@MOLECULE 4-[(2,6-difluorobenzoyl)amino]-n-[(3s)-3-piperidinyl]-1h-pyrazole-3-carboxamide 42 44 0 0 0 SMALL GASTEIGER @ATOM 1 C 6.4860 1.8629 -0.0709 C.3 1 UNL1111111111 -0.1102 2 C 6.1122 1.3410 1.3314 C.3 1 UNL1111111111 -0.3142 3 C 5.1830 0.1289 1.2138 C.3 1 UNL1111111111 -0.2989 4 C 3.9477 0.5041 0.3710 C.3 1 UNL1111111111 0.0561 5 N 3.1047 -0.6793 0.1784 N.am 1 UNL1111111111 -0.5827 6 C 1.7391 -0.5565 0.1340 C.2 1 UNL1111111111 0.6262 7 O 1.1889 0.5261 0.2892 O.2 1 UNL1111111111 -0.5790 8 C 0.9611 -1.7792 -0.1029 C.ar 1 UNL1111111111 -0.1500 9 N 1.4771 -3.0277 -0.2875 N.ar 1 UNL1111111111 -0.2192 10 N 0.4359 -3.8525 -0.4709 N.ar 1 UNL1111111111 -0.1411 11 C -0.7820 -3.1862 -0.4163 C.ar 1 UNL1111111111 -0.1530 12 C -0.4761 -1.8371 -0.1794 C.ar 1 UNL1111111111 0.1438 13 N -1.3060 -0.7351 -0.0429 N.am 1 UNL1111111111 -0.5105 14 C -2.6850 -0.8455 -0.1550 C.2 1 UNL1111111111 0.6106 15 O -3.2273 -1.9117 -0.3382 O.2 1 UNL1111111111 -0.4816 16 C -3.4214 0.4354 -0.0237 C.ar 1 UNL1111111111 -0.2815 17 C -3.3849 1.4254 -1.0075 C.ar 1 UNL1111111111 0.2722 18 F -2.6250 1.2290 -2.0691 F 1 UNL1111111111 -0.1442 19 C -4.1200 2.6060 -0.9131 C.ar 1 UNL1111111111 -0.2645 20 C -4.9288 2.7982 0.2064 C.ar 1 UNL1111111111 -0.0347 21 C -5.0027 1.8361 1.2127 C.ar 1 UNL1111111111 -0.2673 22 C -4.2498 0.6703 1.0761 C.ar 1 UNL1111111111 0.2816 23 F -4.3104 -0.2474 2.0222 F 1 UNL1111111111 -0.1407 24 C 4.3964 1.0522 -1.0176 C.3 1 UNL1111111111 -0.1433 25 N 5.3091 2.2012 -0.8962 N.3 1 UNL1111111111 -0.5190 26 H 7.1268 2.7666 0.0056 H 1 UNL1111111111 0.1364 27 H 7.0831 1.1004 -0.6176 H 1 UNL1111111111 0.1434 28 H 7.0260 1.0701 1.8899 H 1 UNL1111111111 0.1431 29 H 5.6267 2.1415 1.9191 H 1 UNL1111111111 0.1431 30 H 4.8202 3.0105 -0.5141 H 1 UNL1111111111 0.2541 31 H 5.7233 -0.7202 0.7554 H 1 UNL1111111111 0.1437 32 H 4.8672 -0.2155 2.2169 H 1 UNL1111111111 0.1500 33 H 3.3495 1.2938 0.9030 H 1 UNL1111111111 0.1680 34 H 3.5544 -1.5691 0.0207 H 1 UNL1111111111 0.3262 35 H 4.9021 0.2560 -1.6033 H 1 UNL1111111111 0.1473 36 H 3.5069 1.3645 -1.6077 H 1 UNL1111111111 0.1564 37 H -1.7359 -3.6675 -0.5391 H 1 UNL1111111111 0.2157 38 H -4.0677 3.3613 -1.6962 H 1 UNL1111111111 0.1832 39 H -5.5154 3.7150 0.2948 H 1 UNL1111111111 0.1583 40 H -5.6383 1.9918 2.0832 H 1 UNL1111111111 0.1821 41 H 0.6058 -4.8267 -0.6262 H 1 UNL1111111111 0.3314 42 H -0.8293 0.1625 0.1192 H 1 UNL1111111111 0.3628 @BOND 1 1 2 1 2 1 25 1 3 1 26 1 4 1 27 1 5 2 3 1 6 2 28 1 7 2 29 1 8 3 4 1 9 3 31 1 10 3 32 1 11 4 5 1 12 4 24 1 13 4 33 1 14 5 6 am 15 5 34 1 16 6 7 2 17 6 8 1 18 8 9 ar 19 8 12 ar 20 9 10 ar 21 10 11 ar 22 10 41 1 23 11 12 ar 24 11 37 1 25 12 13 1 26 13 14 am 27 13 42 1 28 14 15 2 29 14 16 1 30 16 17 ar 31 16 22 ar 32 17 18 1 33 17 19 ar 34 19 20 ar 35 19 38 1 36 20 21 ar 37 20 39 1 38 21 22 ar 39 21 40 1 40 22 23 1 41 24 25 1 42 24 35 1 43 24 36 1 44 25 30 1