@MOLECULE 2-{1-[2-(2,3-dihydro-1,4-benzodioxin-5-yloxy)ethyl]-3-pyrrolidinyl}-1-(4-fluorophenyl)ethanone 52 55 0 0 0 SMALL GASTEIGER @ATOM 1 F -4.4458 -2.4781 -0.1668 F 1 UNL1111111111 -0.1723 2 O 3.4172 -0.2479 -1.6530 O.3 1 UNL1111111111 -0.3258 3 O -2.4337 3.4033 -0.7216 O.2 1 UNL1111111111 -0.4509 4 O 2.9212 -1.6819 0.5648 O.3 1 UNL1111111111 -0.2523 5 O 0.2875 -2.7338 0.9921 O.3 1 UNL1111111111 -0.3076 6 N 2.2708 1.4511 0.3151 N.3 1 UNL1111111111 -0.4403 7 C 0.0733 1.8861 1.0598 C.3 1 UNL1111111111 -0.0995 8 C 0.9641 1.8806 2.3204 C.3 1 UNL1111111111 -0.3000 9 C 1.0679 2.2193 -0.0789 C.3 1 UNL1111111111 -0.1212 10 C 2.3658 1.4891 1.7993 C.3 1 UNL1111111111 -0.1034 11 C -1.0888 2.8689 1.1500 C.3 1 UNL1111111111 -0.3980 12 C 3.5141 1.8246 -0.3680 C.3 1 UNL1111111111 -0.1454 13 C 3.5277 1.1679 -1.7646 C.3 1 UNL1111111111 -0.0412 14 C -2.1239 2.5658 0.0920 C.2 1 UNL1111111111 0.4795 15 C -2.7424 1.2160 0.0620 C.ar 1 UNL1111111111 -0.1845 16 C 2.1401 -0.6975 -1.4493 C.ar 1 UNL1111111111 0.2372 17 C -3.2046 0.7393 -1.1679 C.ar 1 UNL1111111111 -0.0340 18 C -2.8673 0.4373 1.2152 C.ar 1 UNL1111111111 -0.0608 19 C 1.8955 -1.4896 -0.3173 C.ar 1 UNL1111111111 0.0450 20 C 1.1196 -0.4662 -2.3736 C.ar 1 UNL1111111111 -0.2752 21 C 0.6062 -1.9903 -0.1099 C.ar 1 UNL1111111111 0.1429 22 C -3.7871 -0.5220 -1.2597 C.ar 1 UNL1111111111 -0.2481 23 C -3.4464 -0.8260 1.1496 C.ar 1 UNL1111111111 -0.2380 24 C -3.8933 -1.2774 -0.0929 C.ar 1 UNL1111111111 0.2348 25 C 2.6566 -2.7488 1.4739 C.3 1 UNL1111111111 -0.1187 26 C -0.1471 -1.0108 -2.1624 C.ar 1 UNL1111111111 -0.1066 27 C -0.4196 -1.7686 -1.0283 C.ar 1 UNL1111111111 -0.2409 28 C 1.2467 -2.6129 2.0415 C.3 1 UNL1111111111 -0.0930 29 H -0.3099 0.8475 0.8918 H 1 UNL1111111111 0.1626 30 H 0.5965 1.1669 3.0711 H 1 UNL1111111111 0.1384 31 H 0.9860 2.8700 2.8028 H 1 UNL1111111111 0.1398 32 H 0.7133 1.8424 -1.0601 H 1 UNL1111111111 0.1508 33 H 1.2362 3.3093 -0.1728 H 1 UNL1111111111 0.1193 34 H 2.6501 0.4628 2.1194 H 1 UNL1111111111 0.1479 35 H 3.1386 2.1840 2.1732 H 1 UNL1111111111 0.1141 36 H -0.7310 3.9142 1.0344 H 1 UNL1111111111 0.1758 37 H -1.5563 2.8344 2.1540 H 1 UNL1111111111 0.1672 38 H 3.6642 2.9198 -0.4653 H 1 UNL1111111111 0.1186 39 H 4.3738 1.4223 0.2172 H 1 UNL1111111111 0.1528 40 H 2.7440 1.5794 -2.4212 H 1 UNL1111111111 0.1277 41 H 4.5179 1.2749 -2.2468 H 1 UNL1111111111 0.1408 42 H -3.1072 1.3667 -2.0591 H 1 UNL1111111111 0.1731 43 H -2.5112 0.8126 2.1756 H 1 UNL1111111111 0.1560 44 H 1.3182 0.1248 -3.2633 H 1 UNL1111111111 0.1655 45 H -4.1478 -0.9013 -2.2134 H 1 UNL1111111111 0.1763 46 H -3.5395 -1.4440 2.0402 H 1 UNL1111111111 0.1757 47 H 3.4471 -2.6214 2.2333 H 1 UNL1111111111 0.1518 48 H 2.7968 -3.7068 0.9413 H 1 UNL1111111111 0.1479 49 H -0.9359 -0.8349 -2.8924 H 1 UNL1111111111 0.1531 50 H 1.0940 -1.6358 2.5344 H 1 UNL1111111111 0.1399 51 H 0.9691 -3.4338 2.7240 H 1 UNL1111111111 0.1512 52 H -1.4067 -2.1834 -0.8463 H 1 UNL1111111111 0.1719 @BOND 1 1 24 1 2 2 13 1 3 2 16 1 4 3 14 2 5 4 19 1 6 4 25 1 7 5 21 1 8 5 28 1 9 6 9 1 10 6 10 1 11 6 12 1 12 7 8 1 13 7 9 1 14 7 11 1 15 7 29 1 16 8 10 1 17 8 30 1 18 8 31 1 19 9 32 1 20 9 33 1 21 10 34 1 22 10 35 1 23 11 14 1 24 11 36 1 25 11 37 1 26 12 13 1 27 12 38 1 28 12 39 1 29 13 40 1 30 13 41 1 31 14 15 1 32 15 17 ar 33 15 18 ar 34 16 19 ar 35 16 20 ar 36 17 22 ar 37 17 42 1 38 18 23 ar 39 18 43 1 40 19 21 ar 41 20 26 ar 42 20 44 1 43 21 27 ar 44 22 24 ar 45 22 45 1 46 23 24 ar 47 23 46 1 48 25 28 1 49 25 47 1 50 25 48 1 51 26 27 ar 52 26 49 1 53 27 52 1 54 28 50 1 55 28 51 1