@MOLECULE 4-[(3-chloro-4-{[(2r)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoyl]amino}phenyl)sulfonyl]-n,n-dimethylbenzamide 49 50 0 0 0 SMALL GASTEIGER @ATOM 1 F -6.9456 -2.4028 -0.3324 F 1 UNL1111111111 -0.1861 2 C -5.8557 -1.9682 0.2909 C.3 1 UNL1111111111 0.4803 3 F -6.0954 -2.1087 1.5873 F 1 UNL1111111111 -0.1692 4 F -4.9119 -2.8600 0.0004 F 1 UNL1111111111 -0.1938 5 C -5.4556 -0.5238 -0.1313 C.3 1 UNL1111111111 0.1780 6 O -5.4702 -0.4270 -1.5250 O.3 1 UNL1111111111 -0.5126 7 C -6.4357 0.5166 0.3733 C.3 1 UNL1111111111 -0.4604 8 C -4.0410 -0.2472 0.4305 C.2 1 UNL1111111111 0.5068 9 O -3.6486 -0.7996 1.4257 O.2 1 UNL1111111111 -0.4395 10 N -3.3148 0.6746 -0.3105 N.am 1 UNL1111111111 -0.5498 11 C -1.9997 1.0740 -0.0141 C.ar 1 UNL1111111111 0.2364 12 C -1.4048 0.8499 1.2371 C.ar 1 UNL1111111111 -0.2291 13 C -0.1043 1.2803 1.4806 C.ar 1 UNL1111111111 -0.0259 14 C -1.2433 1.7463 -0.9926 C.ar 1 UNL1111111111 -0.1210 15 CL -1.9088 2.0436 -2.5396 Cl 1 UNL1111111111 -0.0720 16 C 0.0498 2.1829 -0.7518 C.ar 1 UNL1111111111 -0.0424 17 C 0.6271 1.9326 0.4906 C.ar 1 UNL1111111111 -0.4224 18 S 2.2804 2.4696 0.8114 S.O2 1 UNL1111111111 2.2273 19 O 2.6040 3.4561 -0.1975 O.2 1 UNL1111111111 -0.9070 20 O 2.3875 2.7612 2.2253 O.2 1 UNL1111111111 -0.9035 21 C 3.2649 1.0371 0.4926 C.ar 1 UNL1111111111 -0.3701 22 C 3.8078 0.3214 1.5567 C.ar 1 UNL1111111111 -0.0717 23 C 4.5952 -0.8018 1.3066 C.ar 1 UNL1111111111 -0.1535 24 C 3.5039 0.6441 -0.8225 C.ar 1 UNL1111111111 -0.0735 25 C 4.2843 -0.4817 -1.0781 C.ar 1 UNL1111111111 -0.1580 26 C 4.8296 -1.1912 -0.0099 C.ar 1 UNL1111111111 -0.0630 27 C 5.6306 -2.4200 -0.2868 C.2 1 UNL1111111111 0.5418 28 O 5.1085 -3.5145 -0.3730 O.2 1 UNL1111111111 -0.5084 29 N 7.0017 -2.2850 -0.3684 N.am 1 UNL1111111111 -0.4571 30 C 7.7980 -3.4377 -0.7989 C.3 1 UNL1111111111 -0.2282 31 C 7.6429 -0.9812 -0.5322 C.3 1 UNL1111111111 -0.2392 32 H -4.9241 -1.1214 -1.9653 H 1 UNL1111111111 0.3390 33 H -6.4314 0.5996 1.4702 H 1 UNL1111111111 0.1815 34 H -6.2046 1.5125 -0.0368 H 1 UNL1111111111 0.1787 35 H -7.4675 0.2924 0.0575 H 1 UNL1111111111 0.1858 36 H -3.7521 1.0514 -1.1581 H 1 UNL1111111111 0.3426 37 H -1.9561 0.3396 2.0323 H 1 UNL1111111111 0.2028 38 H 0.3275 1.1064 2.4758 H 1 UNL1111111111 0.1788 39 H 0.6003 2.7288 -1.5332 H 1 UNL1111111111 0.1946 40 H 3.6337 0.6320 2.5944 H 1 UNL1111111111 0.1796 41 H 5.0196 -1.3739 2.1314 H 1 UNL1111111111 0.1658 42 H 3.0981 1.2105 -1.6663 H 1 UNL1111111111 0.1672 43 H 4.4618 -0.8072 -2.1022 H 1 UNL1111111111 0.1615 44 H 8.0468 -3.3865 -1.8718 H 1 UNL1111111111 0.1355 45 H 8.7307 -3.4885 -0.2120 H 1 UNL1111111111 0.1444 46 H 7.2383 -4.3798 -0.6241 H 1 UNL1111111111 0.1793 47 H 7.1137 -0.2027 0.0459 H 1 UNL1111111111 0.1544 48 H 8.6793 -1.0211 -0.1497 H 1 UNL1111111111 0.1563 49 H 7.6750 -0.6651 -1.5897 H 1 UNL1111111111 0.1391 @BOND 1 1 2 1 2 2 3 1 3 2 4 1 4 2 5 1 5 5 7 1 6 5 6 1 7 5 8 1 8 6 32 1 9 7 33 1 10 7 34 1 11 7 35 1 12 8 9 2 13 8 10 am 14 10 11 1 15 10 36 1 16 11 12 ar 17 11 14 ar 18 12 13 ar 19 12 37 1 20 13 17 ar 21 13 38 1 22 14 15 1 23 14 16 ar 24 16 17 ar 25 16 39 1 26 17 18 1 27 18 19 2 28 18 20 2 29 18 21 1 30 21 24 ar 31 21 22 ar 32 22 23 ar 33 22 40 1 34 23 26 ar 35 23 41 1 36 24 25 ar 37 24 42 1 38 25 26 ar 39 25 43 1 40 26 27 1 41 27 29 am 42 27 28 2 43 29 30 1 44 29 31 1 45 30 44 1 46 30 45 1 47 30 46 1 48 31 47 1 49 31 48 1 50 31 49 1