REMARK Name = BDB063761 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 0.115 -0.347 -0.262 0.00 0.00 +0.175 C ENDROOT BRANCH 1 2 ATOM 2 C LIG 1 -0.093 1.098 0.147 0.00 0.00 +0.016 A ATOM 3 C LIG 1 -0.020 1.466 1.494 0.00 0.00 +0.130 A ATOM 4 F LIG 1 0.245 0.536 2.423 0.00 0.00 -0.205 F ATOM 5 C LIG 1 -0.220 2.780 1.906 0.00 0.00 +0.058 A ATOM 6 C LIG 1 -0.500 3.754 0.954 0.00 0.00 +0.044 A ATOM 7 CL LIG 1 -0.753 5.382 1.446 0.00 0.00 -0.083 Cl ATOM 8 C LIG 1 -0.579 3.419 -0.398 0.00 0.00 +0.020 A ATOM 9 C LIG 1 -0.376 2.096 -0.800 0.00 0.00 +0.010 A ENDBRANCH 1 2 BRANCH 1 11 ATOM 10 O LIG 1 -1.265 -1.320 -2.017 0.00 0.00 -0.290 OA ATOM 11 C LIG 1 -1.186 -0.954 -0.840 0.00 0.00 +0.188 C BRANCH 11 12 ATOM 12 C LIG 1 -2.389 -1.099 0.032 0.00 0.00 +0.020 A ATOM 13 C LIG 1 -3.651 -1.080 -0.581 0.00 0.00 +0.013 A ATOM 14 C LIG 1 -4.812 -1.208 0.186 0.00 0.00 +0.020 A ATOM 15 C LIG 1 -4.713 -1.364 1.566 0.00 0.00 +0.041 A ATOM 16 CL LIG 1 -6.139 -1.521 2.514 0.00 0.00 -0.084 Cl ATOM 17 C LIG 1 -3.464 -1.400 2.183 0.00 0.00 +0.020 A ATOM 18 C LIG 1 -2.300 -1.273 1.418 0.00 0.00 +0.013 A ENDBRANCH 11 12 ENDBRANCH 1 11 BRANCH 1 19 ATOM 19 N LIG 1 1.153 -0.406 -1.315 0.00 0.00 -0.330 N ATOM 20 H LIG 1 0.792 -0.892 -2.142 0.00 0.00 +0.147 HD BRANCH 19 21 ATOM 21 C LIG 1 2.482 -0.708 -1.032 0.00 0.00 +0.033 A ATOM 22 C LIG 1 3.085 -0.477 0.209 0.00 0.00 +0.061 A ATOM 23 C LIG 1 4.444 -0.733 0.402 0.00 0.00 +0.128 A ATOM 24 F LIG 1 4.985 -0.517 1.608 0.00 0.00 -0.205 F ATOM 25 C LIG 1 5.244 -1.195 -0.629 0.00 0.00 +0.076 A ATOM 26 C LIG 1 4.665 -1.387 -1.871 0.00 0.00 +0.128 A ATOM 27 F LIG 1 5.420 -1.814 -2.892 0.00 0.00 -0.205 F ATOM 28 C LIG 1 3.308 -1.137 -2.080 0.00 0.00 +0.061 A ENDBRANCH 19 21 ENDBRANCH 1 19 TORSDOF 5