@MOLECULE 2-{3-[(5e)-5-{[(2,3-dichlorophenyl)carbamoyl]imino}-3-(2-thienyl)-2,5-dihydro-1h-pyrazol-1-yl]phenyl}acetamide 49 52 0 0 0 SMALL GASTEIGER @ATOM 1 C -3.8988 -2.0140 -1.1923 C.ar 1 UNL111111111 -0.2231 2 C -5.1443 -2.4022 -1.6680 C.ar 1 UNL111111111 -0.0757 3 C -6.2994 -1.7003 -1.3196 C.ar 1 UNL111111111 -0.2172 4 C -6.1748 -0.6047 -0.4773 C.ar 1 UNL111111111 0.0483 5 C -4.9437 -0.2003 0.0149 C.ar 1 UNL111111111 -0.1441 6 C -3.7730 -0.8994 -0.3431 C.ar 1 UNL111111111 0.2430 7 C 2.9132 -1.9862 0.3801 C.ar 1 UNL111111111 0.2233 8 C 1.5724 -2.0962 0.1389 C.ar 1 UNL111111111 -0.3446 9 C 0.9244 -0.8848 0.6323 C.ar 1 UNL111111111 0.4688 10 N 1.9528 -0.1024 1.2780 N.ar 1 UNL111111111 -0.2627 11 N 3.2139 -0.6966 0.9190 N.ar 1 UNL111111111 -0.3463 12 C 1.9325 1.3295 1.1702 C.ar 1 UNL111111111 0.1653 13 C 2.9137 2.0387 0.4722 C.ar 1 UNL111111111 -0.2338 14 C 2.8561 3.4317 0.4499 C.ar 1 UNL111111111 0.0286 15 C 1.8290 4.1046 1.1134 C.ar 1 UNL111111111 -0.1767 16 C 0.8549 3.3849 1.8024 C.ar 1 UNL111111111 -0.1121 17 C 0.8975 1.9947 1.8402 C.ar 1 UNL111111111 -0.1535 18 N -0.2984 -0.4414 0.6381 N.am 1 UNL111111111 -0.6313 19 C -1.3599 -1.2015 0.0998 C.2 1 UNL111111111 0.7359 20 O -1.2745 -2.3311 -0.3316 O.2 1 UNL111111111 -0.5458 21 N -2.5358 -0.4475 0.1309 N.am 1 UNL111111111 -0.5246 22 C 6.1210 -4.0551 -0.4805 C.ar 1 UNL111111111 -0.2631 23 S 5.5896 -2.4171 -0.3158 S.2 1 UNL111111111 0.3000 24 C 3.9687 -2.9116 0.1057 C.ar 1 UNL111111111 -0.2438 25 C 3.8681 -4.2815 0.0988 C.ar 1 UNL111111111 -0.0955 26 C 5.0991 -4.9300 -0.2341 C.ar 1 UNL111111111 -0.1791 27 C 3.8803 4.2034 -0.3204 C.3 1 UNL111111111 -0.3844 28 C 3.2875 4.7270 -1.6151 C.2 1 UNL111111111 0.6029 29 O 3.2216 5.9054 -1.8933 O.2 1 UNL111111111 -0.5229 30 N 2.8484 3.7716 -2.5132 N.am 1 UNL111111111 -0.6881 31 CL -4.8525 1.1404 1.0612 Cl 1 UNL111111111 -0.0362 32 CL -7.5918 0.2445 -0.0498 Cl 1 UNL111111111 -0.0502 33 H -3.0108 -2.5850 -1.4851 H 1 UNL111111111 0.2083 34 H -5.2203 -3.2685 -2.3283 H 1 UNL111111111 0.1616 35 H -7.2698 -2.0098 -1.7042 H 1 UNL111111111 0.1762 36 H 1.0291 -2.8928 -0.3423 H 1 UNL111111111 0.2224 37 H 3.8479 -0.6521 1.7238 H 1 UNL111111111 0.3141 38 H 3.7083 1.5102 -0.0524 H 1 UNL111111111 0.1753 39 H 1.7834 5.1933 1.0807 H 1 UNL111111111 0.1676 40 H 0.0498 3.9138 2.3144 H 1 UNL111111111 0.1612 41 H 0.1293 1.4246 2.3684 H 1 UNL111111111 0.1904 42 H -2.4803 0.4829 0.5563 H 1 UNL111111111 0.3454 43 H 7.1332 -4.3039 -0.7512 H 1 UNL111111111 0.1800 44 H 2.9620 -4.8330 0.3193 H 1 UNL111111111 0.1770 45 H 5.1847 -6.0067 -0.2789 H 1 UNL111111111 0.1708 46 H 4.2544 5.0701 0.2750 H 1 UNL111111111 0.1922 47 H 4.7857 3.5985 -0.5369 H 1 UNL111111111 0.1761 48 H 2.7773 2.8095 -2.2621 H 1 UNL111111111 0.3066 49 H 2.4090 4.0547 -3.3673 H 1 UNL111111111 0.3135 @BOND 1 1 2 ar 2 1 6 ar 3 1 33 1 4 2 3 ar 5 2 34 1 6 3 4 ar 7 3 35 1 8 4 5 ar 9 4 32 1 10 5 6 ar 11 5 31 1 12 6 21 1 13 7 8 ar 14 7 11 ar 15 7 24 1 16 8 9 ar 17 8 36 1 18 9 10 ar 19 9 18 2 20 10 11 ar 21 10 12 1 22 11 37 1 23 12 13 ar 24 12 17 ar 25 13 14 ar 26 13 38 1 27 14 15 ar 28 14 27 1 29 15 16 ar 30 15 39 1 31 16 17 ar 32 16 40 1 33 17 41 1 34 18 19 1 35 19 20 2 36 19 21 am 37 21 42 1 38 22 23 ar 39 22 26 ar 40 22 43 1 41 23 24 ar 42 24 25 ar 43 25 26 ar 44 25 44 1 45 26 45 1 46 27 28 1 47 27 46 1 48 27 47 1 49 28 29 2 50 28 30 am 51 30 48 1 52 30 49 1