 587 B10R1.30 COC1=C(C=CC(=C1)N)Cl PI-34236 [0,1,0,0,0,0|3,0,0]=4 588 B10R1.30 COC1=C(C=CC(=C1)N)F PI-10622 [0,1,0,0,0,0|3,0,0]=4 589 B10R1.30 COC1=C(N=CC(=C1)Br)N PI-34882 [0,1,0,0,0,0|1,1,1]=4 590 B10R1.30 COC1=C(O)C=CC(F)=C1 PI-27601 [0,1,0,0,0,0|1,1,1]=4 591 B10R1.30 COC1=CC(=CN=C1F)Br PI-43260 [0,1,0,0,0,0|1,1,1]=4 592 B10R1.30 COC1=CC(Br)=CN=C1Cl PI-41978 [0,1,0,0,0,0|1,1,1]=4 593 B10R1.30 COc1cc(Br)ccc1Cl PI-14389 [0,1,0,0,0,0|2,1,0]=4 594 B10R1.30 COc1cc(Br)ccc1F PI-34341 [0,1,0,0,0,0|2,1,0]=4 595 B10R1.30 FC1=CC(=C(N)C=C1)OC PI-39749 [0,1,0,0,0,0|2,1,0]=4 596 B10R1.30 N#Cc1cc(Cl)ccc1Br PI-38901 [0,1,0,0,0,0|3,0,0]=4 597 B10R1.30 NCc1cc(Cl)ccc1F PI-20075 [0,1,0,0,0,0|3,0,0]=4 598 B10R1.30 O=Cc1cc(Cl)ccc1Br PI-33350 [0,1,0,0,0,0|2,0,1]=4 599 B10R1.30 O=Cc1cc(Cl)ccc1N PI-18302 [0,1,0,0,0,0|2,0,1]=4 600 B10R1.30 O=Cc1cc(Cl)cnc1Cl PI-39057 [0,1,0,0,0,0|1,0,2]=4 601 B10R1.30 OCc1cc(Cl)ccc1Br PI-35234 [0,1,0,0,0,0|2,0,0]=3 602 B10R1.118 Brc1cc(F)c(F)cc1O PI-28194 [0,1,0,0,0,0|2,1,0]=4 603 B10R1.118 C1=C(C(=CC(=C1Cl)Cl)Cl)S PI-17209 [0,1,0,0,0,0|2,1,0]=4 604 B10R1.118 C1=C(C(=CC(=C1Cl)Cl)N)N PI-20947 [0,1,0,0,0,0|3,0,0]=4 605 B10R1.118 C1=C(C(=CC(=C1Cl)N)Cl)N PI-31454 [0,1,0,0,0,0|3,0,0]=4 606 B10R1.118 C1=C(C(=CC(=C1F)Br)F)O PI-21644 [0,1,0,0,0,0|2,1,0]=4 607 B10R1.118 C1=C(C(=CC(=C1F)Cl)Cl)N PI-28421 [0,1,0,0,0,0|3,0,0]=4 608 B10R1.118 C1=C(C(=CC(=C1F)Cl)N)N PI-20018 [0,1,0,0,0,0|3,0,0]=4 609 B10R1.118 C1=C(C(=CC(=C1F)F)F)O PI-34333 [0,1,0,0,0,0|2,1,0]=4 610 B10R1.118 C1=C(C(=CC(=C1F)O)F)N PI-14079 [0,1,0,0,0,0|2,1,0]=4 611 B10R1.118 C1=C(C(=CC(=C1N)O)O)N PI-10078 [0,1,0,0,0,0|3,0,0]=4 612 B10R1.118 C1=C(C(=CC(=C1N)O)O)N PI-19166 [0,1,0,0,0,0|3,0,0]=4 613 B10R1.118 C1=C(C(=CC(=C1O)Cl)Cl)N PI-13030 [0,1,0,0,0,0|2,0,1]=4 614 B10R1.118 C1=C(C(=NC(=C1Cl)Cl)Cl)Cl PI-16739 [0,1,0,0,0,0|2,0,1]=4 615 B10R1.118 CC1=CC(=C(C=C1Cl)C)S PI-17574 [0,1,0,0,0,0|2,1,0]=4 616 B10R1.118 CC1=CC(=C(C=C1Cl)Cl)Cl PI-19822 [0,1,0,0,0,0|3,0,0]=4 617 B10R1.118 CC1=CC(=C(C=C1Cl)N)N PI-19789 [0,1,0,0,0,0|3,0,0]=4 618 B10R1.118 CC1=CC(=C(C=C1F)Cl)Br PI-20637 [0,1,0,0,0,0|3,0,0]=4 619 B10R1.118 CC1=CC(=C(C=C1I)C)O PI-21957 [0,1,0,0,0,0|3,0,0]=4 620 B10R1.118 CC1=CC(=C(C=C1O)C)N PI-27462 [0,1,0,0,0,0|3,0,0]=4 621 B10R1.118 CC1=CC(=O)C(=CC1=O)Cl PI-19280 [0,1,0,0,0,0|2,0,1]=4 622 B10R1.118 ClC1=CC(=O)C(=CC1=O)Cl PI-31951 [0,1,0,0,0,0|2,0,1]=4 623 B10R1.118 Clc1cc(Cl)c(cc1O)Cl PI-34305 [0,1,0,0,0,0|2,0,0]=3 624 B10R1.118 Clc1cc(F)c(cc1O)Br PI-31708 [0,1,0,0,0,0|2,1,0]=4 625 B10R1.118 Fc1cc(Br)c(Cl)cc1Cl PI-32540 [0,1,0,0,0,0|3,0,0]=4 626 B10R1.118 