@MOLECULE 12-(4-deoxy-4-fluoro-beta-d-glucopyranosyl)-3,9-difluoro-12,13-dihydro-5h-indolo[2,3-a]pyrrolo[3,4-c]carbazole-5,7(6h)-dione 56 62 0 0 0 SMALL GASTEIGER @ATOM 1 F -5.2590 -3.2457 -0.5944 F 1 UNL1111111111 -0.1779 2 F -2.8996 5.2941 0.7107 F 1 UNL1111111111 -0.1622 3 F 6.6360 -2.9107 -0.3160 F 1 UNL1111111111 -0.1642 4 O -2.8925 -0.5811 -0.7616 O.3 1 UNL1111111111 -0.4393 5 O -1.1748 -2.5878 1.6641 O.3 1 UNL1111111111 -0.5826 6 O -3.9231 -3.5131 1.9170 O.3 1 UNL1111111111 -0.5266 7 O -4.0038 -0.2437 -3.2854 O.3 1 UNL1111111111 -0.5202 8 O 1.7978 4.6789 -0.0963 O.2 1 UNL1111111111 -0.4400 9 O 5.2514 1.7216 -0.5032 O.2 1 UNL1111111111 -0.4373 10 N -1.1291 0.1381 0.4498 N.ar 1 UNL1111111111 -0.3584 11 N 1.3060 -1.9272 0.2067 N.ar 1 UNL1111111111 -0.4127 12 N 3.7368 3.4544 -0.3355 N.ar 1 UNL1111111111 -0.6644 13 C -1.7964 -1.0696 -0.0070 C.3 1 UNL1111111111 0.2673 14 C -2.3161 -1.8937 1.2043 C.3 1 UNL1111111111 0.0443 15 C 0.2405 0.3687 0.1973 C.ar 1 UNL1111111111 0.0762 16 C -3.3744 -2.9286 0.7689 C.3 1 UNL1111111111 0.0474 17 C -4.4466 -2.2748 -0.1205 C.3 1 UNL1111111111 -0.0247 18 C 0.4914 1.7844 0.1415 C.ar 1 UNL1111111111 0.0223 19 C -3.7446 -1.5762 -1.3054 C.3 1 UNL1111111111 0.0267 20 C -1.7684 1.4026 0.4915 C.ar 1 UNL1111111111 0.1558 21 C 1.3011 -0.5294 0.1350 C.ar 1 UNL1111111111 0.1051 22 C -0.7863 2.4335 0.3365 C.ar 1 UNL1111111111 -0.0674 23 C 2.6486 -0.0465 -0.0669 C.ar 1 UNL1111111111 0.0009 24 C 1.7856 2.2244 -0.0432 C.ar 1 UNL1111111111 -0.1308 25 C 2.8553 1.3116 -0.1613 C.ar 1 UNL1111111111 -0.1054 26 C 3.4972 -1.2147 -0.0789 C.ar 1 UNL1111111111 -0.0639 27 C -4.7074 -0.7509 -2.1772 C.3 1 UNL1111111111 -0.0157 28 C 2.6471 -2.3483 0.1371 C.ar 1 UNL1111111111 0.1395 29 C -3.1117 1.6972 0.7224 C.ar 1 UNL1111111111 -0.1832 30 C -1.1591 3.7687 0.4088 C.ar 1 UNL1111111111 -0.1358 31 C 2.3341 3.6080 -0.1472 C.ar 1 UNL1111111111 0.6143 32 C 4.1187 2.0851 -0.3554 C.ar 1 UNL1111111111 0.6093 33 C -3.4810 3.0347 0.7952 C.ar 1 UNL1111111111 -0.1663 34 C -2.5071 4.0303 0.6363 C.ar 1 UNL1111111111 0.1430 35 C 4.8657 -1.3933 -0.2397 C.ar 1 UNL1111111111 -0.1363 36 C 3.1481 -3.6487 0.2062 C.ar 1 UNL1111111111 -0.2001 37 C 5.3354 -2.7005 -0.1689 C.ar 1 UNL1111111111 0.1376 38 C 4.5169 -3.8200 0.0506 C.ar 1 UNL1111111111 -0.1549 39 H -1.1307 -1.6860 -0.6657 H 1 UNL1111111111 0.1595 40 H -2.6778 -1.2379 2.0259 H 1 UNL1111111111 0.1575 41 H -2.8919 -3.8084 0.2701 H 1 UNL1111111111 0.1795 42 H -5.0673 -1.5444 0.4637 H 1 UNL1111111111 0.1530 43 H -3.1529 -2.2821 -1.9303 H 1 UNL1111111111 0.1576 44 H -5.1608 0.0852 -1.6138 H 1 UNL1111111111 0.1343 45 H -5.4991 -1.3788 -2.6294 H 1 UNL1111111111 0.1611 46 H 0.5744 -2.4470 0.6607 H 1 UNL1111111111 0.3400 47 H -3.8479 0.9075 0.8347 H 1 UNL1111111111 0.1644 48 H -0.4206 4.5696 0.2924 H 1 UNL1111111111 0.2116 49 H -1.4407 -3.2828 2.3112 H 1 UNL1111111111 0.3561 50 H -4.5598 -2.9225 2.3719 H 1 UNL1111111111 0.3207 51 H 4.3765 4.2191 -0.4411 H 1 UNL1111111111 0.3386 52 H -4.5215 3.3065 0.9744 H 1 UNL1111111111 0.1725 53 H 5.5312 -0.5410 -0.4120 H 1 UNL1111111111 0.2083 54 H 2.4902 -4.4963 0.3726 H 1 UNL1111111111 0.1660 55 H -3.2390 0.2925 -2.9722 H 1 UNL1111111111 0.3268 56 H 4.9543 -4.8180 0.0979 H 1 UNL1111111111 0.1732 @BOND 1 1 17 1 2 2 34 1 3 3 37 1 4 4 13 1 5 4 19 1 6 5 14 1 7 5 49 1 8 6 16 1 9 6 50 1 10 7 27 1 11 7 55 1 12 8 31 2 13 9 32 2 14 10 13 1 15 10 15 ar 16 10 20 ar 17 11 21 ar 18 11 28 ar 19 11 46 1 20 12 31 ar 21 12 32 ar 22 12 51 1 23 13 14 1 24 13 39 1 25 14 16 1 26 14 40 1 27 15 18 ar 28 15 21 ar 29 16 17 1 30 16 41 1 31 17 19 1 32 17 42 1 33 18 22 ar 34 18 24 ar 35 19 27 1 36 19 43 1 37 20 22 ar 38 20 29 ar 39 21 23 ar 40 22 30 ar 41 23 25 ar 42 23 26 ar 43 24 25 ar 44 24 31 ar 45 25 32 ar 46 26 28 ar 47 26 35 ar 48 27 44 1 49 27 45 1 50 28 36 ar 51 29 33 ar 52 29 47 1 53 30 34 ar 54 30 48 1 55 33 34 ar 56 33 52 1 57 35 37 ar 58 35 53 1 59 36 38 ar 60 36 54 1 61 37 38 ar 62 38 56 1