@MOLECULE 4,7-dihydroxy-6-(hydroxymethyl)-9,12-dimethyl-10h-2,5,11-trioxabenzo[4,5]cyclohepta[1,2-f]indene-3,10(1h)-dione 40 43 0 0 0 SMALL GASTEIGER @ATOM 1 O -0.5755 -0.4431 1.3027 O.3 1 UNL111111111 -0.2426 2 O 4.9891 -0.3024 -0.7841 O.3 1 UNL111111111 -0.3712 3 O -0.1019 2.3440 0.5826 O.3 1 UNL111111111 -0.3855 4 O 1.3973 -2.2034 0.8203 O.3 1 UNL111111111 -0.4289 5 O 4.3102 -2.3600 -0.1699 O.2 1 UNL111111111 -0.4661 6 O -4.2920 -2.3971 -0.7954 O.3 1 UNL111111111 -0.4345 7 O -2.0235 3.1666 1.0837 O.2 1 UNL111111111 -0.3996 8 O -1.0686 -3.3534 -0.3005 O.3 1 UNL111111111 -0.5306 9 C 3.0171 0.8984 -0.3232 C.ar 1 UNL111111111 0.0574 10 C 2.0230 1.8298 -0.1553 C.ar 1 UNL111111111 -0.0906 11 C 2.8201 -0.4620 -0.0027 C.ar 1 UNL111111111 -0.3945 12 C 0.7826 1.3552 0.3665 C.ar 1 UNL111111111 0.2888 13 C 0.5704 0.0160 0.6875 C.ar 1 UNL111111111 -0.0708 14 C 4.4233 1.0271 -0.8325 C.3 1 UNL111111111 -0.0486 15 C 1.6142 -0.9201 0.4979 C.ar 1 UNL111111111 0.3671 16 C -1.6938 -0.2985 0.5037 C.ar 1 UNL111111111 0.3160 17 C -2.1240 0.9836 0.1333 C.ar 1 UNL111111111 -0.3847 18 C -2.4152 -1.4493 0.2117 C.ar 1 UNL111111111 -0.2454 19 C 4.0519 -1.1948 -0.2947 C.2 1 UNL111111111 0.6284 20 C -3.2879 1.1136 -0.6492 C.ar 1 UNL111111111 0.2432 21 C 2.1769 3.2701 -0.4728 C.3 1 UNL111111111 -0.4184 22 C -1.4874 2.1865 0.6473 C.2 1 UNL111111111 0.6401 23 C -3.5874 -1.2764 -0.5453 C.ar 1 UNL111111111 0.3828 24 C -4.0121 -0.0227 -0.9997 C.ar 1 UNL111111111 -0.4087 25 C -1.9754 -2.8170 0.6393 C.3 1 UNL111111111 0.0379 26 C -3.7550 2.4530 -1.0914 C.3 1 UNL111111111 -0.4799 27 H 4.4896 1.3442 -1.8882 H 1 UNL111111111 0.1636 28 H 5.0712 1.6539 -0.1963 H 1 UNL111111111 0.1643 29 H 1.4517 3.5933 -1.2378 H 1 UNL111111111 0.1662 30 H 1.9807 3.8976 0.4149 H 1 UNL111111111 0.1745 31 H 3.1782 3.5263 -0.8390 H 1 UNL111111111 0.1496 32 H -4.9063 0.0645 -1.6081 H 1 UNL111111111 0.1753 33 H -1.5116 -2.8060 1.6454 H 1 UNL111111111 0.1349 34 H -2.8088 -3.5505 0.6283 H 1 UNL111111111 0.1556 35 H -4.1017 3.0547 -0.2291 H 1 UNL111111111 0.1948 36 H -2.9526 3.0381 -1.5680 H 1 UNL111111111 0.1749 37 H -4.5883 2.4086 -1.8056 H 1 UNL111111111 0.1643 38 H 2.2274 -2.7587 0.6617 H 1 UNL111111111 0.3688 39 H -5.0882 -2.2296 -1.3632 H 1 UNL111111111 0.3325 40 H -0.2011 -2.9061 -0.2091 H 1 UNL111111111 0.3196 @BOND 1 1 13 1 2 1 16 1 3 2 14 1 4 2 19 1 5 3 12 1 6 3 22 1 7 4 15 1 8 4 38 1 9 5 19 2 10 6 23 1 11 6 39 1 12 7 22 2 13 8 25 1 14 8 40 1 15 9 10 ar 16 9 11 ar 17 9 14 1 18 10 12 ar 19 10 21 1 20 11 15 ar 21 11 19 1 22 12 13 ar 23 13 15 ar 24 14 27 1 25 14 28 1 26 16 17 ar 27 16 18 ar 28 17 20 ar 29 17 22 1 30 18 23 ar 31 18 25 1 32 20 24 ar 33 20 26 1 34 21 29 1 35 21 30 1 36 21 31 1 37 23 24 ar 38 24 32 1 39 25 33 1 40 25 34 1 41 26 35 1 42 26 36 1 43 26 37 1