@MOLECULE 1-(2-{[4-(~18~f)fluorophenyl](2-thienyl)methoxy}ethyl)-4-(3-phenylpropyl)piperazine 62 65 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 S -2.6672 -0.0478 -1.7262 S.2 1 UNL1 0.2580 2 F -7.6408 -3.2133 -0.1912 F 1 UNL1 -0.1790 3 O -3.1029 0.4612 1.6367 O.3 1 UNL1 -0.4139 4 N 2.5151 0.8892 0.1969 N.3 1 UNL1 -0.4152 5 N 0.2292 1.8311 1.7897 N.3 1 UNL1 -0.4191 6 C 2.2942 0.3913 1.5763 C.3 1 UNL1 -0.1607 7 C 1.2211 1.2029 -0.4591 C.3 1 UNL1 -0.1634 8 C 1.5306 1.4679 2.3845 C.3 1 UNL1 -0.1164 9 C 0.4448 2.2416 0.3879 C.3 1 UNL1 -0.1232 10 C 3.2694 -0.1025 -0.6129 C.3 1 UNL1 -0.1196 11 C -0.7745 0.7514 1.9208 C.3 1 UNL1 -0.1510 12 C 4.7493 -0.0791 -0.1894 C.3 1 UNL1 -0.2674 13 C -2.1570 1.4141 2.1011 C.3 1 UNL1 -0.0365 14 C 5.5871 -0.9435 -1.1426 C.3 1 UNL1 -0.2925 15 C 6.9987 -1.0184 -0.6457 C.ar 1 UNL1 0.0255 16 C -3.9723 0.9181 0.6092 C.3 1 UNL1 0.1254 17 C -4.9613 -0.2053 0.4132 C.ar 1 UNL1 -0.0732 18 C -3.2252 1.2021 -0.6467 C.ar 1 UNL1 -0.1953 19 C 7.3444 -1.9525 0.3342 C.ar 1 UNL1 -0.1812 20 C 7.9696 -0.1496 -1.1473 C.ar 1 UNL1 -0.1792 21 C -4.6318 -1.5090 0.7877 C.ar 1 UNL1 -0.0789 22 C -6.2039 0.0792 -0.1571 C.ar 1 UNL1 -0.1166 23 C 8.6531 -2.0179 0.8054 C.ar 1 UNL1 -0.1361 24 C 9.2782 -0.2177 -0.6739 C.ar 1 UNL1 -0.1358 25 C -2.8662 2.4338 -1.1182 C.ar 1 UNL1 -0.1853 26 C 9.6222 -1.1516 0.3016 C.ar 1 UNL1 -0.1677 27 C -2.1292 2.3758 -2.3478 C.ar 1 UNL1 -0.1717 28 C -5.5409 -2.5450 0.5866 C.ar 1 UNL1 -0.2266 29 C -7.1270 -0.9407 -0.3700 C.ar 1 UNL1 -0.2200 30 C -1.9406 1.1027 -2.8013 C.ar 1 UNL1 -0.2798 31 C -6.7698 -2.2344 0.0080 C.ar 1 UNL1 0.2037 32 H 3.2869 0.2190 2.0449 H 1 UNL1 0.1459 33 H 1.7445 -0.5716 1.6056 H 1 UNL1 0.1151 34 H 0.5953 0.3025 -0.6281 H 1 UNL1 0.1193 35 H 1.4398 1.6425 -1.4562 H 1 UNL1 0.1433 36 H 1.3804 1.1339 3.4306 H 1 UNL1 0.1359 37 H 2.1421 2.3998 2.4292 H 1 UNL1 0.1589 38 H 1.0139 3.1997 0.4118 H 1 UNL1 0.1564 39 H -0.5342 2.4585 -0.0886 H 1 UNL1 0.1431 40 H 3.1940 0.1888 -1.6841 H 1 UNL1 0.1382 41 H 2.8590 -1.1303 -0.5291 H 1 UNL1 0.1136 42 H -0.5514 0.1165 2.8026 H 1 UNL1 0.1403 43 H -0.8047 0.0622 1.0505 H 1 UNL1 0.1402 44 H 4.8654 -0.4366 0.8500 H 1 UNL1 0.1424 45 H 5.1186 0.9659 -0.1863 H 1 UNL1 0.1617 46 H -2.4088 1.5639 3.1659 H 1 UNL1 0.1367 47 H -2.2192 2.3821 1.5805 H 1 UNL1 0.1361 48 H 5.5483 -0.5247 -2.1684 H 1 UNL1 0.1490 49 H 5.1495 -1.9592 -1.2239 H 1 UNL1 0.1484 50 H -4.4913 1.8384 0.9832 H 1 UNL1 0.1411 51 H 6.5899 -2.6280 0.7306 H 1 UNL1 0.1514 52 H 7.7050 0.5833 -1.9062 H 1 UNL1 0.1524 53 H -3.6603 -1.7190 1.2434 H 1 UNL1 0.1775 54 H -6.4540 1.1005 -0.4439 H 1 UNL1 0.1570 55 H 8.9207 -2.7471 1.5675 H 1 UNL1 0.1464 56 H 10.0332 0.4605 -1.0668 H 1 UNL1 0.1470 57 H -3.1010 3.3731 -0.6411 H 1 UNL1 0.1630 58 H 10.6439 -1.2044 0.6696 H 1 UNL1 0.1483 59 H -1.7746 3.2677 -2.8416 H 1 UNL1 0.1627 60 H -5.2930 -3.5643 0.8739 H 1 UNL1 0.1728 61 H -8.0961 -0.7305 -0.8174 H 1 UNL1 0.1725 62 H -1.4286 0.8000 -3.6966 H 1 UNL1 0.1762 @BOND 1 62 30 1 2 59 27 1 3 30 27 ar 4 30 1 ar 5 27 25 ar 6 48 14 1 7 52 20 1 8 1 18 ar 9 40 10 1 10 35 7 1 11 49 14 1 12 20 24 ar 13 20 15 ar 14 14 15 1 15 14 12 1 16 25 18 ar 17 25 57 1 18 56 24 1 19 61 29 1 20 24 26 ar 21 18 16 1 22 15 19 ar 23 34 7 1 24 10 41 1 25 10 12 1 26 10 4 1 27 7 4 1 28 7 9 1 29 54 22 1 30 29 22 ar 31 29 31 ar 32 2 31 1 33 12 45 1 34 12 44 1 35 22 17 ar 36 39 9 1 37 31 28 ar 38 4 6 1 39 26 58 1 40 26 23 ar 41 19 51 1 42 19 23 ar 43 9 38 1 44 9 5 1 45 17 16 1 46 17 21 ar 47 28 21 ar 48 28 60 1 49 16 50 1 50 16 3 1 51 21 53 1 52 23 55 1 53 43 11 1 54 6 33 1 55 6 32 1 56 6 8 1 57 47 13 1 58 3 13 1 59 5 11 1 60 5 8 1 61 11 13 1 62 11 42 1 63 13 46 1 64 8 37 1 65 8 36 1