Fc1cc(Br)c(cc1C)Cl PI-20636 [0,1,0,0,0,0|3,0,0]=4 627 B10R1.118 Fc1cc(Cl)c(cc1C)N PI-28095 [0,1,0,0,0,0|3,0,0]=4 628 B10R1.118 Oc1cc(Br)c(O)cc1Br PI-36804 [0,1,0,0,0,0|2,1,0]=4 629 B10R1.118 Oc1cc(Cl)c(cc1Cl)O PI-33342 [0,1,0,0,0,0|2,0,0]=3 630 B10R1.119 C1=CC(=C(C(=C1F)Cl)F)Cl PI-10477 [0,1,0,0,0,0|3,0,0]=4 631 B10R1.119 C1=CC(=C(C(=C1F)F)F)Cl PI-11588 [0,1,0,0,0,0|3,0,0]=4 632 B10R1.119 C1=CC(=C(C(=C1F)O)F)F PI-16880 [0,1,0,0,0,0|2,1,0]=4 633 B10R1.119 C1=CC(=C(C(=C1O)Cl)N)Cl PI-11741 [0,1,0,0,0,0|2,0,1]=4 634 B10R1.119 CC1=C(C(=C(C=C1)Cl)Br)Cl PI-21604 [0,1,0,0,0,0|3,0,0]=4 635 B10R1.119 CC1=C(C(=C(C=C1)Cl)C)N PI-30403 [0,1,0,0,0,0|3,0,0]=4 636 B10R1.119 CC1=C(C(=C(C=C1)Cl)N)Cl PI-13570 [0,1,0,0,0,0|3,0,0]=4 637 B10R1.119 CC1=C(C(=C(C=C1)N)Cl)O PI-16013 [0,1,0,0,0,0|3,0,0]=4 638 B10R1.119 CC1=C(C(=O)NNC1=O)C PI-44272 [0,1,0,0,0,0|3,0,0]=4 639 B10R1.119 CC1=C(C=CC(=C1Cl)Cl)Cl PI-34318 [0,1,0,0,0,0|3,0,0]=4 640 B10R1.119 CC1=CC=C(Cl)C(Cl)=C1Cl PI-24595 [0,1,0,0,0,0|3,0,0]=4 641 B10R1.119 Cn1ccc(=O)c(c1C)O PI-11673 [0,1,0,0,0,0|3,0,0]=4 642 B10R1.176 C1=CC(=C(C=C1C#N)O)F PI-35270 [0,1,0,0,0,0|3,0,0]=4 643 B10R1.176 C1=CC(=C(C=C1C=O)O)I PI-27146 [0,1,0,0,0,0|3,0,0]=4 644 B10R1.176 C1=CC(=C(C=C1CCl)F)F PI-21150 [0,1,0,0,0,0|3,0,0]=4 645 B10R1.176 C1=CC(=C(C=C1CO)O)I PI-45003 [0,1,0,0,0,0|3,0,0]=4 646 B10R1.176 C1=CC(=C(C=C1CO)O)O PI-19526 [0,1,0,0,0,0|2,0,1]=4 647 B10R1.176 CC1=C(C=C(C=C1)CCl)C PI-23827 [0,1,0,0,0,0|3,0,0]=4 648 B10R1.176 CCc1ccc(c(c1)O)O PI-19057 [0,1,0,0,0,0|2,0,1]=4 649 B10R1.176 COC1=CC(=C(C=C1)N)O PI-34837 [0,1,0,0,0,0|3,0,0]=4 650 B10R1.176 NCc1ccc(c(c1)O)O PI-30190 [0,1,0,0,0,0|2,0,1]=4 651 B10R1.176 O=Cc1ccc(O)c(O)c1 PI-10046 [0,1,0,0,0,0|2,0,1]=4 652 B10R1.176 O=Cc1ccc(c(c1)O)C PI-27720 [0,1,0,0,0,0|3,0,0]=4 653 B8R1.18 CC1=C(SC(=C1)Cl)Cl PI-14314 [0,0,0,0,1,0|3,0,0]=4 654 B8R1.50 CC1=C(C(=O)CC1)O PI-11535 [0,0,0,0,1,0|2,0,1]=4 655 B8R1.50 CC1=C(C(=O)CO1)O PI-14302 [0,0,0,0,1,0|3,0,0]=4 656 B8R1.50 O=C1N(O)C(C=C1)=O PI-37265 [0,0,0,0,1,0|3,0,0]=4 657 B7R1.3 Brc1cccnc1 PI-11914 [2,0,0,0,0,0|0,1,1]=4 658 B7R1.3 C1=C(C=NC=N1)Cl PI-21317 [2,0,0,0,0,0|1,0,1]=4 659 B7R1.3 C1=CC(=CN=C1)I PI-11390 [2,0,0,0,0,0|0,1,1]=4 660 B7R1.3 C1=CC(=CN=C1)O PI-44714 [2,0,0,0,0,0|0,0,1]=3 661 B7R1.3 C1=CC(=CN=C1)[O-] PI-42109 [2,0,0,0,0,0|0,0,2]=4 662 B7R1.3 C1=CC(=O)NC=C1 PI-13304 [2,0,0,0,0,0|0,0,0]=2 663 B7R1.3 C1=CC(=O)NC=C1 PI-49120 [2,0,0,0,0,0|0,0,0]=2 664 B7R1.3 C1=CC(=O)OC=C1 PI-46989 [2,0,0,0,0,0|1,0,0]=3 665 B7R1.3 C1=CC(=S)NC=C1 PI-11854 [2,0,0,0,0,0|0,1,0]=3 666 B7R1.3 C1=CC=C(C=C1)[Si] PI-45035 [2,0,0,0,0,0|2,0,0]=4 667 B7R1.3 C1=CC=NC(=C1)I PI-32173 [2,0,0,0,0,0|1,0,1]=4 668 B7R1.3 C1=CN=C(C=N1)Cl PI-11831 [2,0,0,0,0,0|1,0,1]=4 669 B7R1.3 C1=CN=CC(=S)N1 PI-45037 [2,0,0,0,0,0|1,1,0]=4 670 B7R1.3 C1=CN=CC=C1Cl PI-16703 [2,0,0,0,0,0|2,0,0]=4 671 B7R1.3 C1=CN=CNC1=O PI-21341 [2,0,0,0,0,0|1,0,0]=3 672 B7R1.3 C1=CN=CNC1=O PI-45002 [2,0,0,0,0,0|1,0,0]=3 673 B7R1.3 C1=CNC(=O)N=C1 PI-32626 [2,0,0,0,0,0|1,0,0]=3 674 B7R1.3 C1=CNC(=O)N=C1 PI-33107 [2,0,0,0,0,0|1,0,0]=3 675 B7R1.3 C1=CNC(=S)N=C1 PI-15316 [2,0,0,0,0,0|1,1,0]=4 676 B7R1.3 C1=COC=CC1=O PI-43972 [2,0,0,0,0,0|2,0,0]=4 677 B7R1.3 CC1=CC=CC=N1 PI-38534 [2,0,0,0,0,0|1,0,1]=4 678 B7R1.3 ClC1=NN=CC=C1 PI-37010 [2,0,0,0,0,0|1,0,1]=4 679 B7R1.3 Clc1cccnc1 PI-11921 [2,0,0,0,0,0|0,0,1]=3 680 B7R1.3 Fc1ccccn1 PI-11583 [2,0,0,0,0,0|1,0,1]=4 681 B7R1.3 Fc1cccnc1 PI-16759 [2,0,0,0,0,0|0,1,1]=4 682 B7R1.3 Ic1ccccc1 PI-37973 [2,0,0,0,0,0|1,1,0]=4 683 B7R1.3 O=C1C=CC=NN1 PI-40006 [2,0,0,0,0,0|1,0,0]=3 684 B7R1.3 O=C1C=CNC=C1 PI-33984 [2,0,0,0,0,0|2,0,0]=4 685 B7R1.3 Oc1cncnc1 PI-36495 [2,0,0,0,0,0|1,0,1]=4 686 B7R1.3 [S-]c1ccccc1 PI-17985 [2,0,0,0,0,0|1,1,0]=4 687 B9R1.1 BrCc1ccc(Cl)cc1 PI-15674 [1,1,0,0,0,0|2,0,0]=4 688 B9R1.1 C1=CC(=CC=C1C=O)Cl PI-34386 [1,1,0,0,0,0|1,0,0]=3 689 B9R1.1 C1=CC(=CC=C1C=O)F PI-33068 [1,1,0,0,0,0|1,1,0]=4 690 B9R1.1 C1=CC(=CC=C1CCl)Br PI-20545 [1,1,0,0,0,0|2,0,0]=4 691 B9R1.1 C1=CC(=CC=C1CN)Cl PI-11469 [1,1,0,0,0,0|2,0,0]=4 692 B9R1.1 C1=CC(=CC=C1NN)Cl PI-16438 [1,1,0,0,0,0|2,0,0]=4 693 B9R1.1 C1=CC(=CC=C1NN)Cl PI-50281 [1,1,0,0,0,0|2,0,0]=4 694 B9R1.1 C1=CC(=NC=C1C=O)Cl PI-41221 [1,1,0,0,0,0|2,0,0]=4 695 B9R1.1 C1=CC(=NC=C1Cl)C#N PI-10169 [1,1,0,0,0,0|1,0,1]=4 696 B9R1.1 C1=CC(=NC=C1O)C=O PI-40986 [1,1,0,0,0,0|1,0,1]=4 697 B9R1.1 C=Cc1ccc(cc1)Cl PI-38314 [1,1,0,0,0,0|2,0,0]=4 698 B9R1.1 CCC1=CC=C(C=C1)Cl PI-19776 [1,1,0,0,0,0|2,0,0]=4 699 B9R1.1 CNC1=CC=C(C=C1)Cl PI-34211 [1,1,0,0,0,0|2,0,0]=4 700 B9R1.1 COc1ccc(Cl)cc1 PI-34198 [1,1,0,0,0,0|1,0,1]=4 701 B9R1.1 ClCc1ccc(Cl)nc1 PI-10395 [1,1,0,0,0,0|1,0,1]=4 702 B9R1.1 ClCc1ccc(F)cc1 PI-31364 [1,1,0,0,0,0|2,0,0]=4 703 B9R1.1 N#Cc1ccc(Cl)cc1 PI-11470 [1,1,0,0,0,0|2,0,0]=4 704 B9R1.1 O=CC1=NC=C(F)C=C1 PI-37201 [1,1,0,0,0,0|0,1,1]=4 705 B9R1.1 O=Cc1ccc(Br)cc1 PI-12729 [1,1,0,0,0,0|1,1,0]=4 706 B9R1.1 O=Cc1ccc(cc1)I PI-27209 [1,1,0,0,0,0|1,1,0]=4 707 B9R1.1 O=Cc1ccc(cc1)O PI-37802 [1,1,0,0,0,0|2,0,0]=4 708 B9R1.1 OCc1ccc(cc1)Cl PI-11977 [1,1,0,0,0,0|1,0,1]=4 709 B9R1.2 BrCc1cccc(c1)Cl PI-23167 [1,1,0,0,0,0|2,0,0]=4 710 B9R1.2 C#CC1=CC(=CC=C1)Cl PI-30914 [1,1,0,0,0,0|2,0,0]=4 711 B9R1.2 C1=C(C=NC=C1Br)CO