@MOLECULE 7-hydroxyflavone 28 30 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O -0.0973 -0.6080 -0.0592 O.2 1 UNL1 -0.0840 2 O 1.3301 3.2037 0.2409 O.2 1 UNL1 -0.3310 3 O 4.1480 -2.4716 -0.2214 O.3 1 UNL1 -0.3145 4 C 1.8014 0.9028 0.0591 C.ar 1 UNL1 -0.0765 5 C 1.2497 -0.3779 -0.0428 C.ar 1 UNL1 0.2227 6 C -0.9390 0.4741 0.0403 C.ar 1 UNL1 0.0816 7 C -2.3202 -0.0098 0.0133 C.ar 1 UNL1 0.0772 8 C 0.9156 2.0693 0.1581 C.ar 1 UNL1 0.2046 9 C -0.5125 1.7437 0.1490 C.ar 1 UNL1 -0.4071 10 C 3.1945 1.0437 0.0648 C.ar 1 UNL1 -0.1063 11 C 2.0323 -1.5279 -0.1386 C.ar 1 UNL1 -0.4228 12 C 3.4147 -1.3396 -0.1283 C.ar 1 UNL1 0.2230 13 C 4.0126 -0.0712 -0.0281 C.ar 1 UNL1 -0.4550 14 C -3.3039 0.7327 -0.6469 C.ar 1 UNL1 -0.2236 15 C -2.6504 -1.2122 0.6451 C.ar 1 UNL1 -0.1263 16 C -4.6183 0.2736 -0.6660 C.ar 1 UNL1 -0.2366 17 C -3.9670 -1.6656 0.6211 C.ar 1 UNL1 -0.2244 18 C -4.9499 -0.9236 -0.0326 C.ar 1 UNL1 -0.1120 19 H -1.1962 2.5845 0.2446 H 1 UNL1 0.2185 20 H 3.6214 2.0506 0.1443 H 1 UNL1 0.2160 21 H 1.5951 -2.5185 -0.2201 H 1 UNL1 0.3035 22 H 5.0918 0.0313 -0.0241 H 1 UNL1 0.2353 23 H -3.0426 1.6648 -1.1488 H 1 UNL1 0.1992 24 H -1.8803 -1.7923 1.1554 H 1 UNL1 0.2199 25 H -5.3876 0.8500 -1.1778 H 1 UNL1 0.1875 26 H -4.2282 -2.6004 1.1139 H 1 UNL1 0.2133 27 H -5.9785 -1.2807 -0.0493 H 1 UNL1 0.1836 28 H 5.1222 -2.2956 -0.2136 H 1 UNL1 0.3340 @BOND 1 25 16 1 2 23 14 1 3 16 14 ar 4 16 18 ar 5 14 7 ar 6 3 28 1 7 3 12 1 8 21 11 1 9 11 12 ar 10 11 5 ar 11 12 13 ar 12 1 5 ar 13 1 6 ar 14 27 18 1 15 5 4 ar 16 18 17 ar 17 13 22 1 18 13 10 ar 19 7 6 1 20 7 15 ar 21 6 9 ar 22 4 10 ar 23 4 8 ar 24 10 20 1 25 9 8 ar 26 9 19 1 27 8 2 2 28 17 15 ar 29 17 26 1 30 15 24 1