@MOLECULE 5-(2,3-dichlorophenyl)-n-(4-pyridinylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine 38 41 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 CL 2.1271 1.0988 1.4749 Cl 1 UNL1 -0.0240 2 CL 4.7729 2.5740 0.7193 Cl 1 UNL1 -0.0436 3 N -1.0200 -2.3492 0.3230 N.ar 1 UNL1 -0.2198 4 N -2.3699 -0.4328 0.0539 N.pl3 1 UNL1 -0.5057 5 N 1.3683 -2.3939 -0.0966 N.ar 1 UNL1 -0.4254 6 N -2.0400 -3.1819 0.6983 N.ar 1 UNL1 -0.2936 7 N -6.6619 2.0905 -0.4712 N.ar 1 UNL1 -0.3667 8 C -1.1227 -0.9925 0.0274 C.ar 1 UNL1 0.4680 9 C 1.2778 -1.0940 -0.3577 C.ar 1 UNL1 0.2798 10 C 0.2319 -3.0575 0.2469 C.ar 1 UNL1 0.3091 11 C 0.0672 -0.3541 -0.3271 C.ar 1 UNL1 -0.4762 12 C -2.5234 1.0280 0.0043 C.3 1 UNL1 -0.0785 13 C 2.5378 -0.4022 -0.6978 C.ar 1 UNL1 -0.0303 14 C -3.9775 1.3835 -0.1561 C.ar 1 UNL1 0.0343 15 C -0.0725 -4.3764 0.5951 C.ar 1 UNL1 -0.3435 16 C -1.4730 -4.3990 0.8630 C.ar 1 UNL1 0.0211 17 C 3.0082 0.6452 0.0943 C.ar 1 UNL1 -0.0082 18 C 3.2774 -0.8030 -1.8124 C.ar 1 UNL1 -0.0947 19 C -4.5405 2.3841 0.6358 C.ar 1 UNL1 -0.2558 20 C -4.7692 0.7419 -1.1088 C.ar 1 UNL1 -0.2418 21 C 4.1902 1.2918 -0.2380 C.ar 1 UNL1 -0.0219 22 C 4.4630 -0.1459 -2.1395 C.ar 1 UNL1 -0.1422 23 C 4.9262 0.9083 -1.3543 C.ar 1 UNL1 -0.1427 24 C -5.8898 2.7085 0.4414 C.ar 1 UNL1 0.0606 25 C -6.1112 1.1245 -1.2298 C.ar 1 UNL1 0.0594 26 H 0.0791 0.6982 -0.5831 H 1 UNL1 0.1983 27 H -3.1522 -0.9762 0.4171 H 1 UNL1 0.3461 28 H -1.9471 1.4373 -0.8670 H 1 UNL1 0.1738 29 H -2.0848 1.4931 0.9230 H 1 UNL1 0.1621 30 H 0.6099 -5.1957 0.6514 H 1 UNL1 0.1968 31 H -2.0656 -5.2489 1.1653 H 1 UNL1 0.1871 32 H 2.9267 -1.6438 -2.4165 H 1 UNL1 0.1793 33 H -3.9574 2.9052 1.3898 H 1 UNL1 0.1703 34 H -4.3580 -0.0374 -1.7484 H 1 UNL1 0.1819 35 H 5.0356 -0.4644 -3.0109 H 1 UNL1 0.1646 36 H 5.8559 1.4184 -1.6115 H 1 UNL1 0.1745 37 H -6.3850 3.4883 1.0327 H 1 UNL1 0.1731 38 H -6.7817 0.6510 -1.9576 H 1 UNL1 0.1744 @BOND 1 35 22 1 2 32 18 1 3 22 18 ar 4 22 23 ar 5 38 25 1 6 18 13 ar 7 34 20 1 8 36 23 1 9 23 21 ar 10 25 20 ar 11 25 7 ar 12 20 14 ar 13 28 12 1 14 13 9 1 15 13 17 ar 16 26 11 1 17 7 24 ar 18 9 11 ar 19 9 5 ar 20 11 8 ar 21 21 17 ar 22 21 2 1 23 14 12 1 24 14 19 ar 25 5 10 ar 26 12 4 1 27 12 29 1 28 8 4 1 29 8 3 ar 30 4 27 1 31 17 1 1 32 10 3 ar 33 10 15 ar 34 3 6 ar 35 24 19 ar 36 24 37 1 37 15 30 1 38 15 16 ar 39 19 33 1 40 6 16 ar 41 16 31 1