@MOLECULE 2-fluoro-n,n-dimethyl-4-{(5r)-5-[2-methyl-1-oxo-1-(1,3,4-thiadiazol-2-ylamino)-2-propanyl]-5h-chromeno[2,3-b]pyridin-2-yl}benzamide 61 65 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 S 2.1981 -4.1293 0.7911 S.2 1 UNL1 0.2456 2 F -5.4924 2.2085 -0.0406 F 1 UNL1 -0.1601 3 O 1.3234 2.9364 0.5441 O.3 1 UNL1 -0.2299 4 O 2.5804 -1.5896 1.5989 O.2 1 UNL1 -0.4560 5 O -7.1168 -0.3644 1.7004 O.2 1 UNL1 -0.5063 6 N 3.7545 -2.0200 -0.2733 N.am 1 UNL1 -0.5457 7 N -0.4438 1.5913 0.2192 N.ar 1 UNL1 -0.4025 8 N 3.6790 -4.1337 -1.3596 N.ar 1 UNL1 -0.2906 9 N 3.1404 -5.3568 -1.2853 N.ar 1 UNL1 -0.1199 10 N -7.4527 -0.4798 -0.5298 N.am 1 UNL1 -0.4548 11 C 3.8424 0.2866 0.7041 C.3 1 UNL1 0.0339 12 C 3.2046 0.9996 -0.5386 C.3 1 UNL1 -0.0959 13 C 3.4896 2.4719 -0.4927 C.ar 1 UNL1 -0.1097 14 C 1.7248 0.7871 -0.5574 C.ar 1 UNL1 -0.1988 15 C 5.3686 0.2829 0.5997 C.3 1 UNL1 -0.4613 16 C 3.4207 0.9474 2.0172 C.3 1 UNL1 -0.4531 17 C 3.3282 -1.1547 0.7580 C.2 1 UNL1 0.5512 18 C 2.5482 3.3445 0.0574 C.ar 1 UNL1 0.1880 19 C 0.8812 1.7363 0.0491 C.ar 1 UNL1 0.3622 20 C 1.1084 -0.3257 -1.1225 C.ar 1 UNL1 -0.0483 21 C 4.6806 3.0127 -0.9775 C.ar 1 UNL1 -0.1120 22 C 2.7744 4.7164 0.1806 C.ar 1 UNL1 -0.2068 23 C -0.2663 -0.4984 -0.9773 C.ar 1 UNL1 -0.2692 24 C 4.9265 4.3794 -0.8688 C.ar 1 UNL1 -0.1905 25 C -1.0051 0.4588 -0.2626 C.ar 1 UNL1 0.2170 26 C 3.9824 5.2255 -0.2831 C.ar 1 UNL1 -0.0991 27 C -2.4508 0.2908 -0.0255 C.ar 1 UNL1 0.0228 28 C 3.3098 -3.3219 -0.3548 C.ar 1 UNL1 0.1668 29 C -3.3035 1.3917 -0.1253 C.ar 1 UNL1 -0.1802 30 C -2.9547 -0.9745 0.2963 C.ar 1 UNL1 -0.1739 31 C -4.6667 1.1804 0.0654 C.ar 1 UNL1 0.2033 32 C -4.3219 -1.1561 0.4862 C.ar 1 UNL1 -0.0813 33 C -5.1954 -0.0779 0.3504 C.ar 1 UNL1 -0.1743 34 C 2.3488 -5.5534 -0.2496 C.ar 1 UNL1 -0.1943 35 C -6.6536 -0.2777 0.5806 C.2 1 UNL1 0.5736 36 C -6.9992 -0.1457 -1.8798 C.3 1 UNL1 -0.2374 37 C -8.9071 -0.4913 -0.3471 C.3 1 UNL1 -0.2330 38 H 3.6584 0.5639 -1.4675 H 1 UNL1 0.1611 39 H 2.3266 0.9575 2.1380 H 1 UNL1 0.1748 40 H 5.8227 -0.3563 1.3694 H 1 UNL1 0.1647 41 H 5.7365 -0.0535 -0.3742 H 1 UNL1 0.1459 42 H 5.7704 1.2946 0.7617 H 1 UNL1 0.1701 43 H 3.8208 0.4099 2.8874 H 1 UNL1 0.1665 44 H 3.7654 1.9860 2.0813 H 1 UNL1 0.1613 45 H 1.6946 -1.0670 -1.6691 H 1 UNL1 0.1667 46 H 5.4218 2.3643 -1.4431 H 1 UNL1 0.1549 47 H 2.0138 5.3580 0.6231 H 1 UNL1 0.1818 48 H 4.4217 -1.7135 -0.9812 H 1 UNL1 0.3376 49 H -0.7611 -1.3647 -1.4088 H 1 UNL1 0.1788 50 H 5.8607 4.7922 -1.2440 H 1 UNL1 0.1551 51 H 4.1891 6.2924 -0.1978 H 1 UNL1 0.1570 52 H -2.9021 2.3880 -0.3306 H 1 UNL1 0.1994 53 H -2.2751 -1.8192 0.4138 H 1 UNL1 0.1713 54 H -4.7161 -2.1408 0.7465 H 1 UNL1 0.1695 55 H 1.8457 -6.4900 -0.0586 H 1 UNL1 0.2022 56 H -7.1185 0.9288 -2.1066 H 1 UNL1 0.1423 57 H -5.9372 -0.4163 -2.0162 H 1 UNL1 0.1536 58 H -7.5794 -0.7214 -2.6230 H 1 UNL1 0.1494 59 H -9.3585 -1.2617 -0.9940 H 1 UNL1 0.1419 60 H -9.1622 -0.7411 0.7030 H 1 UNL1 0.1784 61 H -9.3590 0.4875 -0.5791 H 1 UNL1 0.1365 @BOND 1 58 36 1 2 56 36 1 3 57 36 1 4 36 10 1 5 45 20 1 6 38 12 1 7 46 21 1 8 49 23 1 9 8 9 ar 10 8 28 ar 11 9 34 ar 12 50 24 1 13 20 23 ar 14 20 14 ar 15 59 37 1 16 48 6 1 17 21 24 ar 18 21 13 ar 19 23 25 ar 20 24 26 ar 21 61 37 1 22 14 12 1 23 14 19 ar 24 12 13 1 25 12 11 1 26 10 37 1 27 10 35 am 28 13 18 ar 29 41 15 1 30 28 6 1 31 28 1 ar 32 37 60 1 33 52 29 1 34 26 51 1 35 26 22 ar 36 6 17 am 37 25 27 1 38 25 7 ar 39 34 55 1 40 34 1 ar 41 29 27 ar 42 29 31 ar 43 2 31 1 44 27 30 ar 45 19 7 ar 46 19 3 1 47 18 22 ar 48 18 3 1 49 31 33 ar 50 22 47 1 51 30 53 1 52 30 32 ar 53 33 32 ar 54 33 35 1 55 32 54 1 56 35 5 2 57 15 11 1 58 15 42 1 59 15 40 1 60 11 17 1 61 11 16 1 62 17 4 2 63 16 44 1 64 16 39 1 65 16 43 1