@MOLECULE 1,3,6,8-tetrahydroxy-9,10-anthraquinone 28 30 0 0 0 SMALL GASTEIGER @ATOM 1 O -0.0248 -2.5210 -0.0134 O.2 1 UNL1111 -0.4939 2 O 0.0129 2.8279 0.0034 O.2 1 UNL1111 -0.3929 3 O -2.5901 -2.5527 -0.0160 O.3 1 UNL1111 -0.4635 4 O 2.4694 -2.5656 0.0333 O.3 1 UNL1111 -0.3843 5 O -4.8685 1.4885 0.0074 O.3 1 UNL1111 -0.4537 6 O 4.8731 1.4827 -0.0144 O.3 1 UNL1111 -0.4536 7 C -1.2587 -0.5427 -0.0022 C.ar 1 UNL1111 -0.3773 8 C 1.2628 -0.5550 0.0052 C.ar 1 UNL1111 -0.2976 9 C -1.2761 0.8590 0.0023 C.ar 1 UNL1111 0.0432 10 C 1.2795 0.8468 0.0015 C.ar 1 UNL1111 0.0394 11 C -0.0024 -1.2985 -0.0028 C.2 1 UNL1111 0.5393 12 C 0.0025 1.6198 0.0027 C.2 1 UNL1111 0.4252 13 C -2.4973 -1.2235 -0.0068 C.ar 1 UNL1111 0.4285 14 C 2.5040 -1.2241 0.0096 C.ar 1 UNL1111 0.3944 15 C -2.4593 1.5718 0.0051 C.ar 1 UNL1111 -0.3306 16 C 2.4633 1.5650 -0.0042 C.ar 1 UNL1111 -0.3358 17 C -3.6751 0.8553 0.0036 C.ar 1 UNL1111 0.3662 18 C 3.6777 0.8568 -0.0071 C.ar 1 UNL1111 0.3813 19 C -3.7203 -0.5298 -0.0023 C.ar 1 UNL1111 -0.3634 20 C 3.7233 -0.5330 -0.0013 C.ar 1 UNL1111 -0.4207 21 H -2.4524 2.6598 0.0081 H 1 UNL1111 0.1855 22 H 2.4483 2.6541 -0.0064 H 1 UNL1111 0.1902 23 H -4.6630 -1.0721 -0.0037 H 1 UNL1111 0.2036 24 H 4.6770 -1.0506 -0.0018 H 1 UNL1111 0.1903 25 H -1.6542 -2.9825 -0.0207 H 1 UNL1111 0.3870 26 H 3.3786 -2.9691 -0.0137 H 1 UNL1111 0.3219 27 H -4.7740 2.4752 0.0110 H 1 UNL1111 0.3339 28 H 4.7854 2.4709 -0.0161 H 1 UNL1111 0.3375 @BOND 1 1 11 2 2 2 12 2 3 3 13 1 4 3 25 1 5 4 14 1 6 4 26 1 7 5 17 1 8 5 27 1 9 6 18 1 10 6 28 1 11 7 9 ar 12 7 11 1 13 7 13 ar 14 8 10 ar 15 8 11 1 16 8 14 ar 17 9 12 1 18 9 15 ar 19 10 12 1 20 10 16 ar 21 13 19 ar 22 14 20 ar 23 15 17 ar 24 15 21 1 25 16 18 ar 26 16 22 1 27 17 19 ar 28 18 20 ar 29 19 23 1 30 20 24 1