REMARK Name = BDB000578 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -2.376 -0.044 0.234 0.00 0.00 +0.016 C ATOM 2 C LIG 1 -0.881 0.164 0.458 0.00 0.00 +0.060 C ATOM 3 C LIG 1 -0.351 1.300 -0.397 0.00 0.00 +0.201 C ATOM 4 O LIG 1 -1.048 2.107 -0.995 0.00 0.00 -0.289 OA ATOM 5 C LIG 1 1.166 1.430 -0.442 0.00 0.00 +0.198 C ATOM 6 O LIG 1 1.697 2.531 -0.416 0.00 0.00 -0.289 OA ATOM 7 C LIG 1 1.930 0.141 -0.581 0.00 0.00 +0.083 C ATOM 8 C LIG 1 1.391 -0.925 0.360 0.00 0.00 +0.009 C ATOM 9 C LIG 1 -0.109 -1.126 0.168 0.00 0.00 +0.011 C ENDROOT TORSDOF 0