@MOLECULE 3-(b,b-diphenylethyl)-5-(b-piperidinoethyl)-1,2,4-oxadiazole 54 57 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.7218 2.9626 0.7652 O.2 1 UNL1111111111 -0.0201 2 N 4.2408 0.0958 -0.0399 N.3 1 UNL1111111111 -0.4235 3 N 0.1122 1.6771 -0.9500 N.ar 1 UNL1111111111 -0.4548 4 N -0.6523 2.9515 0.7451 N.ar 1 UNL1111111111 -0.2732 5 C 4.8094 -0.7042 1.0739 C.3 1 UNL1111111111 -0.1001 6 C 4.3706 -0.6281 -1.3300 C.3 1 UNL1111111111 -0.1018 7 C 6.3099 -0.9415 0.8184 C.3 1 UNL1111111111 -0.2764 8 C 5.8622 -0.8538 -1.6376 C.3 1 UNL1111111111 -0.2758 9 C 6.5176 -1.6668 -0.5157 C.3 1 UNL1111111111 -0.2651 10 C 2.8290 0.4492 0.2245 C.3 1 UNL1111111111 -0.1098 11 C 2.5813 1.8547 -0.3889 C.3 1 UNL1111111111 -0.2908 12 C -2.8269 0.6117 0.3787 C.3 1 UNL1111111111 -0.1267 13 C 1.1481 2.1464 -0.2802 C.ar 1 UNL1111111111 0.2384 14 C -2.3959 1.7208 -0.6150 C.3 1 UNL1111111111 -0.2612 15 C -1.0269 2.1673 -0.2667 C.ar 1 UNL1111111111 0.2395 16 C -1.7325 -0.4181 0.5335 C.ar 1 UNL1111111111 -0.0060 17 C -4.1070 -0.0719 -0.0230 C.ar 1 UNL1111111111 0.0065 18 C -1.3154 -1.1964 -0.5481 C.ar 1 UNL1111111111 -0.1341 19 C -4.9777 -0.4905 0.9892 C.ar 1 UNL1111111111 -0.1646 20 C -1.1027 -0.5638 1.7715 C.ar 1 UNL1111111111 -0.1671 21 C -4.4314 -0.3288 -1.3551 C.ar 1 UNL1111111111 -0.1675 22 C -0.2627 -2.0958 -0.3977 C.ar 1 UNL1111111111 -0.1397 23 C -6.1558 -1.1593 0.6685 C.ar 1 UNL1111111111 -0.1352 24 C -0.0517 -1.4662 1.9203 C.ar 1 UNL1111111111 -0.1486 25 C -5.6125 -0.9964 -1.6743 C.ar 1 UNL1111111111 -0.1353 26 C 0.3735 -2.2294 0.8351 C.ar 1 UNL1111111111 -0.1635 27 C -6.4763 -1.4130 -0.6645 C.ar 1 UNL1111111111 -0.1615 28 H 4.6840 -0.1237 2.0142 H 1 UNL1111111111 0.1353 29 H 4.2897 -1.6760 1.2099 H 1 UNL1111111111 0.1125 30 H 3.8309 -1.5992 -1.3302 H 1 UNL1111111111 0.1145 31 H 3.9150 -0.0014 -2.1273 H 1 UNL1111111111 0.1365 32 H 6.7454 -1.5196 1.6511 H 1 UNL1111111111 0.1298 33 H 6.8371 0.0325 0.8010 H 1 UNL1111111111 0.1509 34 H 6.3698 0.1257 -1.7369 H 1 UNL1111111111 0.1506 35 H 5.9734 -1.3651 -2.6089 H 1 UNL1111111111 0.1300 36 H 6.0855 -2.6832 -0.4733 H 1 UNL1111111111 0.1337 37 H 7.5956 -1.8006 -0.7167 H 1 UNL1111111111 0.1323 38 H 2.6320 0.4911 1.3173 H 1 UNL1111111111 0.1434 39 H 2.1033 -0.2842 -0.1955 H 1 UNL1111111111 0.1437 40 H 3.2154 2.6071 0.1288 H 1 UNL1111111111 0.1870 41 H 2.9157 1.8709 -1.4517 H 1 UNL1111111111 0.1911 42 H -2.9902 1.1228 1.3699 H 1 UNL1111111111 0.1675 43 H -2.4100 1.3449 -1.6628 H 1 UNL1111111111 0.1803 44 H -3.1202 2.5623 -0.5764 H 1 UNL1111111111 0.1756 45 H -1.8021 -1.0902 -1.5160 H 1 UNL1111111111 0.1560 46 H -4.7318 -0.3023 2.0328 H 1 UNL1111111111 0.1538 47 H -1.4222 0.0350 2.6227 H 1 UNL1111111111 0.1551 48 H -3.7647 -0.0172 -2.1573 H 1 UNL1111111111 0.1530 49 H 0.0630 -2.6920 -1.2477 H 1 UNL1111111111 0.1503 50 H -6.8273 -1.4862 1.4599 H 1 UNL1111111111 0.1472 51 H 0.4349 -1.5743 2.8873 H 1 UNL1111111111 0.1485 52 H -5.8579 -1.1938 -2.7158 H 1 UNL1111111111 0.1459 53 H 1.1940 -2.9329 0.9517 H 1 UNL1111111111 0.1464 54 H -7.3964 -1.9356 -0.9136 H 1 UNL1111111111 0.1470 @BOND 1 1 4 ar 2 1 13 ar 3 2 5 1 4 2 6 1 5 2 10 1 6 3 13 ar 7 3 15 ar 8 4 15 ar 9 5 7 1 10 5 28 1 11 5 29 1 12 6 8 1 13 6 30 1 14 6 31 1 15 7 9 1 16 7 32 1 17 7 33 1 18 8 9 1 19 8 34 1 20 8 35 1 21 9 36 1 22 9 37 1 23 10 11 1 24 10 38 1 25 10 39 1 26 11 13 1 27 11 40 1 28 11 41 1 29 12 14 1 30 12 16 1 31 12 17 1 32 12 42 1 33 14 15 1 34 14 43 1 35 14 44 1 36 16 18 ar 37 16 20 ar 38 17 19 ar 39 17 21 ar 40 18 22 ar 41 18 45 1 42 19 23 ar 43 19 46 1 44 20 24 ar 45 20 47 1 46 21 25 ar 47 21 48 1 48 22 26 ar 49 22 49 1 50 23 27 ar 51 23 50 1 52 24 26 ar 53 24 51 1 54 25 27 ar 55 25 52 1 56 26 53 1 57 27 54 1