@MOLECULE 5-{[(3s,4r)-4-(4-fluorophenyl)-3-piperidinyl]methoxy}-1h-isoindol-1-one 44 47 0 0 0 SMALL GASTEIGER @ATOM 1 F -3.9112 -4.2922 -0.6436 F 1 UNL111111111 -0.1706 2 C -3.6885 -3.0162 -0.3668 C.ar 1 UNL111111111 0.1922 3 C -3.5295 -2.1227 -1.4252 C.ar 1 UNL111111111 -0.2033 4 C -3.2955 -0.7851 -1.1215 C.ar 1 UNL111111111 -0.1265 5 C -3.6232 -2.6242 0.9687 C.ar 1 UNL111111111 -0.2079 6 C -3.3910 -1.2795 1.2455 C.ar 1 UNL111111111 -0.1341 7 C -3.2248 -0.3583 0.2079 C.ar 1 UNL111111111 -0.0508 8 C -2.9701 1.0862 0.5388 C.3 1 UNL111111111 -0.1179 9 C -4.1067 1.9661 -0.0143 C.3 1 UNL111111111 -0.3223 10 C -3.8195 3.4483 0.2930 C.3 1 UNL111111111 -0.1086 11 N -2.5140 3.9051 -0.2224 N.3 1 UNL111111111 -0.5214 12 C -1.4171 3.0606 0.2832 C.3 1 UNL111111111 -0.1145 13 C -1.6172 1.5596 -0.0363 C.3 1 UNL111111111 -0.1803 14 C -0.4761 0.7348 0.5664 C.3 1 UNL111111111 -0.0587 15 O 0.6584 1.1336 -0.2141 O.3 1 UNL111111111 -0.3347 16 C 1.8375 0.5259 0.0367 C.ar 1 UNL111111111 0.2936 17 C 2.8718 1.0138 -0.8125 C.ar 1 UNL111111111 -0.2175 18 C 2.0558 -0.4570 0.9972 C.ar 1 UNL111111111 -0.3225 19 C 3.3420 -1.0044 1.1529 C.ar 1 UNL111111111 0.0118 20 C 4.3471 -0.5416 0.3406 C.ar 1 UNL111111111 -0.2648 21 C 5.7977 -0.8996 0.2447 C.2 1 UNL111111111 0.5501 22 O 6.4355 -1.6861 0.8717 O.2 1 UNL111111111 -0.3495 23 C 4.1083 0.4618 -0.6369 C.ar 1 UNL111111111 -0.0223 24 C 5.4267 0.6926 -1.3147 C.2 1 UNL111111111 0.1139 25 N 6.3656 -0.0587 -0.8316 N.am 1 UNL111111111 -0.4243 26 H -3.5852 -2.4573 -2.4600 H 1 UNL111111111 0.1764 27 H -3.1662 -0.0674 -1.9316 H 1 UNL111111111 0.1570 28 H -3.7512 -3.3443 1.7748 H 1 UNL111111111 0.1733 29 H -3.3433 -0.9480 2.2826 H 1 UNL111111111 0.1562 30 H -2.9421 1.2217 1.6508 H 1 UNL111111111 0.1487 31 H -4.2210 1.8172 -1.1028 H 1 UNL111111111 0.1456 32 H -5.0709 1.6621 0.4323 H 1 UNL111111111 0.1513 33 H -4.6110 4.0955 -0.1420 H 1 UNL111111111 0.1403 34 H -3.8383 3.6258 1.3910 H 1 UNL111111111 0.1447 35 H -2.5146 3.9241 -1.2411 H 1 UNL111111111 0.2527 36 H -0.4614 3.4218 -0.1577 H 1 UNL111111111 0.1530 37 H -1.3339 3.2188 1.3803 H 1 UNL111111111 0.1452 38 H -1.6112 1.4235 -1.1446 H 1 UNL111111111 0.1589 39 H -0.2885 0.9741 1.6265 H 1 UNL111111111 0.1352 40 H -0.6424 -0.3514 0.4409 H 1 UNL111111111 0.1458 41 H 2.6524 1.7811 -1.5493 H 1 UNL111111111 0.1826 42 H 1.2517 -0.8168 1.6315 H 1 UNL111111111 0.1729 43 H 3.5272 -1.7768 1.9021 H 1 UNL111111111 0.1684 44 H 5.5639 1.4092 -2.1168 H 1 UNL111111111 0.1827 @BOND 1 1 2 1 2 2 3 ar 3 3 4 ar 4 3 26 1 5 4 27 1 6 5 6 ar 7 5 2 ar 8 5 28 1 9 6 7 ar 10 6 29 1 11 7 8 1 12 7 4 ar 13 8 9 1 14 8 13 1 15 8 30 1 16 9 10 1 17 9 31 1 18 9 32 1 19 10 11 1 20 10 33 1 21 10 34 1 22 11 35 1 23 12 11 1 24 12 36 1 25 12 37 1 26 13 12 1 27 13 38 1 28 14 13 1 29 14 39 1 30 14 40 1 31 15 14 1 32 16 15 1 33 16 17 ar 34 17 41 1 35 18 16 ar 36 18 42 1 37 19 18 ar 38 19 20 ar 39 19 43 1 40 20 21 1 41 20 23 ar 42 21 25 1 43 22 21 2 44 23 17 ar 45 23 24 1 46 24 44 1 47 25 24 2