@MOLECULE 3-cyclohexyl-1-[4-(2-ethoxyphenyl)-1-piperazinyl]-1-propanone 57 59 0 0 0 SMALL GASTEIGER @ATOM 1 O -1.4136 1.8041 1.3125 O.2 1 UNL1111111111 -0.5332 2 O 4.6223 0.8629 -0.1617 O.3 1 UNL1111111111 -0.3093 3 N -0.2395 1.3157 -0.5542 N.am 1 UNL1111111111 -0.4907 4 N 2.2095 -0.1589 -0.3665 N.pl3 1 UNL1111111111 -0.4027 5 C -5.0894 0.2056 -0.1233 C.3 1 UNL1111111111 -0.0946 6 C -6.3414 0.8523 0.4991 C.3 1 UNL1111111111 -0.2770 7 C -5.1286 -1.3169 0.1016 C.3 1 UNL1111111111 -0.2744 8 C -3.8270 0.8235 0.4998 C.3 1 UNL1111111111 -0.2725 9 C -7.6151 0.2554 -0.1125 C.3 1 UNL1111111111 -0.2658 10 C -6.4012 -1.9178 -0.5100 C.3 1 UNL1111111111 -0.2680 11 C -7.6514 -1.2645 0.0939 C.3 1 UNL1111111111 -0.2641 12 C -2.5747 0.4844 -0.3157 C.3 1 UNL1111111111 -0.3575 13 C -1.3797 1.2181 0.2497 C.2 1 UNL1111111111 0.5757 14 C 0.1069 0.2719 -1.5253 C.3 1 UNL1111111111 -0.0791 15 C 0.9635 1.9203 0.0437 C.3 1 UNL1111111111 -0.0794 16 C 0.9900 -0.8255 -0.8705 C.3 1 UNL1111111111 -0.1399 17 C 1.8789 0.8438 0.6758 C.3 1 UNL1111111111 -0.1328 18 C 3.2741 -1.0278 -0.0024 C.ar 1 UNL1111111111 0.0844 19 C 4.5882 -0.4774 0.0417 C.ar 1 UNL1111111111 0.1974 20 C 3.1289 -2.3958 0.2173 C.ar 1 UNL1111111111 -0.1942 21 C 5.6959 -1.2822 0.2739 C.ar 1 UNL1111111111 -0.2767 22 C 4.2455 -3.2047 0.4501 C.ar 1 UNL1111111111 -0.1779 23 C 5.5177 -2.6539 0.4751 C.ar 1 UNL1111111111 -0.1154 24 C 5.8979 1.5101 -0.0854 C.3 1 UNL1111111111 -0.0351 25 C 5.5466 2.9752 -0.3095 C.3 1 UNL1111111111 -0.4520 26 H -5.0948 0.4079 -1.2201 H 1 UNL1111111111 0.1308 27 H -6.3403 0.7000 1.5942 H 1 UNL1111111111 0.1405 28 H -6.3240 1.9458 0.3407 H 1 UNL1111111111 0.1333 29 H -4.2373 -1.7938 -0.3425 H 1 UNL1111111111 0.1268 30 H -5.0896 -1.5393 1.1840 H 1 UNL1111111111 0.1402 31 H -3.7012 0.4884 1.5478 H 1 UNL1111111111 0.1573 32 H -3.9340 1.9255 0.5688 H 1 UNL1111111111 0.1563 33 H -7.6625 0.4904 -1.1919 H 1 UNL1111111111 0.1334 34 H -8.5083 0.7217 0.3413 H 1 UNL1111111111 0.1298 35 H -6.3960 -1.7782 -1.6067 H 1 UNL1111111111 0.1326 36 H -6.4247 -3.0094 -0.3412 H 1 UNL1111111111 0.1275 37 H -7.7133 -1.4967 1.1735 H 1 UNL1111111111 0.1368 38 H -8.5624 -1.6887 -0.3646 H 1 UNL1111111111 0.1277 39 H -2.7317 0.7625 -1.3779 H 1 UNL1111111111 0.1661 40 H -2.3903 -0.6080 -0.2959 H 1 UNL1111111111 0.1612 41 H 0.6783 0.7542 -2.3561 H 1 UNL1111111111 0.1638 42 H -0.7971 -0.1792 -1.9774 H 1 UNL1111111111 0.1374 43 H 1.5119 2.4606 -0.7614 H 1 UNL1111111111 0.1535 44 H 0.6706 2.6705 0.8134 H 1 UNL1111111111 0.1679 45 H 0.4215 -1.3552 -0.0782 H 1 UNL1111111111 0.1261 46 H 1.2804 -1.5730 -1.6402 H 1 UNL1111111111 0.1502 47 H 2.8156 1.3223 1.0376 H 1 UNL1111111111 0.1621 48 H 1.3828 0.3853 1.5578 H 1 UNL1111111111 0.1347 49 H 2.1415 -2.8520 0.2176 H 1 UNL1111111111 0.1552 50 H 6.6984 -0.8686 0.2947 H 1 UNL1111111111 0.1596 51 H 4.1068 -4.2704 0.6153 H 1 UNL1111111111 0.1519 52 H 6.3858 -3.2857 0.6530 H 1 UNL1111111111 0.1489 53 H 6.5545 1.1123 -0.8781 H 1 UNL1111111111 0.1257 54 H 6.3449 1.3318 0.9073 H 1 UNL1111111111 0.1252 55 H 4.9087 3.3608 0.4961 H 1 UNL1111111111 0.1589 56 H 4.9898 3.1055 -1.2484 H 1 UNL1111111111 0.1645 57 H 6.4470 3.5950 -0.3598 H 1 UNL1111111111 0.1488 @BOND 1 1 13 2 2 2 19 1 3 2 24 1 4 3 13 am 5 3 14 1 6 3 15 1 7 4 16 1 8 4 17 1 9 4 18 1 10 5 6 1 11 5 7 1 12 5 8 1 13 5 26 1 14 6 9 1 15 6 27 1 16 6 28 1 17 7 10 1 18 7 29 1 19 7 30 1 20 8 12 1 21 8 31 1 22 8 32 1 23 9 11 1 24 9 33 1 25 9 34 1 26 10 11 1 27 10 35 1 28 10 36 1 29 11 37 1 30 11 38 1 31 12 13 1 32 12 39 1 33 12 40 1 34 14 16 1 35 14 41 1 36 14 42 1 37 15 17 1 38 15 43 1 39 15 44 1 40 16 45 1 41 16 46 1 42 17 47 1 43 17 48 1 44 18 19 ar 45 18 20 ar 46 19 21 ar 47 20 22 ar 48 20 49 1 49 21 23 ar 50 21 50 1 51 22 23 ar 52 22 51 1 53 23 52 1 54 24 25 1 55 24 53 1 56 24 54 1 57 25 55 1 58 25 56 1 59 25 57 1