@MOLECULE 3-[(4-bromophenoxy)methyl]-n-(4-nitro-1h-pyrazol-1-yl)benzamide 39 41 0 0 0 SMALL GASTEIGER @ATOM 1 BR -7.7237 1.2867 -0.0069 Br 1 UNL1111111111 -0.0524 2 O -2.2136 -1.0548 -0.1320 O.3 1 UNL1111111111 -0.3308 3 O 4.6124 -1.8687 0.3639 O.2 1 UNL1111111111 -0.4232 4 O 9.0297 2.3001 -0.2804 O.2 1 UNL1111111111 -0.4085 5 O 8.6165 1.0461 1.4259 O.2 1 UNL1111111111 -0.4115 6 N 3.6409 0.1381 -0.1427 N.am 1 UNL1111111111 -0.4225 7 N 4.8837 0.7111 -0.3092 N.ar 1 UNL1111111111 0.0727 8 N 5.1222 1.4868 -1.4163 N.ar 1 UNL1111111111 -0.2876 9 N 8.2917 1.5833 0.3778 N.pl3 1 UNL1111111111 0.6872 10 C -0.1191 -1.7628 0.4649 C.ar 1 UNL1111111111 -0.0406 11 C 2.2429 -1.8486 0.0200 C.ar 1 UNL1111111111 -0.1566 12 C -1.3278 -1.0491 0.9934 C.3 1 UNL1111111111 -0.0565 13 C 1.1422 -1.1783 0.5550 C.ar 1 UNL1111111111 -0.1076 14 C -0.2771 -3.0081 -0.1498 C.ar 1 UNL1111111111 -0.0845 15 C 2.0956 -3.1009 -0.5797 C.ar 1 UNL1111111111 -0.0734 16 C 3.6042 -1.2781 0.0782 C.2 1 UNL1111111111 0.5547 17 C 0.8301 -3.6767 -0.6672 C.ar 1 UNL1111111111 -0.1625 18 C -3.4385 -0.4911 0.0206 C.ar 1 UNL1111111111 0.2521 19 C 5.9700 0.5825 0.5128 C.ar 1 UNL1111111111 0.0463 20 C 6.9747 1.3661 -0.0996 C.ar 1 UNL1111111111 -0.2733 21 C -3.9332 0.0865 1.1889 C.ar 1 UNL1111111111 -0.2921 22 C -4.1988 -0.5493 -1.1610 C.ar 1 UNL1111111111 -0.2377 23 C 6.3978 1.9097 -1.2932 C.ar 1 UNL1111111111 0.0375 24 C -5.2236 0.6199 1.1742 C.ar 1 UNL1111111111 -0.0771 25 C -5.4781 -0.0160 -1.1621 C.ar 1 UNL1111111111 -0.0821 26 C -5.9723 0.5611 0.0078 C.ar 1 UNL1111111111 -0.0934 27 H -1.7950 -1.5942 1.8367 H 1 UNL1111111111 0.1452 28 H -1.1250 -0.0041 1.2921 H 1 UNL1111111111 0.1438 29 H 1.2669 -0.2112 1.0449 H 1 UNL1111111111 0.1673 30 H -1.2731 -3.4496 -0.2292 H 1 UNL1111111111 0.1685 31 H 2.9698 -3.6261 -0.9739 H 1 UNL1111111111 0.1739 32 H 0.7068 -4.6510 -1.1404 H 1 UNL1111111111 0.1651 33 H 2.9244 0.5783 -0.7405 H 1 UNL1111111111 0.3408 34 H 5.9987 -0.0086 1.4180 H 1 UNL1111111111 0.2212 35 H -3.3449 0.1303 2.0987 H 1 UNL1111111111 0.1667 36 H -3.7736 -1.0067 -2.0522 H 1 UNL1111111111 0.1789 37 H 6.8691 2.5637 -2.0149 H 1 UNL1111111111 0.2120 38 H -5.6237 1.0761 2.0820 H 1 UNL1111111111 0.1681 39 H -6.0803 -0.0523 -2.0725 H 1 UNL1111111111 0.1718 @BOND 1 1 26 1 2 2 12 1 3 2 18 1 4 3 16 2 5 4 9 2 6 5 9 2 7 6 7 1 8 6 16 am 9 6 33 1 10 7 8 ar 11 7 19 ar 12 8 23 ar 13 9 20 1 14 10 12 1 15 10 13 ar 16 10 14 ar 17 11 13 ar 18 11 15 ar 19 11 16 1 20 12 27 1 21 12 28 1 22 13 29 1 23 14 17 ar 24 14 30 1 25 15 17 ar 26 15 31 1 27 17 32 1 28 18 21 ar 29 18 22 ar 30 19 20 ar 31 19 34 1 32 20 23 ar 33 21 24 ar 34 21 35 1 35 22 25 ar 36 22 36 1 37 23 37 1 38 24 26 ar 39 24 38 1 40 25 26 ar 41 25 39 1