@MOLECULE 7-methoxy-8-[3-(4-phenyl-1-piperazinyl)propoxy]-2h-chromen-2-one 55 58 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 1.9466 0.3495 0.9132 O.3 1 UNL1 -0.3134 2 O 4.2518 1.0118 -0.2958 O.2 1 UNL1 -0.3450 3 O 1.3063 -2.5028 1.0920 O.3 1 UNL1 -0.2898 4 O 5.5403 2.6473 -0.9223 O.2 1 UNL1 -0.4212 5 N -1.4523 1.2138 0.9240 N.3 1 UNL1 -0.4307 6 N -4.1402 0.6094 0.1293 N.pl3 1 UNL1 -0.4319 7 C -2.1523 2.0354 -0.0916 C.3 1 UNL1 -0.1196 8 C -2.4436 0.7128 1.9098 C.3 1 UNL1 -0.1252 9 C -3.1614 1.1345 -0.8467 C.3 1 UNL1 -0.1073 10 C -3.4547 -0.1945 1.1694 C.3 1 UNL1 -0.0960 11 C -0.3771 1.9687 1.6155 C.3 1 UNL1 -0.1137 12 C 0.7646 2.3470 0.6554 C.3 1 UNL1 -0.2916 13 C -5.3015 -0.0058 -0.4091 C.ar 1 UNL1 0.2009 14 C 1.3095 1.1422 -0.1085 C.3 1 UNL1 -0.0416 15 C -5.4674 -0.2661 -1.7777 C.ar 1 UNL1 -0.2666 16 C -6.3646 -0.2707 0.4766 C.ar 1 UNL1 -0.2334 17 C -6.6767 -0.7736 -2.2470 C.ar 1 UNL1 -0.0904 18 C -7.5607 -0.7825 -0.0068 C.ar 1 UNL1 -0.0956 19 C 2.7490 -0.6301 0.4069 C.ar 1 UNL1 -0.0494 20 C -7.7237 -1.0370 -1.3693 C.ar 1 UNL1 -0.2095 21 C 3.9969 -0.3027 -0.1619 C.ar 1 UNL1 0.2800 22 C 2.4247 -1.9797 0.5599 C.ar 1 UNL1 0.2730 23 C 4.9024 -1.2921 -0.5726 C.ar 1 UNL1 -0.2558 24 C 3.3306 -2.9888 0.1396 C.ar 1 UNL1 -0.2911 25 C 4.5423 -2.6450 -0.4127 C.ar 1 UNL1 -0.0298 26 C 6.1557 -0.8705 -1.1301 C.ar 1 UNL1 0.0369 27 C 6.4262 0.4456 -1.2617 C.ar 1 UNL1 -0.3732 28 C 5.4683 1.4516 -0.8535 C.ar 1 UNL1 0.5954 29 C 0.3251 -1.6164 1.6247 C.3 1 UNL1 -0.2005 30 H -2.6837 2.9058 0.3490 H 1 UNL1 0.1294 31 H -1.4080 2.4271 -0.8160 H 1 UNL1 0.1408 32 H -1.9142 0.1170 2.6822 H 1 UNL1 0.1348 33 H -2.9859 1.5313 2.4302 H 1 UNL1 0.1313 34 H -3.6980 1.7474 -1.6032 H 1 UNL1 0.1432 35 H -2.6149 0.3251 -1.3785 H 1 UNL1 0.1341 36 H -2.9244 -1.0675 0.7276 H 1 UNL1 0.1342 37 H -4.2002 -0.5870 1.8919 H 1 UNL1 0.1415 38 H 0.0387 1.3054 2.4099 H 1 UNL1 0.1476 39 H -0.7548 2.8828 2.1216 H 1 UNL1 0.1140 40 H 1.5880 2.8060 1.2454 H 1 UNL1 0.1645 41 H 0.4395 3.1219 -0.0629 H 1 UNL1 0.1458 42 H 0.5119 0.5308 -0.5668 H 1 UNL1 0.1400 43 H 2.0422 1.4449 -0.8755 H 1 UNL1 0.1337 44 H -4.6612 -0.0866 -2.4816 H 1 UNL1 0.1560 45 H -6.2543 -0.0476 1.5350 H 1 UNL1 0.1604 46 H -6.7985 -0.9696 -3.3118 H 1 UNL1 0.1462 47 H -8.3805 -0.9813 0.6824 H 1 UNL1 0.1466 48 H -8.6630 -1.4361 -1.7405 H 1 UNL1 0.1512 49 H 3.0408 -4.0300 0.2709 H 1 UNL1 0.1793 50 H 5.2399 -3.4208 -0.7325 H 1 UNL1 0.1559 51 H 6.8694 -1.6387 -1.4375 H 1 UNL1 0.1566 52 H 7.3592 0.8247 -1.6749 H 1 UNL1 0.1906 53 H -0.1141 -0.9942 0.8327 H 1 UNL1 0.1681 54 H -0.4146 -2.3171 2.0299 H 1 UNL1 0.1428 55 H 0.7531 -0.9882 2.4128 H 1 UNL1 0.1476 @BOND 1 46 17 1 2 44 15 1 3 17 15 ar 4 17 20 ar 5 15 13 ar 6 48 20 1 7 52 27 1 8 34 9 1 9 51 26 1 10 35 9 1 11 20 18 ar 12 27 26 ar 13 27 28 ar 14 26 23 ar 15 4 28 2 16 43 14 1 17 28 2 ar 18 9 7 1 19 9 6 1 20 31 7 1 21 50 25 1 22 23 25 ar 23 23 21 ar 24 42 14 1 25 25 24 ar 26 13 6 1 27 13 16 ar 28 2 21 ar 29 21 19 ar 30 14 12 1 31 14 1 1 32 7 30 1 33 7 5 1 34 41 12 1 35 18 16 ar 36 18 47 1 37 6 10 1 38 24 49 1 39 24 22 ar 40 19 22 ar 41 19 1 1 42 16 45 1 43 22 3 1 44 12 40 1 45 12 11 1 46 36 10 1 47 53 29 1 48 5 11 1 49 5 8 1 50 3 29 1 51 10 37 1 52 10 8 1 53 11 39 1 54 11 38 1 55 29 54 1 56 29 55 1 57 8 33 1 58 8 32 1