@MOLECULE 4-(cyclohexylamino)-6-(1-piperazinyl)-1,3,5-triazine-2-carbonitrile 42 44 0 0 0 SMALL GASTEIGER @ATOM 1 N -0.8344 1.1727 -0.1927 N.ar 1 UNL111111111 -0.5889 2 C -0.6071 -0.1937 -0.2252 C.ar 1 UNL111111111 0.5765 3 N 0.6427 -0.7603 -0.2324 N.ar 1 UNL111111111 -0.6696 4 C 1.7034 0.1104 -0.2405 C.ar 1 UNL111111111 0.5647 5 N 1.5491 1.4925 -0.1922 N.ar 1 UNL111111111 -0.6001 6 C 0.2783 1.9370 -0.1686 C.ar 1 UNL111111111 0.4501 7 N -1.6575 -1.0501 -0.2783 N.pl3 1 UNL111111111 -0.4919 8 N 2.9580 -0.3883 -0.3274 N.pl3 1 UNL111111111 -0.3626 9 C 0.0899 3.3645 -0.1103 C.1 1 UNL111111111 0.1263 10 C 4.1342 0.4902 -0.3853 C.3 1 UNL111111111 -0.1131 11 C 5.2087 0.0150 0.6230 C.3 1 UNL111111111 -0.1300 12 N 5.5335 -1.4161 0.4854 N.3 1 UNL111111111 -0.5137 13 C 4.3110 -2.2273 0.6255 C.3 1 UNL111111111 -0.1297 14 C 3.2075 -1.8337 -0.3881 C.3 1 UNL111111111 -0.1149 15 N -0.0620 4.5085 -0.0626 N.1 1 UNL111111111 -0.1783 16 C -3.0564 -0.5752 -0.2728 C.3 1 UNL111111111 0.1189 17 C -3.9446 -1.7164 -0.8085 C.3 1 UNL111111111 -0.3057 18 C -5.4084 -1.2605 -0.8158 C.3 1 UNL111111111 -0.2558 19 C -5.8536 -0.8320 0.5886 C.3 1 UNL111111111 -0.2712 20 C -4.9473 0.2807 1.1304 C.3 1 UNL111111111 -0.2536 21 C -3.4844 -0.1722 1.1523 C.3 1 UNL111111111 -0.3023 22 H -1.4772 -2.0441 -0.2063 H 1 UNL111111111 0.3295 23 H 4.5305 0.4779 -1.4256 H 1 UNL111111111 0.1450 24 H 3.8520 1.5499 -0.1644 H 1 UNL111111111 0.1919 25 H 6.1373 0.6104 0.4946 H 1 UNL111111111 0.1480 26 H 4.8596 0.1945 1.6656 H 1 UNL111111111 0.1614 27 H 5.9972 -1.6031 -0.4023 H 1 UNL111111111 0.2520 28 H 4.5730 -3.2991 0.5028 H 1 UNL111111111 0.1461 29 H 3.9323 -2.1103 1.6664 H 1 UNL111111111 0.1605 30 H 2.2735 -2.4077 -0.1727 H 1 UNL111111111 0.1852 31 H 3.5077 -2.0965 -1.4271 H 1 UNL111111111 0.1447 32 H -3.1279 0.3207 -0.9501 H 1 UNL111111111 0.1687 33 H -3.6289 -2.0010 -1.8297 H 1 UNL111111111 0.1454 34 H -3.8360 -2.6214 -0.1828 H 1 UNL111111111 0.1415 35 H -5.5420 -0.4237 -1.5279 H 1 UNL111111111 0.1420 36 H -6.0550 -2.0779 -1.1849 H 1 UNL111111111 0.1320 37 H -6.9037 -0.4881 0.5639 H 1 UNL111111111 0.1309 38 H -5.8351 -1.7004 1.2728 H 1 UNL111111111 0.1357 39 H -5.0513 1.1926 0.5105 H 1 UNL111111111 0.1444 40 H -5.2671 0.5710 2.1481 H 1 UNL111111111 0.1346 41 H -3.3462 -1.0116 1.8550 H 1 UNL111111111 0.1416 42 H -2.8352 0.6497 1.5177 H 1 UNL111111111 0.1635 @BOND 1 1 2 ar 2 1 6 ar 3 2 3 ar 4 2 7 1 5 3 4 ar 6 4 5 ar 7 4 8 1 8 5 6 ar 9 6 9 1 10 7 16 1 11 7 22 1 12 8 10 1 13 8 14 1 14 9 15 3 15 10 11 1 16 10 23 1 17 10 24 1 18 11 12 1 19 11 25 1 20 11 26 1 21 12 13 1 22 12 27 1 23 13 14 1 24 13 28 1 25 13 29 1 26 14 30 1 27 14 31 1 28 16 17 1 29 16 21 1 30 16 32 1 31 17 18 1 32 17 33 1 33 17 34 1 34 18 19 1 35 18 35 1 36 18 36 1 37 19 20 1 38 19 37 1 39 19 38 1 40 20 21 1 41 20 39 1 42 20 40 1 43 21 41 1 44 21 42 1