@MOLECULE 3,5-dibromo-n-(2-chloro-4-isothiocyanatophenyl)-2-hydroxybenzamide 29 30 0 0 0 SMALL GASTEIGER @ATOM 1 BR 4.8134 -2.4083 -0.4108 Br 1 UNL1111 0.0190 2 BR 3.6233 3.0819 0.3536 Br 1 UNL1111 -0.0255 3 CL -2.7922 2.0356 -1.4421 Cl 1 UNL1111 -0.0525 4 S -9.2740 -0.4045 -0.1817 S.2 1 UNL1111 -0.1760 5 O 1.9164 -2.6433 0.0005 O.3 1 UNL1111 -0.4267 6 O -0.4969 -1.8842 0.5568 O.2 1 UNL1111 -0.5607 7 N -1.1176 0.2736 0.2647 N.am 1 UNL1111 -0.5285 8 N -6.6178 -0.7115 0.4385 N.2 1 UNL1111 -0.4056 9 C 1.2606 -0.3313 0.2660 C.ar 1 UNL1111 -0.3260 10 C -2.5038 -0.0007 0.3038 C.ar 1 UNL1111 0.1659 11 C -0.1567 -0.7199 0.3802 C.2 1 UNL1111 0.6289 12 C 2.2142 -1.3486 0.0585 C.ar 1 UNL1111 0.3740 13 C 1.7040 0.9953 0.3677 C.ar 1 UNL1111 -0.0355 14 C -3.3917 0.7852 -0.4472 C.ar 1 UNL1111 -0.0417 15 C -3.0327 -1.0290 1.1022 C.ar 1 UNL1111 -0.1345 16 C 3.5789 -1.0212 -0.1034 C.ar 1 UNL1111 -0.1568 17 C 3.0468 1.2849 0.2184 C.ar 1 UNL1111 -0.1202 18 C 4.0012 0.2890 -0.0280 C.ar 1 UNL1111 -0.0447 19 C -4.7606 0.5823 -0.4245 C.ar 1 UNL1111 -0.2050 20 C -4.3994 -1.2594 1.1372 C.ar 1 UNL1111 -0.1509 21 C -5.2658 -0.4551 0.3756 C.ar 1 UNL1111 0.2251 22 C -7.7508 -0.4931 0.0954 C.1 1 UNL1111 0.3307 23 H -0.8395 1.2215 0.0231 H 1 UNL1111 0.3277 24 H 0.9908 1.7970 0.5779 H 1 UNL1111 0.1663 25 H -2.3635 -1.6590 1.6999 H 1 UNL1111 0.2036 26 H 5.0582 0.5497 -0.1512 H 1 UNL1111 0.1852 27 H -5.4338 1.2050 -1.0167 H 1 UNL1111 0.1908 28 H -4.8092 -2.0632 1.7538 H 1 UNL1111 0.1872 29 H 0.9200 -2.8058 0.1898 H 1 UNL1111 0.3863 @BOND 1 1 16 1 2 2 17 1 3 3 14 1 4 4 22 2 5 5 12 1 6 5 29 1 7 6 11 2 8 7 10 1 9 7 11 am 10 7 23 1 11 8 21 1 12 8 22 2 13 9 11 1 14 9 12 ar 15 9 13 ar 16 10 14 ar 17 10 15 ar 18 12 16 ar 19 13 17 ar 20 13 24 1 21 14 19 ar 22 15 20 ar 23 15 25 1 24 16 18 ar 25 17 18 ar 26 18 26 1 27 19 21 ar 28 19 27 1 29 20 21 ar 30 20 28 1