@MOLECULE 4-({4-methoxy-6-[2-(4-morpholinyl)ethoxy]-1,3,5-triazin-2-yl}amino)-2-(3-methylbutoxy)benzonitrile 62 64 0 0 0 SMALL GASTEIGER @ATOM 1 C 8.6660 -3.8447 -0.7441 C.3 1 UNL111111111 -0.4543 2 C 7.1724 -3.4978 -0.7228 C.3 1 UNL111111111 -0.0524 3 C 6.3829 -4.6230 -0.0446 C.3 1 UNL111111111 -0.4584 4 C 6.9730 -2.1629 0.0135 C.3 1 UNL111111111 -0.3120 5 C 5.5190 -1.6987 -0.0622 C.3 1 UNL111111111 -0.0387 6 O 5.6287 -0.2993 0.2428 O.3 1 UNL111111111 -0.3251 7 C 2.1410 0.8791 0.1055 C.ar 1 UNL111111111 0.3306 8 C 2.3733 2.2375 0.3554 C.ar 1 UNL111111111 -0.2929 9 C 3.6709 2.6912 0.5511 C.ar 1 UNL111111111 0.0156 10 C 4.7559 1.8123 0.5071 C.ar 1 UNL111111111 -0.2080 11 C 4.5077 0.4427 0.2564 C.ar 1 UNL111111111 0.3426 12 C 3.2148 -0.0332 0.0544 C.ar 1 UNL111111111 -0.4206 13 C 6.0773 2.2714 0.7070 C.1 1 UNL111111111 0.1541 14 N 7.1602 2.6488 0.8711 N.1 1 UNL111111111 -0.2685 15 N 0.8675 0.3114 -0.1013 N.pl3 1 UNL111111111 -0.4456 16 N -1.4058 0.1074 -0.4382 N.ar 1 UNL111111111 -0.6179 17 C -0.3436 0.9575 -0.1977 C.ar 1 UNL111111111 0.5749 18 N -0.4624 2.3121 -0.0692 N.ar 1 UNL111111111 -0.5972 19 C -1.7279 2.7993 -0.1971 C.ar 1 UNL111111111 0.5799 20 N -2.8389 2.0542 -0.4439 N.ar 1 UNL111111111 -0.6813 21 C -2.6152 0.7097 -0.5558 C.ar 1 UNL111111111 0.5936 22 O -1.7987 4.1276 -0.0587 O.3 1 UNL111111111 -0.2227 23 C -3.1150 4.6929 -0.1565 C.3 1 UNL111111111 -0.1944 24 O -3.6212 -0.1279 -0.8035 O.3 1 UNL111111111 -0.2678 25 C -4.9269 0.4766 -0.9990 C.3 1 UNL111111111 -0.0394 26 C -5.7749 -0.7256 -1.4324 C.3 1 UNL111111111 -0.1417 27 N -6.5947 -1.1699 -0.2811 N.3 1 UNL111111111 -0.4142 28 C -7.7411 -1.9962 -0.7347 C.3 1 UNL111111111 -0.1626 29 C -8.5823 -2.3577 0.5048 C.3 1 UNL111111111 -0.0434 30 O -7.7936 -3.0583 1.4472 O.3 1 UNL111111111 -0.3876 31 C -6.6834 -2.2965 1.8863 C.3 1 UNL111111111 -0.0446 32 C -5.7796 -1.9356 0.6944 C.3 1 UNL111111111 -0.1598 33 H 8.8486 -4.7825 -1.2795 H 1 UNL111111111 0.1435 34 H 9.2524 -3.0643 -1.2423 H 1 UNL111111111 0.1477 35 H 9.0659 -3.9624 0.2693 H 1 UNL111111111 0.1483 36 H 6.8166 -3.3899 -1.7765 H 1 UNL111111111 0.1306 37 H 5.3038 -4.4483 -0.0909 H 1 UNL111111111 0.1380 38 H 6.5772 -5.5878 -0.5266 H 1 UNL111111111 0.1453 39 H 6.6583 -4.7263 1.0110 H 1 UNL111111111 0.1490 40 H 7.2962 -2.2460 1.0682 H 1 UNL111111111 0.1568 41 H 7.6312 -1.3836 -0.4284 H 1 UNL111111111 0.1675 42 H 5.0888 -1.8133 -1.0718 H 1 UNL111111111 0.1323 43 H 4.8782 -2.1851 0.6917 H 1 UNL111111111 0.1315 44 H 1.5491 2.9571 0.3998 H 1 UNL111111111 0.2196 45 H 3.8476 3.7537 0.7435 H 1 UNL111111111 0.1656 46 H 3.0352 -1.0841 -0.1388 H 1 UNL111111111 0.1755 47 H 0.8235 -0.7098 -0.2249 H 1 UNL111111111 0.3427 48 H -3.5544 4.4913 -1.1393 H 1 UNL111111111 0.1527 49 H -3.7604 4.3079 0.6406 H 1 UNL111111111 0.1532 50 H -2.8990 5.7608 -0.0223 H 1 UNL111111111 0.1555 51 H -5.2584 0.9274 -0.0456 H 1 UNL111111111 0.1688 52 H -4.8588 1.2561 -1.7750 H 1 UNL111111111 0.1482 53 H -6.4495 -0.4125 -2.2599 H 1 UNL111111111 0.1499 54 H -5.1171 -1.5268 -1.8441 H 1 UNL111111111 0.1486 55 H -8.3537 -1.4006 -1.4428 H 1 UNL111111111 0.1392 56 H -7.4247 -2.9221 -1.2589 H 1 UNL111111111 0.1279 57 H -9.0137 -1.4575 0.9771 H 1 UNL111111111 0.1297 58 H -9.3824 -3.0793 0.2651 H 1 UNL111111111 0.1368 59 H -7.0380 -1.3950 2.4158 H 1 UNL111111111 0.1294 60 H -6.1827 -2.9785 2.5954 H 1 UNL111111111 0.1394 61 H -5.3377 -2.8563 0.2582 H 1 UNL111111111 0.1314 62 H -4.9340 -1.2980 1.0327 H 1 UNL111111111 0.1555 @BOND 1 1 33 1 2 1 34 1 3 1 35 1 4 2 1 1 5 2 36 1 6 3 2 1 7 3 37 1 8 3 38 1 9 3 39 1 10 4 2 1 11 4 40 1 12 4 41 1 13 5 4 1 14 5 42 1 15 5 43 1 16 6 5 1 17 7 12 ar 18 8 9 ar 19 8 7 ar 20 8 44 1 21 9 10 ar 22 9 45 1 23 10 13 1 24 10 11 ar 25 11 6 1 26 12 11 ar 27 12 46 1 28 13 14 3 29 15 17 1 30 15 7 1 31 15 47 1 32 16 21 ar 33 16 17 ar 34 17 18 ar 35 18 19 ar 36 19 22 1 37 20 19 ar 38 21 20 ar 39 22 23 1 40 23 48 1 41 23 49 1 42 23 50 1 43 24 21 1 44 25 24 1 45 25 51 1 46 25 52 1 47 26 25 1 48 26 53 1 49 26 54 1 50 27 32 1 51 27 26 1 52 28 27 1 53 28 55 1 54 28 56 1 55 29 30 1 56 29 28 1 57 29 57 1 58 29 58 1 59 30 31 1 60 31 32 1 61 31 59 1 62 31 60 1 63 32 61 1 64 32 62 1