@MOLECULE 3,5,12-trihydroxy-3-(1-hydroxyethyl)-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl 3-amino-2,3,6-trideoxy-alpha-l-lyxo-hexopyranoside 69 73 0 0 0 SMALL USER_CHARGES @ATOM 1 O 2.0622 0.6668 -0.2184 O.3 1 UNL11 -0.4914 2 O 3.0037 -1.5267 1.0269 O.3 1 UNL11 -0.5993 3 O 3.8249 1.8482 -1.1193 O.3 1 UNL11 -0.4639 4 O 3.3130 -4.1066 -1.3705 O.3 1 UNL11 -0.5850 5 O 5.3361 3.4764 0.6975 O.3 1 UNL11 -0.5485 6 O -0.5029 1.3641 -1.6329 O.3 1 UNL11 -0.4818 7 O -1.3042 -3.4059 0.8485 O.3 1 UNL11 -0.4659 8 O -2.9613 1.9742 -1.1830 O.2 1 UNL11 -0.5031 9 O -3.8240 -2.7703 1.1388 O.2 1 UNL11 -0.4988 10 O -5.4936 2.6334 -0.8405 O.3 1 UNL11 -0.3342 11 N 3.5163 3.2292 2.8330 N.3 1 UNL11 -0.6351 12 C 2.6152 -2.2482 -0.1234 C.3 1 UNL11 0.3129 13 C 2.6625 -1.3531 -1.3680 C.3 1 UNL11 -0.3929 14 C 1.6555 -0.2060 -1.2729 C.3 1 UNL11 0.1670 15 C 1.2084 -2.8282 0.0928 C.3 1 UNL11 -0.3376 16 C 0.2985 -0.6654 -0.8150 C.ar 1 UNL11 -0.1189 17 C 0.1135 -1.8599 -0.1707 C.ar 1 UNL11 0.0426 18 C 3.6955 -3.3667 -0.2212 C.3 1 UNL11 0.1436 19 C 2.5275 1.9408 -0.5988 C.3 1 UNL11 0.3363 20 C 2.4601 2.7720 0.6816 C.3 1 UNL11 -0.3557 21 C 3.4991 2.2815 1.7034 C.3 1 UNL11 0.0191 22 C 4.8932 2.1782 1.0200 C.3 1 UNL11 0.0316 23 C -0.8018 0.2281 -0.9883 C.ar 1 UNL11 0.3516 24 C -1.2105 -2.1970 0.2737 C.ar 1 UNL11 0.2853 25 C 4.7982 1.2951 -0.2372 C.3 1 UNL11 0.0872 26 C -2.0716 -0.0742 -0.5105 C.ar 1 UNL11 -0.2873 27 C -2.2797 -1.3272 0.1237 C.ar 1 UNL11 -0.2392 28 C 3.7439 -4.2485 1.0175 C.3 1 UNL11 -0.5043 29 C 6.0863 1.3002 -1.0493 C.3 1 UNL11 -0.4642 30 C -3.1617 0.8942 -0.6446 C.2 1 UNL11 0.5188 31 C -3.6100 -1.6871 0.6155 C.2 1 UNL11 0.4978 32 C -4.4910 0.5499 -0.1083 C.ar 1 UNL11 -0.1991 33 C -4.7145 -0.7068 0.4770 C.ar 1 UNL11 -0.0740 34 C -5.5706 1.4340 -0.1915 C.ar 1 UNL11 0.2701 35 C -5.9729 -1.0658 0.9440 C.ar 1 UNL11 -0.1309 36 C -6.8487 1.0783 0.2740 C.ar 1 UNL11 -0.2091 37 C -7.0447 -0.1720 0.8351 C.ar 1 UNL11 -0.1010 38 C -4.8835 3.6693 -0.0724 C.3 1 UNL11 -0.1794 39 H 2.4597 -1.9691 -2.2695 H 1 UNL11 0.1824 40 H 3.6817 -0.9429 -1.5119 H 1 UNL11 0.1722 