PI-47170 [1,1,0,0,0,0|0,1,1]=4 712 B9R1.2 C1=C(C=NC=C1Cl)CO PI-34717 [1,1,0,0,0,0|0,0,1]=3 713 B9R1.2 C1=CC(=CC(=C1)Br)CCl PI-35258 [1,1,0,0,0,0|2,0,0]=4 714 B9R1.2 C1=CC(=CC(=C1)Br)CO PI-10954 [1,1,0,0,0,0|1,1,0]=4 715 B9R1.2 C1=CC(=CC(=C1)Cl)CCl PI-34222 [1,1,0,0,0,0|2,0,0]=4 716 B9R1.2 C1=CC(=CC(=C1)Cl)NN PI-29369 [1,1,0,0,0,0|2,0,0]=4 717 B9R1.2 C1=CC(=CC(=C1)F)CCl PI-34129 [1,1,0,0,0,0|2,0,0]=4 718 B9R1.2 C1=CC(=CC(=C1)F)CO PI-16873 [1,1,0,0,0,0|1,1,0]=4 719 B9R1.2 C1=CC(=CC(=C1)O)C#N PI-35245 [1,1,0,0,0,0|2,0,0]=4 720 B9R1.2 C1=CC(=CC(=C1)O)CBr PI-43991 [1,1,0,0,0,0|1,1,0]=4 721 B9R1.2 C1=CC(=CC(=C1)O)CO PI-11929 [1,1,0,0,0,0|2,0,0]=4 722 B9R1.2 C1=CC(=NC(=C1)Cl)CO PI-35291 [1,1,0,0,0,0|2,0,0]=4 723 B9R1.2 C1=CC(=NC(=C1)Cl)CO PI-35292 [1,1,0,0,0,0|2,0,0]=4 724 B9R1.2 C1=CN=C(C=C1Cl)CO PI-34715 [1,1,0,0,0,0|2,0,0]=4 725 B9R1.2 COC1=CC(=CC=C1)Br PI-12683 [1,1,0,0,0,0|1,1,0]=4 726 B9R1.2 COC1=CC(=CC=C1)S PI-13025 [1,1,0,0,0,0|2,0,0]=4 727 B9R1.2 COC1=CC(=NC=C1)Cl PI-27253 [1,1,0,0,0,0|2,0,0]=4 728 B9R1.2 COC1=CC(Cl)=CC=C1 PI-31362 [1,1,0,0,0,0|1,0,0]=3 729 B9R1.2 COC1=CC(F)=CC=C1 PI-12220 [1,1,0,0,0,0|1,1,0]=4 730 B9R1.2 COc1cc(Br)cnc1 PI-38259 [1,1,0,0,0,0|0,1,1]=4 731 B9R1.2 COc1cc(Cl)ccn1 PI-26867 [1,1,0,0,0,0|2,0,0]=4 732 B9R1.2 COc1cc(N)cnc1 PI-33855 [1,1,0,0,0,0|1,0,1]=4 733 B9R1.2 COc1cccc(c1)O PI-34658 [1,1,0,0,0,0|2,0,0]=4 734 B9R1.2 CSC1=CC(=CC=C1)Cl PI-20243 [1,1,0,0,0,0|1,1,0]=4 735 B9R1.2 Clc1cccc(c1)C#N PI-31301 [1,1,0,0,0,0|2,0,0]=4 736 B9R1.2 NCc1cccc(Cl)c1 PI-15673 [1,1,0,0,0,0|2,0,0]=4 737 B9R1.2 O=Cc1cccc(c1)Cl PI-27742 [1,1,0,0,0,0|1,0,1]=4 738 B9R1.2 O=Cc1cccc(c1)O PI-34273 [1,1,0,0,0,0|2,0,0]=4 739 B9R1.2 OCC1=CC(N)=CN=C1 PI-35898 [1,1,0,0,0,0|1,0,1]=4 740 B9R1.2 OCc1cccc(c1)C PI-38620 [1,1,0,0,0,0|2,0,0]=4 741 B9R1.2 OCc1cccc(c1)Cl PI-11919 [1,1,0,0,0,0|1,0,0]=3 742 B9R1.3 Brc1c(Cl)cccc1Br PI-36772 [1,1,0,0,0,0|2,0,0]=4 743 B9R1.3 Brc1c(O)cccc1F PI-27596 [1,1,0,0,0,0|1,1,0]=4 744 B9R1.3 C1=C(C(=C(C=C1)F)O)O PI-19501 [1,1,0,0,0,0|1,1,0]=4 745 B9R1.3 C1=C(C(=C(C=N1)Cl)Br)Cl PI-28407 [1,1,0,0,0,0|1,0,1]=4 746 B9R1.3 C1=C(C(=C(C=N1)Cl)N)Cl PI-16166 [1,1,0,0,0,0|1,0,1]=4 747 B9R1.3 C1=C(C(=O)C(=CN1)Cl)Cl PI-28203 [1,1,0,0,0,0|1,0,0]=3 748 B9R1.3 C1=CC(=C(C(=C1)Br)Cl)O PI-34265 [1,1,0,0,0,0|1,1,0]=4 749 B9R1.3 C1=CC(=C(C(=C1)Br)I)O PI-44588 [1,1,0,0,0,0|1,1,0]=4 750 B9R1.3 C1=CC(=C(C(=C1)Cl)Br)Cl PI-33015 [1,1,0,0,0,0|2,0,0]=4 751 B9R1.3 C1=CC(=C(C(=C1)Cl)Cl)F PI-21033 [1,1,0,0,0,0|2,0,0]=4 752 B9R1.3 C1=CC(=C(C(=C1)Cl)Cl)S PI-21353 [1,1,0,0,0,0|1,1,0]=4 753 B9R1.3 C1=CC(=C(C(=C1)Cl)F)F PI-28648 [1,1,0,0,0,0|2,0,0]=4 754 B9R1.3 C1=CC(=C(C(=C1)Cl)N)F PI-16936 [1,1,0,0,0,0|2,0,0]=4 755 B9R1.3 C1=CC(=C(C(=C1)Cl)N)S PI-41796 [1,1,0,0,0,0|1,1,0]=4 756 B9R1.3 C1=CC(=C(C(=C1)Cl)O)F PI-16877 [1,1,0,0,0,0|2,0,0]=4 757 B9R1.3 C1=CC(=C(C(=C1)Cl)S)Cl PI-17253 [1,1,0,0,0,0|2,0,0]=4 758 B9R1.3 C1=CC(=C(C(=C1)I)Cl)Cl PI-31839 [1,1,0,0,0,0|2,0,0]=4 759 B9R1.3 C1=CC(=C(C(=C1)O)Cl)N PI-34749 [1,1,0,0,0,0|2,0,0]=4 760 B9R1.3 C1=CC(=C(C(=C1)O)F)N PI-49267 [1,1,0,0,0,0|2,0,0]=4 761 B9R1.3 C1=CC=C(O)C(=C1O)Cl PI-10240 [1,1,0,0,0,0|2,0,0]=4 762 B9R1.3 CC1=C(C(=CC=C1)Cl)Br PI-19844 [1,1,0,0,0,0|2,0,0]=4 763 B9R1.3 CC1=C(C(=CC=C1)Cl)F PI-28868 [1,1,0,0,0,0|2,0,0]=4 764 B9R1.3 CC1=C(C(=CC=C1)Cl)I PI-19664 [1,1,0,0,0,0|2,0,0]=4 765 B9R1.3 CC1=C(C(=CC=C1)O)Cl PI-42107 [1,1,0,0,0,0|2,0,0]=4 766 B9R1.3 CC1=C(C=CC=C1Br)Cl PI-20670 [1,1,0,0,0,0|2,0,0]=4 767 B9R1.3 CC1=C(C=CC=C1F)O PI-33695 [1,1,0,0,0,0|1,1,0]=4 768 B9R1.3 CC1=C(Cl)C(Cl)=CC=C1 PI-27484 [1,1,0,0,0,0|2,0,0]=4 769 B9R1.3 Cc1c(F)cccc1Cl PI-33407 [1,1,0,0,0,0|2,0,0]=4 770 B9R1.3 Cc1c(O)cccc1O PI-13269 [1,1,0,0,0,0|2,0,0]=4 771 B9R1.3 ClC1=CC=CC(Br)=C1I PI-41926 [1,1,0,0,0,0|2,0,0]=4 772 B9R1.3 Clc1c(O)cccc1Cl PI-37792 [1,1,0,0,0,0|1,0,0]=3 773 B9R1.3 Clc1cncc(Cl)c1Cl PI-33527 [1,1,0,0,0,0|1,0,1]=4 774 B9R1.3 Clc1cncc(c1F)Cl PI-28912 [1,1,0,0,0,0|1,0,1]=4 775 B9R1.3 Fc1c(C)cccc1O PI-38225 [1,1,0,0,0,0|2,0,0]=4 776 B9R1.3 Fc1c(Cl)cccc1Br PI-11590 [1,1,0,0,0,0|2,0,0]=4 777 B9R1.3 Fc1c(Cl)cccc1I PI-20091 [1,1,0,0,0,0|2,0,0]=4 778 B9R1.3 Fc1c(O)cccc1F PI-10291 [1,1,0,0,0,0|1,1,0]=4 779 B9R1.3 Nc1c(C)cccc1Cl PI-12044 [1,1,0,0,0,0|2,0,0]=4 780 B9R1.3 Nc1c(C)cccc1O PI-11311 [1,1,0,0,0,0|2,0,0]=4 781 B9R1.3 Nc1c(Cl)cccc1I PI-36760 [1,1,0,0,0,0|2,0,0]=4 782 B9R1.3 Nc1c(O)cccc1Br PI-36538 [1,1,0,0,0,0|1,1,0]=4 783 B9R1.3 OC1=C(F)C(Br)=CC=C1 PI-40482 [1,1,0,0,0,0|1,1,0]=4 784 B9R1.3 Oc1c(C)cccc1Cl PI-20168 [1,1,0,0,0,0|2,0,0]=4 785 B9R1.3 Oc1cccc(c1N)O PI-32329 [1,1,0,0,0,0|2,0,0]=4 786 B9R1.34 C1=C(C=C(C=C1Br)Br)O PI-34092 [1,1,0,0,0,0|1,1,0]=4 787 B9R1.34 C1=C(C=C(C=C1Cl)Br)F PI-11589 [1,1,0,0,0,0|2,0,0]=4 788 B9R1.34 C1=C(C=C(C=C1Cl)Br)O PI-34267 [1,1,0,0,0,0|1,0,0]=3 789 B9R1.34 C1=C(C=C(C=C1Cl)Cl)F PI-21034 [1,1,0,0,0,0|2,0,0]=4 790 B9R1.34 C1=C(C=C(C=C1Cl)Cl)S PI-17419 [1,1,0,0,0,0|1,1,0]=4 791 B9R1.34 C1=C(C=C(C=C1I)I)O PI-35825 [1,1,0,0,0,0|1,1,0]=4 792 B9R1.34 C1=C(C=[N+](C=C1Cl)[O-])Cl PI-42562 [1,1,0,0,0,0|1,0,1]=4 793 B9R1.34 CC1=CC(=CC(=C1)Cl)C PI-19721 [1,1,0,0,0,0|2,0,0]=4 794 B9R1.34 CC1=CC(=CC(=C1)Cl)F PI-19987 [1,1,0,0,0,0|2,0,0]=4 795 B9R1.34 CC1=CC(=CC(=C1)O)O PI-10527 [1,1,0,0,0,0|2,0,0]=4 796 B9R1.34 Cc1cc(N)cc(c1)Cl PI-39722 [1,1,0,0,0,0|2,0,0]=4 797 B9R1.34 Cc1cc(O)cc(c1)Br PI-33356 [1,1,0,0,0,0|1,1,0]=4 798 B9R1.34 Clc1cc(Br)cc(c1)Br PI-35806 [1,1,0,0,0,0|2,0,0]=4 799 B9R1.34 Clc1cc(Br)cc(c1)I PI-36792 [1,1,0,0,0,0|2,0,0]=4 800 B9R1.34 Clc1cc(Cl)cc(Br)c1 PI-11894 [1,1,0,0,0,0|2,0,0]=4 801 B9R1.34 Clc1cc(Cl)cc(I)c1 PI-30450 [1,1,0,0,0,0|2,0,0]=4 802 B9R1.34 Fc1cc(F)cc(Cl)c1 PI-28147 [1,1,0,0,0,0|2,0,0]=4 803 B9R1.34 NC1=CC(Cl)=CC(N)=C1 PI-30495 [1,1,0,0,0,0|2,0,0]=4 804 B9R1.34 Oc1cc(Cl)cc(c1)Cl PI-37316 [1,1,0,0,0,0|1,0,0]=3 805 B9R1.34 Oc1cc(F)cc(Br)c1 PI-34268 [1,1,0,0,0,0|1,1,0]=4 806 B9R1.34 Oc1cc(F)cc(c1)Cl PI-38861 [1,1,0,0,0,0|1,0,0]=3 807 B9R1.34 Oc1cc(F)cc(c1)F PI-16915 [1,1,0,0,0,0|1,1,0]=4 808 B9R1.34 Oc1cc(O)cc(c1)O PI-16481 [1,1,0,0,0,0|2,0,0]=4 809 B9R1.34 Oc1cc(O)cc(c1)O PI-39326 [1,1,0,0,0,0|2,0,0]=4 810 B9R1.15 C1=CC(=C(N=C1)C#N)O PI-31932 [1,1,0,0,0,0|1,0,1]=4 811 B9R1.15 C1=CC(=C(N=C1)C=O)O PI-20863 [1,1,0,0,0,0|0,0,1]=3 812 B9R1.15 C1=CC(=C(N=C1)CO)O PI-16743 [1,1,0,0,0,0|0,0,2]=4 813 B9R1.15 C1=CC(=C(N=C1)Cl)CO PI-33153 [1,1,0,0,0,0|1,0,1]=4 814 B9R1.15 C1=CC=C(C(=C1)C=O)Br PI-11807 [1,1,0,0,0,0|2,0,0]=4 815 B9R1.15 C1=CC=C(C(=C1)CO)Br PI-30250 [1,1,0,0,0,0|2,0,0]=4 816 B9R1.15 C1=CC=C(C(=C1)CO)Cl PI-23166 [1,1,0,0,0,0|2,0,0]=4 817 B9R1.15 C1=CC=C(C(=C1)CO)N PI-11798 [1,1,0,0,0,0|2,0,0]=4 818 B9R1.15 C1=CN=CC(=C1C=O)O PI-34863 [1,1,0,0,0,0|2,0,0]=4 819 B9R1.15 C1=CNC(=O)C(=C1)C#N PI-35286 [1,1,0,0,0,0|1,0,0]=3 820 B9R1.15 CC1=CC=CC=C1C=O PI-27677 [1,1,0,0,0,0|2,0,0]=4 821 B9R1.15 COC1=C(N=CC=C1)I PI-26982 [1,1,0,0,0,0|1,0,1]=4 822 B9R1.15 COC1=CC=CC=C1Br PI-34200 [1,1,0,0,0,0|2,0,0]=4 823 B9R1.15 COC1=CC=CC=C1Cl PI-34199 [1,1,0,0,0,0|2,0,0]=4 824 B9R1.15 COC1=CC=CC=C1F PI-12348 [1,1,0,0,0,0|2,0,0]=4 825 B9R1.15 COC1=CC=CC=C1I PI-50209 [1,1,0,0,0,0|2,0,0]=4 826 B9R1.15 COc1ccc[nH]c1=O PI-26288 [1,1,0,0,0,0|0,0,0]=2 827 B9R1.15 COc1ccccc1S PI-21364 [1,1,0,0,0,0|1,1,0]=4 828 B9R1.15 COc1cccnc1Br PI-26342 [1,1,0,0,0,0|1,0,1]=4 829 B9R1.15 COc1cccnc1Cl PI-27671 [1,1,0,0,0,0|1,0,1]=4 830 B9R1.15 CSC1=CC=CC=C1O PI-20874 [1,1,0,0,0,0|1,1,0]=4 831 B9R1.15 N#Cc1ccccc1O PI-11836 [1,1,0,0,0,0|2,0,0]=4 832 B9R1.15 NC1=NC=CC=C1OC PI-39996 [1,1,0,0,0,0|1,0,1]=4 833 B9R1.15 O=CC1=CC=CC=C1I PI-27403 [1,1,0,0,0,0|2,0,0]=4 834 B9R1.15 O=Cc1ccccc1Cl PI-34387 [1,1,0,0,0,0|2,0,0]=4 835 B9R1.15 O=Cc1ccccc1F PI-27600 [1,1,0,0,0,0|2,0,0]=4 836 B9R1.15 OCc1ccccc1F PI-28537 [1,1,0,0,0,0|2,0,0]=4 837 B9R1.15 OCc1ccccc1O PI-36548 [1,1,0,0,0,0|1,0,1]=4 838 B9R1.15 OCc1cccnc1N PI-33953 [1,1,0,0,0,0|1,0,1]=4 839 B9R1.22 O=Cc1[nH]c(cc1C)C PI-21987 [0,1,0,0,1,0|2,0,0]=4 840 B9R1.37 C1(=C(C(=O)NC1=O)Br)Br PI-42901 [0,1,0,0,1,0|2,0,0]=4 841 B9R1.37 C1(=C(C(=O)NC1=O)Cl)Cl PI-42638 [0,1,0,0,1,0|2,0,0]=4 842 B11R1.32 CN1C=C(C(=O)N(C1=O)C)O PI-16344 [0,2,0,0,0,0|2,0,0]=4 843 B11R1.464 C1=C(C=C(C(=C1Cl)C=O)Cl)Cl PI-43254 [0,2,0,0,0,0|2,0,0]=4 844 B11R1.464 O=CC1=C(O)C=C(O)C=C1O PI-27625 [0,2,0,0,0,0|2,0,0]=4 845 B11R1.464 O=Cc1c(O)cc(Cl)cc1Cl PI-27912 [0,2,0,0,0,0|1,0,0]=3 846 B11R1.464 O=Cc1c(O)cc(cc1F)F PI-38190 [0,2,0,0,0,0|1,1,0]=4 847 B11R1.37 COc1cc(F)ccc1C=O PI-38318 [0,2,0,0,0,0|1,1,0]=4 848 B11R1.37 COc1cc(O)ccc1C=O PI-11990 [0,2,0,0,0,0|2,0,0]=4 849 B11R1.81 C1=CC(=C(C=C1Cl)Cl)N=C=O PI-11419 [0,2,0,0,0,0|2,0,0]=4 850 B11R1.166 C1=CC(=C(C=C1Br)O)C(=O)O PI-21374 [0,2,0,0,0,0|1,1,0]=4 851 B11R1.166 C1=CC(=C(C=C1Cl)Cl)C(=O)N PI-30371 [0,2,0,0,0,0|2,0,0]=4 852 B11R1.166 C1=CC(=C(C=C1Cl)F)C(=O)Cl PI-11845 [0,2,0,0,0,0|2,0,0]=4 853 B11R1.166 C1=CC(=C(C=C1Cl)N)C(=O)N PI-35500 [0,2,0,0,0,0|2,0,0]=4 854 B11R1.166 C1=CC(=C(C=C1Cl)N)[N+](=O)[O-] PI-11297 [0,2,0,0,0,0|2,0,0]=4 855 B11R1.166 C1=CC(=C(C=C1Cl)O)C(=O)O PI-33938 [0,2,0,0,0,0|1,0,0]=3 856 B11R1.166 C1=CC(=C(C=C1Cl)O)[N+](=O)[O-] PI-37794 [0,2,0,0,0,0|1,0,0]=3 857 B11R1.166 C1=CC(=C(C=C1F)O)[N+](=O)[O-] PI-16979 [0,2,0,0,0,0|1,1,0]=4 858 B11R1.166 CC(=O)C1=C(C=C(C=C1)Br)O PI-43291 [0,2,0,0,0,0|1,1,0]=4 859 B11R1.166 CC(=O)C1=C(C=C(C=C1)Cl)Br PI-20599 [0,2,0,0,0,0|2,0,0]=4 860 B11R1.166 CC(=O)C1=C(C=C(C=C1)Cl)Cl PI-33128 [0,2,0,0,0,0|2,0,0]=4 861 B11R1.166 CC(=O)C1=C(C=C(C=C1)Cl)O PI-30853 [0,2,0,0,0,0|1,0,0]=3 862 B11R1.166 CC(=O)C1=C(C=C(C=C1)N)O PI-42987 [0,2,0,0,0,0|2,0,0]=4 863 B11R1.166 CC(C1=CC=C(F)C=C1O)=O PI-23585 [0,2,0,0,0,0|1,1,0]=4 864 B11R1.166 CC1=C(C=CC(=C1)Cl)[N+](=O)[O-] PI-26718 [0,2,0,0,0,0|2,0,0]=4 865 B11R1.166 CC1=CC(=C(C=C1)C(=O)N)O PI-28583 [0,2,0,0,0,0|2,0,0]=4 866 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)O PI-15312 [0,2,0,0,0,0|2,0,0]=4 867 B11R1.166 CC1=CC(=C(C=C1)[N+](=O)[O-])O PI-28770 [0,2,0,0,0,0|2,0,0]=4 868 B11R1.166 Cc1ccc(c(c1)O)C(=O)C PI-29847 [0,2,0,0,0,0|2,0,0]=4 869 B11R1.166 Clc1ccc(C(=O)O)c(F)c1 PI-16109 [0,2,0,0,0,0|2,0,0]=4 870 B11R1.166 Clc1ccc(C(=O)O)c(N)c1 PI-14296 [0,2,0,0,0,0|2,0,0]=4 871 B11R1.166 Clc1ccc(c(c1)Br)C(=O)O PI-20610 [0,2,0,0,0,0|2,0,0]=4 872 B11R1.166 Clc1ccc(c(c1)F)[N+](=O)[O-] PI-28769 [0,2,0,0,0,0|2,0,0]=4 873 B11R1.166 Clc1cnc(c(c1)Cl)C(=O)O PI-16047 [0,2,0,0,0,0|1,0,1]=4 874 B11R1.166 Fc1ccc(C(=O)O)c(O)c1 PI-34804 [0,2,0,0,0,0|1,1,0]=4 875 B11R1.166 Ic1ccc(c(c1)O)C(=O)C