@MOLECULE 1,6,7,9,11-pentahydroxy-3-pentyl-5,6-dihydrobenzo[a]tetracene-8,13-dione 34 38 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O -0.6236 4.3463 -0.1918 O.2 1 UNL1 -0.3234 2 O 1.8791 3.3959 0.5868 O.2 1 UNL1 -0.3141 3 O -1.5589 -1.9232 0.4037 O.2 1 UNL1 -0.3651 4 O 4.0490 2.3613 -0.6904 O.2 1 UNL1 -0.2909 5 O 2.0665 -2.5001 0.3604 O.2 1 UNL1 -0.3582 6 O 6.7319 0.7746 -0.7703 O.2 1 UNL1 -0.2893 7 O 4.6669 -4.6500 0.0529 O.2 1 UNL1 -0.1512 8 C -0.8951 3.1928 -0.0108 C.2 1 UNL1 0.4262 9 C -0.0526 2.0507 0.3319 C.3 1 UNL1 -0.4280 10 C -2.1733 2.5351 -0.1174 C.2 1 UNL1 0.2682 11 C -0.5280 0.7436 0.5490 C.2 1 UNL1 0.0281 12 C -2.8134 1.3896 -0.0245 C.2 1 UNL1 -0.1821 13 C -1.8605 0.3840 0.3757 C.2 1 UNL1 -0.2967 14 C 1.4018 2.3138 0.3859 C.2 1 UNL1 0.4701 15 C 0.4686 -0.1448 1.0685 C.3 1 UNL1 0.2866 16 C 2.2568 1.0916 0.1921 C.2 1 UNL1 -0.1746 17 C -4.2314 1.0860 -0.2714 C.2 1 UNL1 0.2200 18 C 1.7419 -0.1416 0.4335 C.2 1 UNL1 -0.1956 19 C -4.6405 -0.2341 0.0699 C.2 1 UNL1 -0.5578 20 C -2.3407 -1.0009 0.4846 C.2 1 UNL1 0.3117 21 C -5.9452 -0.5452 -0.0777 C.1 1 UNL1 0.6262 22 C -3.7952 -1.1939 0.7076 C.3 1 UNL1 0.1628 23 C -7.1515 -0.8558 -0.2523 C.1 1 UNL1 -0.5743 24 C 3.6579 1.2988 -0.2885 C.2 1 UNL1 0.4376 25 C 2.5212 -1.3910 0.2542 C.2 1 UNL1 0.4483 26 C 4.4621 0.0722 -0.2932 C.2 1 UNL1 -0.2648 27 C 3.9460 -1.1576 -0.0722 C.2 1 UNL1 0.0263 28 C -8.3962 -1.1757 -0.4236 C.1 1 UNL1 0.6617 29 C -9.6125 -1.4896 -0.5907 C.1 1 UNL1 -0.7879 30 C 5.9388 -0.0935 -0.5679 C.2 1 UNL1 0.2849 31 C 4.9615 -2.1960 -0.1961 C.2 1 UNL1 -0.5469 32 C 4.7772 -3.5142 -0.0580 C.1 1 UNL1 0.6359 33 C 6.2374 -1.6135 -0.5136 C.3 1 UNL1 0.2065 34 C -10.8610 -1.8150 -0.7634 C.3 1 UNL1 0.5997 @BOND 1 6 30 2 2 34 29 1 3 4 24 2 4 29 28 3 5 30 33 1 6 30 26 1 7 33 31 1 8 28 23 1 9 26 24 1 10 26 27 2 11 24 16 1 12 17 12 1 13 17 19 2 14 23 21 3 15 31 27 1 16 31 32 2 17 1 8 2 18 10 12 2 19 10 8 1 20 21 19 1 21 27 25 1 22 32 7 2 23 12 13 1 24 8 9 1 25 19 22 1 26 16 14 1 27 16 18 2 28 25 5 2 29 25 18 1 30 9 14 1 31 9 11 1 32 13 20 1 33 13 11 2 34 14 2 2 35 3 20 2 36 18 15 1 37 20 22 1 38 11 15 1