@MOLECULE 4,4'-dihydroxy-7,7'-dimethyl-1,1'-binaphthalene-5,5',8,8'-tetrone 42 45 0 0 0 SMALL GASTEIGER @ATOM 1 O -4.7020 1.5218 -1.2107 O.3 1 UNL1111111111 -0.4632 2 O 4.6679 1.5430 1.2479 O.3 1 UNL1111111111 -0.4634 3 O -0.0666 -0.5588 1.8882 O.2 1 UNL1111111111 -0.3880 4 O 0.0812 -0.5843 -1.9031 O.2 1 UNL1111111111 -0.3881 5 O -5.0665 -0.6222 0.2649 O.2 1 UNL1111111111 -0.4941 6 O 5.0677 -0.6001 -0.2131 O.2 1 UNL1111111111 -0.4945 7 C -0.7210 1.2935 -0.1883 C.ar 1 UNL1111111111 -0.0235 8 C 0.7077 1.3008 0.1507 C.ar 1 UNL1111111111 -0.0232 9 C -1.5941 0.3566 0.3387 C.ar 1 UNL1111111111 -0.0360 10 C 1.5917 0.3632 -0.3563 C.ar 1 UNL1111111111 -0.0360 11 C -2.9585 0.3714 -0.0113 C.ar 1 UNL1111111111 -0.3233 12 C 2.9510 0.3870 0.0147 C.ar 1 UNL1111111111 -0.3232 13 C -1.2016 2.2840 -1.0787 C.ar 1 UNL1111111111 -0.0538 14 C 1.1727 2.3045 1.0353 C.ar 1 UNL1111111111 -0.0539 15 C -1.1117 -0.6748 1.2949 C.2 1 UNL1111111111 0.4139 16 C 1.1267 -0.6812 -1.3067 C.2 1 UNL1111111111 0.4137 17 C -3.4189 1.3852 -0.8595 C.ar 1 UNL1111111111 0.3755 18 C 3.3938 1.4061 0.8659 C.ar 1 UNL1111111111 0.3760 19 C -1.9869 -1.8667 1.5188 C.2 1 UNL1111111111 0.0108 20 C 2.0180 -1.8634 -1.5198 C.2 1 UNL1111111111 0.0105 21 C -3.8641 -0.6785 0.4653 C.2 1 UNL1111111111 0.5052 22 C 3.8699 -0.6612 -0.4392 C.2 1 UNL1111111111 0.5052 23 C -2.5348 2.3444 -1.4086 C.ar 1 UNL1111111111 -0.2372 24 C 2.4996 2.3719 1.3865 C.ar 1 UNL1111111111 -0.2367 25 C -3.2753 -1.8399 1.1571 C.2 1 UNL1111111111 -0.2729 26 C 3.3010 -1.8267 -1.1401 C.2 1 UNL1111111111 -0.2725 27 C -1.3259 -3.0223 2.1666 C.3 1 UNL1111111111 -0.4484 28 C 1.3770 -3.0233 -2.1797 C.3 1 UNL1111111111 -0.4481 29 H -0.4929 2.9997 -1.5019 H 1 UNL1111111111 0.1646 30 H 0.4555 3.0234 1.4383 H 1 UNL1111111111 0.1646 31 H -2.9326 3.1007 -2.0838 H 1 UNL1111111111 0.1836 32 H 2.8847 3.1365 2.0599 H 1 UNL1111111111 0.1836 33 H -3.9619 -2.6693 1.3362 H 1 UNL1111111111 0.1897 34 H 3.9965 -2.6507 -1.3100 H 1 UNL1111111111 0.1897 35 H -2.0308 -3.7971 2.4972 H 1 UNL1111111111 0.1622 36 H -0.7404 -2.7079 3.0507 H 1 UNL1111111111 0.1841 37 H -0.6053 -3.5018 1.4831 H 1 UNL1111111111 0.1704 38 H 0.8401 -2.7170 -3.0967 H 1 UNL1111111111 0.1836 39 H 0.6165 -3.4825 -1.5262 H 1 UNL1111111111 0.1706 40 H 2.0882 -3.8106 -2.4626 H 1 UNL1111111111 0.1618 41 H -5.2772 0.7956 -0.7843 H 1 UNL1111111111 0.3803 42 H 5.2533 0.8154 0.8386 H 1 UNL1111111111 0.3803 @BOND 1 1 17 1 2 1 41 1 3 2 18 1 4 2 42 1 5 3 15 2 6 4 16 2 7 5 21 2 8 6 22 2 9 7 8 1 10 7 9 ar 11 7 13 ar 12 8 10 ar 13 8 14 ar 14 9 11 ar 15 9 15 1 16 10 12 ar 17 10 16 1 18 11 17 ar 19 11 21 1 20 12 18 ar 21 12 22 1 22 13 23 ar 23 13 29 1 24 14 24 ar 25 14 30 1 26 15 19 1 27 16 20 1 28 17 23 ar 29 18 24 ar 30 19 25 2 31 19 27 1 32 20 26 2 33 20 28 1 34 21 25 1 35 22 26 1 36 23 31 1 37 24 32 1 38 25 33 1 39 26 34 1 40 27 35 1 41 27 36 1 42 27 37 1 43 28 38 1 44 28 39 1 45 28 40 1