@MOLECULE 8-(cyclopentyloxy)-4-[(3,5-dichloro-4-pyridinyl)amino]-7-methoxy-2h-chromen-2-one 46 49 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 CL -4.6643 1.6074 -1.7849 Cl 1 UNL1 -0.0217 2 CL -2.2312 -1.2726 2.0652 Cl 1 UNL1 0.0093 3 O 3.8006 0.3463 -0.3959 O.3 1 UNL1 -0.3166 4 O 1.4445 -1.0338 -0.6311 O.2 1 UNL1 -0.3593 5 O 3.8371 2.7752 0.4639 O.3 1 UNL1 -0.2462 6 O 0.5282 -2.9569 -1.0539 O.2 1 UNL1 -0.4216 7 N -2.2855 0.8244 -0.1207 N.pl3 1 UNL1 -0.4997 8 N -5.8957 -1.2271 0.6489 N.ar 1 UNL1 -0.3544 9 C 4.0502 -0.9449 0.1978 C.3 1 UNL1 0.1275 10 C 4.0420 -1.9829 -0.9336 C.3 1 UNL1 -0.3044 11 C 5.4903 -0.8423 0.7360 C.3 1 UNL1 -0.3070 12 C 5.3733 -2.7381 -0.8219 C.3 1 UNL1 -0.2593 13 C 6.3516 -1.7617 -0.1445 C.3 1 UNL1 -0.2572 14 C 2.6022 0.9082 -0.1050 C.ar 1 UNL1 0.0216 15 C 1.3673 0.2629 -0.2893 C.ar 1 UNL1 0.2656 16 C 2.6007 2.2546 0.3021 C.ar 1 UNL1 0.2372 17 C 0.1483 0.9401 -0.0924 C.ar 1 UNL1 -0.2546 18 C 1.3895 2.9357 0.5091 C.ar 1 UNL1 -0.3133 19 C 0.1863 2.2809 0.3183 C.ar 1 UNL1 -0.0327 20 C -1.0621 0.1679 -0.3007 C.ar 1 UNL1 0.3744 21 C -0.9852 -1.1450 -0.6599 C.ar 1 UNL1 -0.4889 22 C 0.2775 -1.8118 -0.7997 C.ar 1 UNL1 0.6309 23 C -3.4717 0.1180 0.1141 C.ar 1 UNL1 0.2235 24 C 3.9195 4.1296 0.8938 C.3 1 UNL1 -0.2204 25 C -4.6579 0.4209 -0.5752 C.ar 1 UNL1 -0.1777 26 C -3.5637 -0.8765 1.1034 C.ar 1 UNL1 -0.1572 27 C -5.8416 -0.2625 -0.2869 C.ar 1 UNL1 0.0717 28 C -4.7779 -1.5304 1.3329 C.ar 1 UNL1 0.0706 29 H 3.3151 -1.1616 0.9923 H 1 UNL1 0.1255 30 H 3.1727 -2.6602 -0.8694 H 1 UNL1 0.1633 31 H 3.9506 -1.4712 -1.9104 H 1 UNL1 0.1623 32 H 5.8435 0.2042 0.6948 H 1 UNL1 0.1568 33 H 5.5328 -1.1418 1.7942 H 1 UNL1 0.1382 34 H 5.2523 -3.6515 -0.2151 H 1 UNL1 0.1338 35 H 5.7393 -3.0655 -1.8064 H 1 UNL1 0.1334 36 H 6.8923 -1.1715 -0.9042 H 1 UNL1 0.1367 37 H 7.1157 -2.2916 0.4420 H 1 UNL1 0.1283 38 H 1.3928 3.9734 0.8283 H 1 UNL1 0.1684 39 H -0.7427 2.8202 0.5070 H 1 UNL1 0.1493 40 H -1.8597 -1.7585 -0.8692 H 1 UNL1 0.2021 41 H -2.3580 1.7954 -0.4126 H 1 UNL1 0.3342 42 H 3.4667 4.8057 0.1628 H 1 UNL1 0.1371 43 H 3.4799 4.2548 1.8875 H 1 UNL1 0.1359 44 H 5.0079 4.2842 0.9333 H 1 UNL1 0.1595 45 H -6.7837 -0.0522 -0.8156 H 1 UNL1 0.1969 46 H -4.8797 -2.3224 2.0914 H 1 UNL1 0.1984 @BOND 1 31 10 1 2 35 12 1 3 1 25 1 4 6 22 2 5 10 30 1 6 10 12 1 7 10 9 1 8 36 13 1 9 40 21 1 10 12 34 1 11 12 13 1 12 45 27 1 13 22 21 ar 14 22 4 ar 15 21 20 ar 16 4 15 ar 17 25 27 ar 18 25 23 ar 19 41 7 1 20 3 14 1 21 3 9 1 22 20 7 1 23 20 17 ar 24 15 14 ar 25 15 17 ar 26 27 8 ar 27 13 37 1 28 13 11 1 29 7 23 1 30 14 16 ar 31 17 19 ar 32 23 26 ar 33 42 24 1 34 9 11 1 35 9 29 1 36 16 5 1 37 16 18 ar 38 19 39 1 39 19 18 ar 40 5 24 1 41 18 38 1 42 8 28 ar 43 32 11 1 44 11 33 1 45 24 44 1 46 24 43 1 47 26 28 ar 48 26 2 1 49 28 46 1