@MOLECULE 1-(5-(4-chlorophenyl)-4-(4-pyridinyl)-1h-pyrazol-3-yl)-4-methylpiperazine 45 48 0 0 0 SMALL GASTEIGER @ATOM 1 CL -6.5295 -0.0409 -0.1151 Cl 1 UNL1111111111 -0.0857 2 N 2.8306 0.7855 -0.1056 N.pl3 1 UNL1111111111 -0.3897 3 N 5.6186 0.3053 0.2750 N.3 1 UNL1111111111 -0.3947 4 N 1.1171 2.5201 -0.0347 N.ar 1 UNL1111111111 -0.3323 5 N -0.2410 2.5232 -0.0444 N.ar 1 UNL1111111111 -0.1732 6 N 0.1274 -3.8783 0.0330 N.ar 1 UNL1111111111 -0.3859 7 C 3.2976 -0.0808 1.0054 C.3 1 UNL1111111111 -0.1080 8 C 3.8152 1.8613 -0.3736 C.3 1 UNL1111111111 -0.0981 9 C 4.6156 -0.7527 0.5543 C.3 1 UNL1111111111 -0.1201 10 C 5.1358 1.1880 -0.8161 C.3 1 UNL1111111111 -0.1276 11 C 1.5026 1.2052 0.0046 C.ar 1 UNL1111111111 0.2578 12 C 0.3356 0.3589 0.0323 C.ar 1 UNL1111111111 -0.2357 13 C 6.9193 -0.2984 -0.0848 C.3 1 UNL1111111111 -0.2848 14 C -0.7578 1.2450 -0.0017 C.ar 1 UNL1111111111 0.0740 15 C 0.2779 -1.0812 0.0461 C.ar 1 UNL1111111111 0.1130 16 C -2.1807 0.9573 -0.0308 C.ar 1 UNL1111111111 -0.0434 17 C 1.1133 -1.8372 -0.7848 C.ar 1 UNL1111111111 -0.2551 18 C -0.6295 -1.7511 0.8756 C.ar 1 UNL1111111111 -0.2622 19 C -3.0483 1.5571 0.8868 C.ar 1 UNL1111111111 -0.1181 20 C -2.6685 0.0480 -0.9775 C.ar 1 UNL1111111111 -0.0969 21 C 1.0041 -3.2304 -0.7585 C.ar 1 UNL1111111111 0.0587 22 C -0.6717 -3.1483 0.8337 C.ar 1 UNL1111111111 0.0609 23 C -4.4069 1.2530 0.8640 C.ar 1 UNL1111111111 -0.1735 24 C -4.0241 -0.2653 -1.0080 C.ar 1 UNL1111111111 -0.1685 25 C -4.8631 0.3460 -0.0841 C.ar 1 UNL1111111111 0.0438 26 H 2.5332 -0.8554 1.2266 H 1 UNL1111111111 0.1500 27 H 3.4674 0.5010 1.9386 H 1 UNL1111111111 0.1440 28 H 3.9874 2.5050 0.5163 H 1 UNL1111111111 0.1444 29 H 3.4305 2.5151 -1.1864 H 1 UNL1111111111 0.1541 30 H 4.9995 -1.3930 1.3772 H 1 UNL1111111111 0.1421 31 H 4.4218 -1.4090 -0.3206 H 1 UNL1111111111 0.1272 32 H 4.9772 0.6457 -1.7729 H 1 UNL1111111111 0.1276 33 H 5.9007 1.9728 -0.9964 H 1 UNL1111111111 0.1384 34 H 6.8995 -0.9264 -0.9877 H 1 UNL1111111111 0.1196 35 H 7.2763 -0.9108 0.7599 H 1 UNL1111111111 0.1464 36 H 7.6587 0.5059 -0.2336 H 1 UNL1111111111 0.1454 37 H -0.7189 3.3970 -0.1245 H 1 UNL1111111111 0.3332 38 H 1.8315 -1.3404 -1.4353 H 1 UNL1111111111 0.1836 39 H -1.2863 -1.1963 1.5389 H 1 UNL1111111111 0.1705 40 H -2.6600 2.2504 1.6329 H 1 UNL1111111111 0.1624 41 H -1.9799 -0.4194 -1.6854 H 1 UNL1111111111 0.1746 42 H 1.6334 -3.8666 -1.3903 H 1 UNL1111111111 0.1653 43 H -1.3663 -3.7189 1.4599 H 1 UNL1111111111 0.1655 44 H -5.0885 1.7146 1.5790 H 1 UNL1111111111 0.1729 45 H -4.4085 -0.9763 -1.7402 H 1 UNL1111111111 0.1781 @BOND 1 1 25 1 2 2 7 1 3 2 8 1 4 2 11 1 5 3 9 1 6 3 10 1 7 3 13 1 8 4 5 ar 9 4 11 ar 10 5 14 ar 11 5 37 1 12 6 21 ar 13 6 22 ar 14 7 9 1 15 7 26 1 16 7 27 1 17 8 10 1 18 8 28 1 19 8 29 1 20 9 30 1 21 9 31 1 22 10 32 1 23 10 33 1 24 11 12 ar 25 12 14 ar 26 12 15 1 27 13 34 1 28 13 35 1 29 13 36 1 30 14 16 1 31 15 17 ar 32 15 18 ar 33 16 19 ar 34 16 20 ar 35 17 21 ar 36 17 38 1 37 18 22 ar 38 18 39 1 39 19 23 ar 40 19 40 1 41 20 24 ar 42 20 41 1 43 21 42 1 44 22 43 1 45 23 25 ar 46 23 44 1 47 24 25 ar 48 24 45 1