@MOLECULE 1,7,9,11-tetrahydroxy-13,13-dimethyl-8-oxo-3-pentyl-5,6,8,13-tetrahydrobenzo[a]tetracene-2-carboxylic acid 52 56 0 0 0 SMALL GASTEIGER @ATOM 1 O 2.1402 3.4490 -0.2294 O.3 1 UNL111111 -0.3372 2 O 4.4849 2.4660 -0.0420 O.2 1 UNL111111 -0.2986 3 O -1.7244 -1.5805 -0.8971 O.3 1 UNL111111 -0.3813 4 O 6.8429 1.5236 0.2170 O.3 1 UNL111111 -0.2409 5 O 7.3682 -3.1206 0.5243 O.3 1 UNL111111 -0.2987 6 O -4.6774 -1.9601 -2.3508 O.co2 1 UNL111111 -0.1048 7 O -4.7477 -2.7826 -0.2658 O.co2 1 UNL111111 -0.3920 8 C 2.8427 -1.3760 0.1870 C.3 1 UNL111111 0.0799 9 C 1.9968 -0.1220 0.0573 C.ar 1 UNL111111 0.0428 10 C 2.5518 1.1264 -0.0312 C.ar 1 UNL111111 -0.2360 11 C -0.2829 0.8157 -0.1433 C.ar 1 UNL111111 -0.0266 12 C 4.3454 -1.1256 0.2393 C.ar 1 UNL111111 0.0165 13 C 0.2464 2.0909 -0.2441 C.ar 1 UNL111111 -0.0411 14 C 0.5795 -0.2785 0.0231 C.ar 1 UNL111111 -0.1161 15 C -0.6208 3.2830 -0.4096 C.3 1 UNL111111 -0.2766 16 C -1.7442 0.6830 -0.2150 C.ar 1 UNL111111 -0.0916 17 C 1.7019 2.3142 -0.1782 C.ar 1 UNL111111 0.3782 18 C -1.9273 3.1061 0.3710 C.3 1 UNL111111 -0.2803 19 C -2.5459 1.7841 0.0378 C.ar 1 UNL111111 0.0341 20 C 4.8655 0.1643 0.1728 C.ar 1 UNL111111 -0.1814 21 C 2.4387 -2.0895 1.4897 C.3 1 UNL111111 -0.4535 22 C 2.5540 -2.2600 -1.0400 C.3 1 UNL111111 -0.4549 23 C 4.0082 1.3618 0.0251 C.2 1 UNL111111 0.4216 24 C -2.3696 -0.5868 -0.6162 C.ar 1 UNL111111 0.4157 25 C 5.1714 -2.2473 0.3558 C.ar 1 UNL111111 -0.2028 26 C -3.9498 1.7065 -0.0385 C.ar 1 UNL111111 -0.1424 27 C -4.5880 0.5152 -0.4542 C.ar 1 UNL111111 0.0842 28 C -3.8371 -0.6020 -0.7097 C.ar 1 UNL111111 -0.2068 29 C 6.3284 0.4160 0.2420 C.ar 1 UNL111111 0.3132 30 C -6.0823 0.5342 -0.6380 C.3 1 UNL111111 -0.2991 31 C 6.6421 -2.1398 0.4188 C.ar 1 UNL111111 0.3068 32 C 7.0472 -0.7959 0.3463 C.ar 1 UNL111111 -0.0413 33 C -6.7372 0.0137 0.5136 C.3 1 UNL111111 0.0454 34 C -7.8266 -0.2929 1.2081 C.3 1 UNL111111 -0.1035 35 C -4.4613 -1.9173 -1.0532 C.2 1 UNL111111 0.5028 36 C -8.9214 -0.5503 1.7666 C.3 1 UNL111111 -0.2974 37 C -10.0520 -0.8618 2.3909 C.3 1 UNL111111 0.2736 38 H 0.1586 -1.2799 0.1223 H 1 UNL111111 0.1919 39 H -0.1010 4.2142 -0.0859 H 1 UNL111111 0.1860 40 H -0.8311 3.4433 -1.4927 H 1 UNL111111 0.1716 41 H -2.6124 3.9503 0.1554 H 1 UNL111111 0.1571 42 H -1.7326 3.1632 1.4661 H 1 UNL111111 0.1723 43 H 2.6159 -1.4518 2.3650 H 1 UNL111111 0.1608 44 H 1.3769 -2.3660 1.4962 H 1 UNL111111 0.1612 45 H 2.9978 -3.0199 1.6397 H 1 UNL111111 0.1561 46 H 3.0961 -3.2112 -1.0011 H 1 UNL111111 0.1556 47 H 1.4887 -2.5137 -1.1231 H 1 UNL111111 0.1667 48 H 2.8384 -1.7527 -1.9716 H 1 UNL111111 0.1615 49 H -4.5531 2.5782 0.2123 H 1 UNL111111 0.1718 50 H 4.7726 -3.2561 0.4077 H 1 UNL111111 0.1815 51 H -6.4410 1.5746 -0.8664 H 1 UNL111111 0.1929 52 H -6.3706 -0.0518 -1.5569 H 1 UNL111111 0.2031 @BOND 1 37 36 1 2 7 35 ar 3 36 34 1 4 6 35 ar 5 35 28 1 6 34 33 1 7 52 30 1 8 33 30 1 9 3 24 1 10 28 24 ar 11 28 27 ar 12 30 27 1 13 30 51 1 14 47 22 1 15 46 22 1 16 24 16 ar 17 44 21 1 18 27 26 ar 19 45 21 1 20 22 48 1 21 22 8 1 22 38 14 1 23 50 25 1 24 21 8 1 25 21 43 1 26 16 11 1 27 16 19 ar 28 8 9 1 29 8 12 1 30 14 11 ar 31 14 9 ar 32 26 49 1 33 26 19 ar 34 25 12 ar 35 25 31 ar 36 5 31 1 37 11 13 ar 38 19 18 1 39 9 10 ar 40 12 20 ar 41 31 32 ar 42 13 17 ar 43 13 15 1 44 10 17 ar 45 10 23 1 46 18 42 1 47 18 41 1 48 18 15 1 49 20 23 1 50 20 29 ar 51 32 29 ar 52 40 15 1 53 17 1 1 54 15 39 1 55 23 2 2 56 29 4 1