PI-30931 [0,2,0,0,0,0|1,1,0]=4 876 B11R1.166 Oc1ccc(C(=O)C)c(O)c1 PI-15410 [0,2,0,0,0,0|2,0,0]=4 877 B11R1.166 Oc1ccc(c(c1)O)C(=O)N PI-10047 [0,2,0,0,0,0|2,0,0]=4 878 B11R1.277 C1=C(C(=O)NC(=C1F)O)C#N PI-28062 [0,2,0,0,0,0|1,1,0]=4 879 B11R1.277 COC1=CC(=O)C(=CC1=O)O PI-20787 [0,2,0,0,0,0|2,0,0]=4 880 B11R1.277 O=Cc1cc(F)c(Cl)cc1F PI-28937 [0,2,0,0,0,0|2,0,0]=4 881 B11R1.277 O=Cc1cc(O)c(O)cc1O PI-27519 [0,2,0,0,0,0|2,0,0]=4 882 B11R1.278 CC1=C(C=CC(=C1O)C=O)O PI-33979 [0,2,0,0,0,0|2,0,0]=4 883 B11R1.278 O=Cc1ccc(O)c(O)c1O PI-16094 [0,2,0,0,0,0|2,0,0]=4 884 B11R1.279 COc1ccc(C=O)c(O)c1 PI-31262 [0,2,0,0,0,0|2,0,0]=4 885 B11R1.167 B(C1=C(C=CC(=C1)Cl)C)(O)O PI-19142 [0,2,0,0,0,0|2,0,0]=4 886 B11R1.167 C1=C(C(=O)NC=C1Br)C(=O)O PI-12916 [0,2,0,0,0,0|0,1,0]=3 887 B11R1.167 C1=C(C(=O)NC=C1Br)[N+](=O)[O-] PI-21515 [0,2,0,0,0,0|0,1,1]=4 888 B11R1.167 C1=C(C(=O)NC=C1Cl)C(=O)O PI-30553 [0,2,0,0,0,0|0,0,0]=2 889 B11R1.167 C1=C(C(=O)NC=C1Cl)[N+](=O)[O-] PI-20131 [0,2,0,0,0,0|0,0,1]=3 890 B11R1.167 C1=CC(=C(C=C1Cl)C(=O)O)Br PI-20611 [0,2,0,0,0,0|2,0,0]=4 891 B11R1.167 C1=CC(=C(C=C1Cl)C(=O)O)Cl PI-16113 [0,2,0,0,0,0|2,0,0]=4 892 B11R1.167 C1=CC(=C(C=C1Cl)C(=O)O)F PI-28487 [0,2,0,0,0,0|2,0,0]=4 893 B11R1.167 C1=CC(=C(C=C1Cl)C(=O)O)O PI-33939 [0,2,0,0,0,0|1,0,1]=4 894 B11R1.167 CC1=CNC(=O)C(=C1)[N+](=O)[O-] PI-34403 [0,2,0,0,0,0|1,0,1]=4 895 B11R1.167 Clc1ccc(c(c1)B(O)O)Cl PI-11580 [0,2,0,0,0,0|2,0,0]=4 896 B11R1.167 Clc1ccc(c(c1)B(O)O)O PI-39030 [0,2,0,0,0,0|1,0,1]=4 897 B11R1.167 O=[N+](C1=CC(F)=CNC1=O)[O-] PI-46643 [0,2,0,0,0,0|0,1,1]=4 898 B11R1.167 OB(C1=CC(Cl)=CC=C1F)O PI-25476 [0,2,0,0,0,0|2,0,0]=4 899 B11R1.21 C1=C(C(=O)NC=C1C(=O)O)Cl PI-16724 [0,2,0,0,0,0|2,0,0]=4 900 B11R1.21 CC1=CC(=CNC1=O)[N+](=O)[O-] PI-13599 [0,2,0,0,0,0|2,0,0]=4 901 B9R1.5 Oc1cccccc1=O PI-12283 [0,0,1,1,0,0|2,0,0]=4 902 B9R1.11 NNC(=O)c1ccco1 PI-28398 [0,0,1,1,0,0|2,0,0]=4 903 B11R2.36 C1OC2=C(O1)C=C(C=C2)Cl PI-30880 [0,1,0,1,0,0|1,0,1]=4 904 B7R1.2 C1=C(NNC1=O)N PI-30770 [1,0,0,0,1,0|2,0,0]=4 905 B7R1.2 C1=C(SC(=C1)Br)Cl PI-20666 [1,0,0,0,1,0|2,0,0]=4 906 B7R1.2 C1=C(SC(=C1)Cl)Cl PI-11157 [1,0,0,0,1,0|2,0,0]=4 907 B7R1.2 CC1=CNC(=O)N1 PI-31820 [1,0,0,0,1,0|2,0,0]=4 908 B7R1.2 Cc1[nH][nH]c(=O)c1 PI-10806 [1,0,0,0,1,0|2,0,0]=4 909 B7R1.2 Cc1[nH]cc(c1)C PI-10987 [1,0,0,0,1,0|2,0,0]=4 910 B7R1.2 Cc1ccc(s1)Cl PI-29205 [1,0,0,0,1,0|2,0,0]=4 911 B7R1.2 O=C1C=CC(=O)N1 PI-29681 [1,0,0,0,1,0|1,0,0]=3 912 B7R1.2 O=C1OC=C(Cl)O1 PI-38606 [1,0,0,0,1,0|2,0,0]=4 913 B7R1.4 C1=C(C(=CN1)F)F PI-49257 [1,0,0,0,1,0|1,1,0]=4 914 B7R1.4 Oc1cscc1O PI-33661 [1,0,0,0,1,0|2,0,0]=4