@MOLECULE 1,3,8,11-tetrahydroxy-10-(4-hydroxy-2-oxopentyl)-2-methyl-5,12-tetracenedione 45 48 0 0 0 SMALL GASTEIGER @ATOM 1 O -1.3494 -1.0076 -0.9200 O.3 1 UNL111111 -0.4859 2 O 1.0955 -1.7603 -0.8368 O.2 1 UNL111111 -0.4045 3 O 2.6506 3.1034 0.7645 O.2 1 UNL111111 -0.3882 4 O 3.5190 -2.5419 -0.7952 O.3 1 UNL111111 -0.3211 5 O -4.5499 4.2814 0.0740 O.3 1 UNL111111 -0.3811 6 O -3.8433 -0.8706 1.2330 O.2 1 UNL111111 -0.4279 7 O 6.8114 0.4366 0.6436 O.3 1 UNL111111 -0.3683 8 O -2.9548 -4.4131 0.9067 O.3 1 UNL111111 -0.3295 9 C -1.8880 1.2134 -0.3921 C.ar 1 UNL111111 -0.0581 10 C 0.4577 0.4246 -0.2888 C.ar 1 UNL111111 -0.2737 11 C 0.8655 1.7124 0.1307 C.ar 1 UNL111111 -0.0697 12 C -1.4367 2.4964 0.0331 C.ar 1 UNL111111 0.0173 13 C -3.2937 1.0109 -0.6511 C.ar 1 UNL111111 0.1016 14 C -0.9004 0.1909 -0.5341 C.ar 1 UNL111111 0.3483 15 C -0.0517 2.7217 0.2934 C.ar 1 UNL111111 -0.1224 16 C 2.8565 -0.3544 -0.1928 C.ar 1 UNL111111 -0.1535 17 C 3.2791 0.9045 0.2313 C.ar 1 UNL111111 -0.0819 18 C 1.4407 -0.6489 -0.4652 C.2 1 UNL111111 0.4640 19 C -3.8220 -0.3211 -1.0860 C.3 1 UNL111111 -0.4019 20 C 2.2865 2.0076 0.4078 C.2 1 UNL111111 0.4408 21 C -2.3367 3.5502 0.2110 C.ar 1 UNL111111 -0.1835 22 C -4.1823 2.0279 -0.4888 C.ar 1 UNL111111 -0.2666 23 C 3.8412 -1.4495 -0.3929 C.ar 1 UNL111111 0.3937 24 C -3.7601 3.3597 -0.0555 C.ar 1 UNL111111 0.3940 25 C -3.9664 -1.2521 0.1006 C.2 1 UNL111111 0.4977 26 C 4.5998 1.1960 0.5026 C.ar 1 UNL111111 -0.1469 27 C 5.2490 -1.1511 -0.0876 C.ar 1 UNL111111 -0.1124 28 C -4.3402 -2.6815 -0.2327 C.3 1 UNL111111 -0.3892 29 C 5.6600 0.1731 0.3739 C.ar 1 UNL111111 0.3916 30 C -4.1798 -3.5803 0.9497 C.3 1 UNL111111 -0.2334 31 C 6.2338 -2.2093 -0.2601 C.3 1 UNL111111 -0.4454 32 C -4.0607 -5.0779 0.7872 C.3 1 UNL111111 0.3696 33 H 0.2692 3.7153 0.6241 H 1 UNL111111 0.1869 34 H -4.8134 -0.2164 -1.5813 H 1 UNL111111 0.1782 35 H -3.1780 -0.7751 -1.8742 H 1 UNL111111 0.1998 36 H -2.0165 4.5321 0.5474 H 1 UNL111111 0.1806 37 H -5.2511 1.9024 -0.6585 H 1 UNL111111 0.1816 38 H 4.9161 2.1910 0.8292 H 1 UNL111111 0.2019 39 H -3.7298 -3.0439 -1.0902 H 1 UNL111111 0.1793 40 H -5.3975 -2.7078 -0.5859 H 1 UNL111111 0.1819 41 H -4.3414 -3.1245 1.9309 H 1 UNL111111 0.1906 42 H -0.5843 -1.6892 -0.9897 H 1 UNL111111 0.3873 43 H 7.2600 -1.8984 0.0001 H 1 UNL111111 0.1816 44 H 5.9903 -3.1001 0.3528 H 1 UNL111111 0.1889 45 H 6.2523 -2.5860 -1.3022 H 1 UNL111111 0.1877 @BOND 1 32 30 1 2 39 28 1 3 30 8 1 4 30 28 1 5 30 41 1 6 40 28 1 7 28 25 1 8 25 19 1 9 25 6 2 10 35 19 1 11 42 1 1 12 34 19 1 13 4 23 1 14 19 13 1 15 2 18 2 16 1 14 1 17 44 31 1 18 45 31 1 19 31 43 1 20 31 27 1 21 18 16 1 22 18 10 1 23 23 27 ar 24 23 16 ar 25 14 10 ar 26 14 9 ar 27 13 9 ar 28 13 22 ar 29 37 22 1 30 27 29 ar 31 16 17 ar 32 10 11 ar 33 9 12 ar 34 22 24 ar 35 29 7 1 36 29 26 ar 37 17 26 ar 38 17 20 1 39 11 15 ar 40 11 20 1 41 12 15 ar 42 12 21 ar 43 24 21 ar 44 24 5 1 45 26 38 1 46 15 33 1 47 20 3 2 48 21 36 1