@MOLECULE 5-[2-(cyclohexylamino)-4-pyridyl]-4-(2-naphthyl)-2-tetrahydropyran-4-yl-1,2,4-triazol-3-one 66 71 0 0 0 SMALL GASTEIGER @ATOM 1 C 6.1145 -0.6832 1.0314 C.ar 1 UNL1111111111 -0.1479 2 C 4.8881 -0.0877 0.6283 C.ar 1 UNL1111111111 -0.0192 3 C 3.6853 -0.8094 0.7906 C.ar 1 UNL1111111111 0.0226 4 C 3.7251 -2.1165 1.3513 C.ar 1 UNL1111111111 -0.1507 5 C 4.9208 -2.6690 1.7308 C.ar 1 UNL1111111111 -0.1400 6 C 6.1291 -1.9444 1.5692 C.ar 1 UNL1111111111 -0.1517 7 C 2.4570 -0.2222 0.3898 C.ar 1 UNL1111111111 -0.2200 8 C 2.4579 1.0289 -0.1864 C.ar 1 UNL1111111111 0.1964 9 C 3.6634 1.7725 -0.3387 C.ar 1 UNL1111111111 -0.1685 10 C 4.8478 1.2193 0.0660 C.ar 1 UNL1111111111 -0.1222 11 N 1.2587 1.6205 -0.6552 N.ar 1 UNL1111111111 -0.4499 12 C 0.1075 0.9281 -1.1177 C.ar 1 UNL1111111111 0.2080 13 N -0.9433 1.7438 -1.1359 N.ar 1 UNL1111111111 -0.2281 14 N -0.5183 3.0021 -0.7605 N.ar 1 UNL1111111111 -0.3137 15 C 0.8495 2.9540 -0.3432 C.ar 1 UNL1111111111 0.6173 16 O 1.5356 3.8616 0.0415 O.2 1 UNL1111111111 -0.4681 17 C -1.4893 3.8900 -0.0876 C.3 1 UNL1111111111 0.1259 18 C -1.8196 3.4040 1.3376 C.3 1 UNL1111111111 -0.3697 19 C -2.8725 4.3368 1.9406 C.3 1 UNL1111111111 -0.0309 20 O -4.0282 4.3961 1.1269 O.3 1 UNL1111111111 -0.3901 21 C -3.7732 4.8776 -0.1801 C.3 1 UNL1111111111 -0.0371 22 C -2.7823 3.9744 -0.9144 C.3 1 UNL1111111111 -0.3361 23 C 0.0838 -0.4698 -1.5422 C.ar 1 UNL1111111111 0.1119 24 C 1.1071 -0.9962 -2.3317 C.ar 1 UNL1111111111 -0.3187 25 C 1.0388 -2.3547 -2.6702 C.ar 1 UNL1111111111 0.1360 26 N 0.0451 -3.1621 -2.2769 N.ar 1 UNL1111111111 -0.4815 27 C -0.9741 -2.6270 -1.5328 C.ar 1 UNL1111111111 0.4049 28 C -0.9768 -1.2689 -1.1329 C.ar 1 UNL1111111111 -0.3375 29 N -2.0041 -3.5033 -1.2628 N.pl3 1 UNL1111111111 -0.5361 30 C -2.9880 -3.2046 -0.2096 C.3 1 UNL1111111111 0.0984 31 C -4.1509 -4.2113 -0.3253 C.3 1 UNL1111111111 -0.3002 32 C -5.2033 -3.8953 0.7439 C.3 1 UNL1111111111 -0.2583 33 C -4.5855 -3.9447 2.1478 C.3 1 UNL1111111111 -0.2710 34 C -3.4051 -2.9705 2.2564 C.3 1 UNL1111111111 -0.2583 35 C -2.3474 -3.2855 1.1946 C.3 1 UNL1111111111 -0.3150 36 H 7.0374 -0.1200 0.9033 H 1 UNL1111111111 0.1524 37 H 2.7916 -2.6655 1.4667 H 1 UNL1111111111 0.1571 38 H 4.9624 -3.6686 2.1596 H 1 UNL1111111111 0.1501 39 H 