REMARK  Name = BDB001414
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.161  -0.142  -0.798  0.00  0.00    -0.027 A 
ATOM      2  C   LIG    1        0.063  -1.533  -0.815  0.00  0.00    +0.066 A 
ATOM      3 CL   LIG    1       -1.227  -2.603  -1.281  0.00  0.00    -0.082 Cl
ATOM      4  C   LIG    1        1.327  -2.051  -0.468  0.00  0.00    +0.101 A 
ATOM      5 CL   LIG    1        1.618  -3.769  -0.480  0.00  0.00    -0.078 Cl
ATOM      6  C   LIG    1        2.381  -1.186  -0.107  0.00  0.00    +0.141 A 
ATOM      7  C   LIG    1        2.152   0.191  -0.093  0.00  0.00    +0.047 A 
ATOM      8  C   LIG    1        0.899   0.704  -0.436  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1   9
ATOM      9  C   LIG    1       -1.496   0.488  -1.147  0.00  0.00    +0.040 C 
BRANCH   9  10
ATOM     10  C   LIG    1       -2.546   0.431  -0.012  0.00  0.00    -0.010 C 
ATOM     11  C   LIG    1       -2.152   1.342   1.157  0.00  0.00    +0.008 C 
BRANCH  10  13
ATOM     12  C   LIG    1       -5.073   0.647   0.400  0.00  0.00    +0.004 C 
ATOM     13  C   LIG    1       -3.926   0.814  -0.587  0.00  0.00    +0.000 C 
ENDBRANCH  10  13
ENDBRANCH   9  10
ENDBRANCH   1   9
BRANCH   6  14
ATOM     14  O   LIG    1        3.576  -1.776   0.217  0.00  0.00    -0.479 OA
BRANCH  14  15
ATOM     15  C   LIG    1        4.704  -0.961   0.489  0.00  0.00    +0.349 C 
BRANCH  15  16
ATOM     16  C   LIG    1        5.317  -0.268  -0.716  0.00  0.00    +0.343 C 
ATOM     17  O   LIG    1        5.638   0.909  -0.775  0.00  0.00    -0.247 OA
BRANCH  16  18
ATOM     18  O   LIG    1        5.517  -1.087  -1.767  0.00  0.00    -0.478 OA
ATOM     19  H   LIG    1        5.905  -0.517  -2.462  0.00  0.00    +0.295 HD
ENDBRANCH  16  18
ENDBRANCH  15  16
ENDBRANCH  14  15
ENDBRANCH   6  14
TORSDOF 7