41 H 1.5978 0.3450 -2.2423 H 1 UNL11 0.1512 42 H 1.1340 -3.2137 1.1377 H 1 UNL11 0.1895 43 H 1.0766 -3.7289 -0.5549 H 1 UNL11 0.1937 44 H 4.6901 -2.9154 -0.4360 H 1 UNL11 0.1263 45 H 1.9452 2.3537 -1.4525 H 1 UNL11 0.1438 46 H 1.4451 2.7111 1.1286 H 1 UNL11 0.1834 47 H 2.6160 3.8418 0.4466 H 1 UNL11 0.1634 48 H 3.1965 1.2731 2.0872 H 1 UNL11 0.1506 49 H 5.6702 1.8129 1.7233 H 1 UNL11 0.1462 50 H 4.4864 0.2588 0.0326 H 1 UNL11 0.1471 51 H 2.6508 -0.6095 0.9805 H 1 UNL11 0.3540 52 H 4.6249 -4.8968 1.0271 H 1 UNL11 0.1438 53 H 3.7810 -3.6270 1.9275 H 1 UNL11 0.1840 54 H 2.8553 -4.8855 1.0993 H 1 UNL11 0.1590 55 H 3.7307 -4.9864 -1.3763 H 1 UNL11 0.3237 56 H 6.4756 2.3190 -1.1842 H 1 UNL11 0.1657 57 H 5.9180 0.8866 -2.0527 H 1 UNL11 0.1617 58 H 6.8681 0.7102 -0.5598 H 1 UNL11 0.1537 59 H 3.9694 4.0943 2.5673 H 1 UNL11 0.2612 60 H 4.0023 2.8503 3.6302 H 1 UNL11 0.2478 61 H 4.8801 3.7888 -0.1168 H 1 UNL11 0.3283 62 H -1.3293 1.9657 -1.6998 H 1 UNL11 0.3853 63 H -2.2596 -3.5867 1.1505 H 1 UNL11 0.3781 64 H -6.1239 -2.0519 1.3939 H 1 UNL11 0.1833 65 H -7.6648 1.7930 0.1744 H 1 UNL11 0.1755 66 H -8.0311 -0.4658 1.1954 H 1 UNL11 0.1603 67 H -4.7247 4.4522 -0.8263 H 1 UNL11 0.1562 68 H -3.9239 3.3636 0.3546 H 1 UNL11 0.1435 69 H -5.5793 3.9982 0.7048 H 1 UNL11 0.1219 @BOND 1 39 13 1 2 41 14 1 3 57 29 1 4 62 6 1 5 6 23 1 6 40 13 1 7 45 19 1 8 55 4 1 9 4 18 1 10 13 14 1 11 13 12 1 12 14 16 1 13 14 1 1 14 56 29 1 15 8 30 2 16 3 19 1 17 3 25 1 18 29 58 1 19 29 25 1 20 23 16 ar 21 23 26 ar 22 10 34 1 23 10 38 1 24 67 38 1 25 16 17 ar 26 30 26 1 27 30 32 1 28 19 1 1 29 19 20 1 30 43 15 1 31 26 27 ar 32 44 18 1 33 25 50 1 34 25 22 1 35 18 12 1 36 18 28 1 37 34 32 ar 38 34 36 ar 39 17 15 1 40 17 24 ar 41 12 15 1 42 12 2 1 43 61 5 1 44 32 33 ar 45 38 68 1 46 38 69 1 47 15 42 1 48 27 24 ar 49 27 31 1 50 65 36 1 51 24 7 1 52 36 37 ar 53 47 20 1 54 33 31 1 55 33 35 ar 56 31 9 2 57 20 46 1 58 20 21 1 59 5 22 1 60 37 35 ar 61 37 66 1 62 7 63 1 63 35 64 1 64 51 2 1 65 28 52 1 66 28 54 1 67 28 53 1 68 22 21 1 69 22 49 1 70 21 48 1 71 21 11 1 72 59 11 1 73 11 60 1