7.0638 -2.4077 1.8789 H 1 UNL1111111111 0.1494 40 H 1.5346 -0.7811 0.5410 H 1 UNL1111111111 0.1741 41 H 3.6183 2.7765 -0.7670 H 1 UNL1111111111 0.1875 42 H 5.7807 1.7735 -0.0366 H 1 UNL1111111111 0.1589 43 H -0.9854 4.8972 -0.0455 H 1 UNL1111111111 0.1610 44 H -2.2094 2.3668 1.3020 H 1 UNL1111111111 0.1717 45 H -0.9144 3.3786 1.9697 H 1 UNL1111111111 0.1556 46 H -3.2765 3.9456 2.8930 H 1 UNL1111111111 0.1401 47 H -2.4793 5.3561 2.1016 H 1 UNL1111111111 0.1201 48 H -4.7787 4.8496 -0.6396 H 1 UNL1111111111 0.1399 49 H -3.4249 5.9239 -0.1272 H 1 UNL1111111111 0.1176 50 H -2.5760 4.3465 -1.9340 H 1 UNL1111111111 0.1616 51 H -3.2136 2.9592 -1.0503 H 1 UNL1111111111 0.1822 52 H 1.9338 -0.3802 -2.6698 H 1 UNL1111111111 0.1823 53 H 1.8209 -2.8321 -3.2759 H 1 UNL1111111111 0.1714 54 H -1.7908 -0.8547 -0.5469 H 1 UNL1111111111 0.1865 55 H -1.8547 -4.4804 -1.4900 H 1 UNL1111111111 0.3167 56 H -3.3863 -2.1679 -0.3829 H 1 UNL1111111111 0.1534 57 H -4.5998 -4.1589 -1.3357 H 1 UNL1111111111 0.1502 58 H -3.7853 -5.2472 -0.2038 H 1 UNL1111111111 0.1425 59 H -5.6457 -2.8974 0.5603 H 1 UNL1111111111 0.1407 60 H -6.0405 -4.6143 0.6720 H 1 UNL1111111111 0.1343 61 H -5.3508 -3.7011 2.9073 H 1 UNL1111111111 0.1327 62 H -4.2491 -4.9731 2.3768 H 1 UNL1111111111 0.1373 63 H -3.7612 -1.9284 2.1434 H 1 UNL1111111111 0.1429 64 H -2.9570 -3.0283 3.2657 H 1 UNL1111111111 0.1346 65 H -1.9195 -4.2898 1.3635 H 1 UNL1111111111 0.1443 66 H -1.5004 -2.5780 1.2711 H 1 UNL1111111111 0.1498 @BOND 1 1 2 ar 2 1 6 ar 3 1 36 1 4 2 3 ar 5 2 10 ar 6 3 4 ar 7 3 7 ar 8 4 5 ar 9 4 37 1 10 5 6 ar 11 5 38 1 12 6 39 1 13 7 8 ar 14 7 40 1 15 8 9 ar 16 8 11 1 17 9 10 ar 18 9 41 1 19 10 42 1 20 11 12 ar 21 11 15 ar 22 12 13 ar 23 12 23 1 24 13 14 ar 25 14 15 ar 26 14 17 1 27 15 16 2 28 17 18 1 29 17 22 1 30 17 43 1 31 18 19 1 32 18 44 1 33 18 45 1 34 19 20 1 35 19 46 1 36 19 47 1 37 20 21 1 38 21 22 1 39 21 48 1 40 21 49 1 41 22 50 1 42 22 51 1 43 23 24 ar 44 23 28 ar 45 24 25 ar 46 24 52 1 47 25 26 ar 48 25 53 1 49 26 27 ar 50 27 28 ar 51 27 29 1 52 28 54 1 53 29 30 1 54 29 55 1 55 30 31 1 56 30 35 1 57 30 56 1 58 31 32 1 59 31 57 1 60 31 58 1 61 32 33 1 62 32 59 1 63 32 60 1 64 33 34 1 65 33 61 1 66 33 62 1 67 34 35 1 68 34 63 1 69 34 64 1 70 35 65 1 71 35 66 1