@MOLECULE (2e,5s)-6,6,6-trichloro-3-methoxy-n,5-dimethyl-n-[(1s)-2-phenyl-1-(1,3-thiazol-2-yl)ethyl]-2-hexenamide 51 52 0 0 0 SMALL GASTEIGER @ATOM 1 CL 1.7950 1.9275 0.3291 Cl 1 UNL1111111111 -0.0612 2 CL 4.0436 1.1725 -1.2455 Cl 1 UNL1111111111 -0.1223 3 CL 4.3919 1.7806 1.5092 Cl 1 UNL1111111111 -0.0875 4 S -0.7475 0.9998 -2.1573 S.2 1 UNL1111111111 0.1164 5 O 2.8545 -3.5570 -0.1008 O.2 1 UNL1111111111 -0.3172 6 O -0.5141 -1.3813 1.6204 O.2 1 UNL1111111111 -0.5134 7 N -1.2083 -1.7294 -0.5039 N.am 1 UNL1111111111 -0.5279 8 N -1.6430 1.6584 0.1835 N.ar 1 UNL1111111111 -0.3558 9 C -2.2649 -0.7099 -0.4077 C.3 1 UNL1111111111 0.1129 10 C -3.0470 -0.7719 0.9271 C.3 1 UNL1111111111 -0.3118 11 C 3.0741 -0.4482 0.7175 C.3 1 UNL1111111111 -0.1065 12 C 2.2840 -1.1561 -0.4022 C.3 1 UNL1111111111 -0.3582 13 C -1.6238 0.6357 -0.6273 C.ar 1 UNL1111111111 0.0807 14 C -4.4326 -0.2498 0.7202 C.ar 1 UNL1111111111 0.0003 15 C -0.3752 -1.9937 0.5826 C.2 1 UNL1111111111 0.6228 16 C 1.9334 -2.5601 -0.0371 C.2 1 UNL1111111111 0.3068 17 C -1.3512 -2.6978 -1.5939 C.3 1 UNL1111111111 -0.2227 18 C 3.2922 1.0152 0.3576 C.3 1 UNL1111111111 0.1459 19 C 2.3553 -0.5526 2.0611 C.3 1 UNL1111111111 -0.4673 20 C 0.7141 -2.9642 0.3655 C.2 1 UNL1111111111 -0.4471 21 C -4.7197 1.0935 0.9685 C.ar 1 UNL1111111111 -0.1507 22 C -5.4390 -1.1015 0.2583 C.ar 1 UNL1111111111 -0.1798 23 C -6.0039 1.5842 0.7485 C.ar 1 UNL1111111111 -0.1397 24 C -6.7237 -0.6081 0.0417 C.ar 1 UNL1111111111 -0.1447 25 C -0.4357 2.6118 -1.5782 C.ar 1 UNL1111111111 -0.3219 26 C -0.9789 2.7747 -0.3365 C.ar 1 UNL1111111111 0.0015 27 C -7.0068 0.7352 0.2837 C.ar 1 UNL1111111111 -0.1611 28 C 4.0986 -3.2920 -0.7315 C.3 1 UNL1111111111 -0.1990 29 H -3.0090 -0.8833 -1.2436 H 1 UNL1111111111 0.1614 30 H -2.5052 -0.1946 1.7157 H 1 UNL1111111111 0.2081 31 H -3.0594 -1.8100 1.3154 H 1 UNL1111111111 0.1683 32 H 4.0774 -0.9480 0.8166 H 1 UNL1111111111 0.1682 33 H 2.8377 -1.1369 -1.3649 H 1 UNL1111111111 0.1752 34 H 1.3451 -0.5865 -0.6165 H 1 UNL1111111111 0.1961 35 H -2.1416 -3.4375 -1.3748 H 1 UNL1111111111 0.1392 36 H -0.4057 -3.2456 -1.7605 H 1 UNL1111111111 0.1583 37 H -1.5978 -2.1875 -2.5405 H 1 UNL1111111111 0.1475 38 H 1.3392 -0.1222 2.0418 H 1 UNL1111111111 0.1962 39 H 2.2067 -1.6025 2.3565 H 1 UNL1111111111 0.1764 40 H 2.9010 -0.0671 2.8771 H 1 UNL1111111111 0.1626 41 H 0.4911 -3.9957 0.6194 H 1 UNL1111111111 0.1954 42 H -3.9288 1.7571 1.3279 H 1 UNL1111111111 0.1776 43 H -5.2228 -2.1502 0.0735 H 1 UNL1111111111 0.1455 44 H -6.2229 2.6325 0.9398 H 1 UNL1111111111 0.1470 45 H -7.5067 -1.2719 -0.3161 H 1 UNL1111111111 0.1420 46 H 0.1167 3.3309 -2.1551 H 1 UNL1111111111 0.1897 47 H -0.9527 3.6629 0.2864 H 1 UNL1111111111 0.1856 48 H -8.0091 1.1192 0.1120 H 1 UNL1111111111 0.1433 49 H 3.9611 -2.9810 -1.7713 H 1 UNL1111111111 0.1344 50 H 4.6827 -2.5604 -0.1653 H 1 UNL1111111111 0.1351 51 H 4.5862 -4.2771 -0.6915 H 1 UNL1111111111 0.1553 @BOND 1 1 18 1 2 2 18 1 3 3 18 1 4 4 13 ar 5 4 25 ar 6 5 16 1 7 5 28 1 8 6 15 2 9 7 9 1 10 7 15 am 11 7 17 1 12 8 13 ar 13 8 26 ar 14 9 10 1 15 9 13 1 16 9 29 1 17 10 14 1 18 10 30 1 19 10 31 1 20 11 12 1 21 11 18 1 22 11 19 1 23 11 32 1 24 12 16 1 25 12 33 1 26 12 34 1 27 14 21 ar 28 14 22 ar 29 15 20 1 30 16 20 2 31 17 35 1 32 17 36 1 33 17 37 1 34 19 38 1 35 19 39 1 36 19 40 1 37 20 41 1 38 21 23 ar 39 21 42 1 40 22 24 ar 41 22 43 1 42 23 27 ar 43 23 44 1 44 24 27 ar 45 24 45 1 46 25 26 ar 47 25 46 1 48 26 47 1 49 27 48 1 50 28 49 1 51 28 50 1 52 28 51 1