@MOLECULE 4-{[4,5-bis(4-chlorophenyl)-2-(2-isopropoxy-4-methoxyphenyl)-4,5-dihydro-1h-imidazol-1-yl]carbonyl}-2-piperazinone 70 74 0 0 0 SMALL GASTEIGER @ATOM 1 CL -7.0893 1.1404 1.2720 Cl 1 UNL1111111111 -0.0946 2 CL 1.7145 -6.5746 -1.0224 Cl 1 UNL1111111111 -0.0952 3 O -1.9135 1.1747 -1.8078 O.2 1 UNL1111111111 -0.5138 4 O 2.7867 -0.0923 0.9780 O.3 1 UNL1111111111 -0.3626 5 O -0.0846 3.6544 -4.7799 O.2 1 UNL1111111111 -0.5321 6 O 3.5362 4.5497 2.2037 O.3 1 UNL1111111111 -0.3066 7 N -0.6529 0.2218 -0.1841 N.am 1 UNL1111111111 -0.5767 8 N 0.0104 -0.7631 1.7565 N.2 1 UNL1111111111 -0.4495 9 N 0.2207 2.0240 -1.5171 N.am 1 UNL1111111111 -0.4658 10 N 1.1024 1.8373 -4.2443 N.am 1 UNL1111111111 -0.5979 11 C -1.6294 -0.8962 -0.0186 C.3 1 UNL1111111111 0.0567 12 C -0.9614 -1.7051 1.1663 C.3 1 UNL1111111111 0.0141 13 C 0.1673 0.2752 0.9928 C.2 1 UNL1111111111 0.4358 14 C -3.0009 -0.3886 0.3313 C.ar 1 UNL1111111111 -0.0656 15 C -0.2694 -2.9296 0.6294 C.ar 1 UNL1111111111 -0.0255 16 C -0.8530 1.1386 -1.2210 C.2 1 UNL1111111111 0.7122 17 C 1.0595 1.3918 1.2643 C.ar 1 UNL1111111111 -0.2584 18 C 1.5075 1.3962 -1.8557 C.3 1 UNL1111111111 -0.1094 19 C -0.1305 3.1014 -2.4565 C.3 1 UNL1111111111 -0.1639 20 C -3.2592 0.1848 1.5783 C.ar 1 UNL1111111111 -0.1237 21 C -4.0114 -0.4676 -0.6308 C.ar 1 UNL1111111111 -0.0862 22 C 1.4807 0.8022 -3.2833 C.3 1 UNL1111111111 -0.1001 23 C 0.8675 -2.8033 -0.1742 C.ar 1 UNL1111111111 -0.1167 24 C -0.7833 -4.1932 0.9255 C.ar 1 UNL1111111111 -0.1288 25 C 2.4492 1.1623 1.3231 C.ar 1 UNL1111111111 0.3695 26 C 0.2667 2.8826 -3.9095 C.2 1 UNL1111111111 0.5633 27 C 0.5671 2.6781 1.5060 C.ar 1 UNL1111111111 0.0477 28 C -4.5323 0.6635 1.8794 C.ar 1 UNL1111111111 -0.1841 29 C -5.2900 0.0063 -0.3438 C.ar 1 UNL1111111111 -0.1756 30 C 1.4892 -3.9338 -0.6972 C.ar 1 UNL1111111111 -0.1835 31 C -0.1683 -5.3355 0.4140 C.ar 1 UNL1111111111 -0.1719 32 C -5.5199 0.5580 0.9092 C.ar 1 UNL1111111111 0.0403 33 C 3.3447 2.1858 1.6405 C.ar 1 UNL1111111111 -0.4712 34 C 1.4315 3.7146 1.8161 C.ar 1 UNL1111111111 -0.3336 35 C 0.9535 -5.1774 -0.3879 C.ar 1 UNL1111111111 0.0275 36 C 2.8125 3.4517 1.8868 C.ar 1 UNL1111111111 0.3474 37 C 4.1069 -0.5861 1.2732 C.3 1 UNL1111111111 0.1723 38 C 4.9743 -0.3405 0.0445 C.3 1 UNL1111111111 -0.4902 39 C 3.8526 -2.0658 1.5379 C.3 1 UNL1111111111 -0.4787 40 C 4.9467 4.4047 2.3102 C.3 1 UNL1111111111 -0.2046 41 H -1.6451 -1.4971 -0.9611 H 1 UNL1111111111 0.1682 42 H -1.7081 -1.9708 1.9548 H 1 UNL1111111111 0.1750 43 H 2.2997 2.1759 -1.7661 H 1 UNL1111111111 0.1657 44 H 1.7629 0.6023 -1.1188 H 1 UNL1111111111 0.1692 45 H 0.3736 4.0330 -2.0915 H 1 UNL1111111111 0.1840 46 H -1.2318 3.3141 -2.4231 H 1 UNL1111111111 0.2038 47 H -2.4634 0.2702 2.3210 H 1 UNL1111111111 0.1693 48 H -3.7962 -0.8751 -1.6205 H 1 UNL1111111111 0.1686 49 H 2.4833 0.3988 -3.5470 H 1 UNL1111111111 0.1441 50 H 0.7609 -0.0495 -3.3314 H 1 UNL1111111111 0.1472 51 H 1.2783 -1.8123 -0.3812 H 1 UNL1111111111 0.1711 52 H -1.6642 -4.2946 1.5597 H 1 UNL1111111111 0.1631 53 H -0.5100 2.8609 1.4459 H 1 UNL1111111111 0.1668 54 H 1.3382 1.6879 -5.2143 H 1 UNL1111111111 0.3205 55 H -4.7380 1.1106 2.8507 H 1 UNL1111111111 0.1711 56 H -6.0784 -0.0472 -1.0940 H 1 UNL1111111111 0.1744 57 H 2.3698 -3.8384 -1.3299 H 1 UNL1111111111 0.1677 58 H -0.5649 -6.3241 0.6427 H 1 UNL1111111111 0.1715 59 H 4.4076 2.0005 1.6878 H 1 UNL1111111111 0.1758 60 H 1.0653 4.7196 2.0056 H 1 UNL1111111111 0.1829 61 H 4.5048 -0.0808 2.1789 H 1 UNL1111111111 0.1237 62 H 4.5287 -0.7899 -0.8526 H 1 UNL1111111111 0.1632 63 H 5.9712 -0.7772 0.1697 H 1 UNL1111111111 0.1552 64 H 5.0976 0.7292 -0.1586 H 1 UNL1111111111 0.1525 65 H 3.5197 -2.5950 0.6367 H 1 UNL1111111111 0.1608 66 H 4.7487 -2.5657 1.9167 H 1 UNL1111111111 0.1552 67 H 3.0496 -2.1942 2.2830 H 1 UNL1111111111 0.1799 68 H 5.2087 3.7011 3.1064 H 1 UNL1111111111 0.1371 69 H 5.3822 4.1106 1.3505 H 1 UNL1111111111 0.1357 70 H 5.2633 5.4223 2.5794 H 1 UNL1111111111 0.1561 @BOND 1 1 32 1 2 2 35 1 3 3 16 2 4 4 25 1 5 4 37 1 6 5 26 2 7 6 36 1 8 6 40 1 9 7 11 1 10 7 13 1 11 7 16 am 12 8 12 1 13 8 13 2 14 9 16 am 15 9 18 1 16 9 19 1 17 10 22 1 18 10 26 am 19 10 54 1 20 11 12 1 21 11 14 1 22 11 41 1 23 12 15 1 24 12 42 1 25 13 17 1 26 14 20 ar 27 14 21 ar 28 15 23 ar 29 15 24 ar 30 17 25 ar 31 17 27 ar 32 18 22 1 33 18 43 1 34 18 44 1 35 19 26 1 36 19 45 1 37 19 46 1 38 20 28 ar 39 20 47 1 40 21 29 ar 41 21 48 1 42 22 49 1 43 22 50 1 44 23 30 ar 45 23 51 1 46 24 31 ar 47 24 52 1 48 25 33 ar 49 27 34 ar 50 27 53 1 51 28 32 ar 52 28 55 1 53 29 32 ar 54 29 56 1 55 30 35 ar 56 30 57 1 57 31 35 ar 58 31 58 1 59 33 36 ar 60 33 59 1 61 34 36 ar 62 34 60 1 63 37 38 1 64 37 39 1 65 37 61 1 66 38 62 1 67 38 63 1 68 38 64 1 69 39 65 1 70 39 66 1 71 39 67 1 72 40 68 1 73 40 69 1 74 40 70 1