@MOLECULE 8-(dibenzo[b,d]thiophen-4-yl)-2-morpholino-4h-chromen-4-one 49 54 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 S -1.8997 -1.5765 -0.8109 S.2 1 UNL1 0.1703 2 O 1.6980 3.9600 0.7195 O.3 1 UNL1 -0.3739 3 O 1.5590 0.1634 -0.1317 O.2 1 UNL1 -0.3150 4 O 4.8266 -1.9388 -1.3682 O.2 1 UNL1 -0.4722 5 N 2.0895 2.0119 -1.3282 N.pl3 1 UNL1 -0.3849 6 C 0.7371 2.4340 -0.9051 C.3 1 UNL1 -0.1350 7 C 3.0852 3.0735 -1.0611 C.3 1 UNL1 -0.1343 8 C 2.4973 0.7257 -0.9648 C.ar 1 UNL1 0.4530 9 C 0.7291 2.9402 0.5469 C.3 1 UNL1 -0.0813 10 C 3.0106 3.5368 0.4062 C.3 1 UNL1 -0.0821 11 C 0.7057 -1.6401 1.0676 C.ar 1 UNL1 -0.1247 12 C 1.7231 -1.1429 0.2389 C.ar 1 UNL1 0.2566 13 C -0.4008 -0.7613 1.4470 C.ar 1 UNL1 0.0136 14 C -1.5433 -0.6705 0.6610 C.ar 1 UNL1 -0.1182 15 C -2.5832 0.2225 0.9889 C.ar 1 UNL1 -0.0283 16 C 2.8145 -1.9130 -0.1497 C.ar 1 UNL1 -0.2514 17 C -3.6767 0.1756 0.0310 C.ar 1 UNL1 -0.0422 18 C 3.5921 0.0631 -1.4058 C.ar 1 UNL1 -0.5196 19 C 3.8507 -1.3124 -1.0184 C.ar 1 UNL1 0.5173 20 C -3.4549 -0.7555 -1.0045 C.ar 1 UNL1 -0.0995 21 C 0.8034 -2.9599 1.4959 C.ar 1 UNL1 -0.0542 22 C -0.3079 0.0409 2.5869 C.ar 1 UNL1 -0.1451 23 C -2.4770 1.0234 2.1235 C.ar 1 UNL1 -0.1335 24 C 2.8895 -3.2361 0.2938 C.ar 1 UNL1 -0.0224 25 C -1.3385 0.9227 2.9196 C.ar 1 UNL1 -0.1443 26 C 1.8890 -3.7533 1.1093 C.ar 1 UNL1 -0.2188 27 C -4.8518 0.9235 0.0458 C.ar 1 UNL1 -0.1301 28 C -4.3845 -0.9476 -2.0158 C.ar 1 UNL1 -0.1448 29 C -5.7877 0.7324 -0.9674 C.ar 1 UNL1 -0.1554 30 C -5.5569 -0.1938 -1.9887 C.ar 1 UNL1 -0.1328 31 H 0.0097 1.6029 -1.0432 H 1 UNL1 0.1708 32 H 0.4240 3.2473 -1.6012 H 1 UNL1 0.1631 33 H 2.8500 3.9210 -1.7464 H 1 UNL1 0.1652 34 H 4.1063 2.7228 -1.3210 H 1 UNL1 0.1594 35 H -0.2144 3.4553 0.8022 H 1 UNL1 0.1510 36 H 0.9083 2.1258 1.2722 H 1 UNL1 0.1394 37 H 3.3267 2.7453 1.1081 H 1 UNL1 0.1326 38 H 3.6098 4.4475 0.5849 H 1 UNL1 0.1480 39 H 4.3038 0.5128 -2.0925 H 1 UNL1 0.2060 40 H 0.0243 -3.3764 2.1367 H 1 UNL1 0.1614 41 H 0.5783 -0.0229 3.2175 H 1 UNL1 0.1619 42 H -3.2740 1.7163 2.3836 H 1 UNL1 0.1572 43 H 3.7434 -3.8482 -0.0118 H 1 UNL1 0.1742 44 H -1.2478 1.5399 3.8128 H 1 UNL1 0.1571 45 H 1.9470 -4.7845 1.4516 H 1 UNL1 0.1598 46 H -5.0350 1.6453 0.8386 H 1 UNL1 0.1558 47 H -4.2133 -1.6663 -2.8158 H 1 UNL1 0.1638 48 H -6.7104 1.3106 -0.9657 H 1 UNL1 0.1539 49 H -6.3020 -0.3271 -2.7718 H 1 UNL1 0.1527 @BOND 1 47 28 1 2 49 30 1 3 39 18 1 4 28 30 ar 5 28 20 ar 6 30 29 ar 7 33 7 1 8 32 6 1 9 18 19 ar 10 18 8 ar 11 4 19 2 12 5 7 1 13 5 8 1 14 5 6 1 15 34 7 1 16 7 10 1 17 31 6 1 18 19 16 ar 19 20 1 ar 20 20 17 ar 21 29 48 1 22 29 27 ar 23 8 3 ar 24 6 9 1 25 1 14 ar 26 16 12 ar 27 16 24 ar 28 3 12 ar 29 43 24 1 30 17 27 ar 31 17 15 ar 32 27 46 1 33 12 11 ar 34 24 26 ar 35 10 38 1 36 10 2 1 37 10 37 1 38 9 2 1 39 9 35 1 40 9 36 1 41 14 15 ar 42 14 13 ar 43 15 23 ar 44 11 13 1 45 11 21 ar 46 26 45 1 47 26 21 ar 48 13 22 ar 49 21 40 1 50 23 42 1 51 23 25 ar 52 22 25 ar 53 22 41 1 54 25 44 1