REMARK  Name = BDB063020
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.292   1.619   1.457  0.00  0.00    +0.019 C 
ATOM      2  C   LIG    1       -0.974   0.614   0.880  0.00  0.00    +0.000 A 
ATOM      3  C   LIG    1       -2.221   0.890   0.210  0.00  0.00    +0.097 A 
ATOM      4  C   LIG    1       -2.955  -0.126  -0.347  0.00  0.00    +0.073 A 
ATOM      5  N   LIG    1       -4.054   0.474  -0.881  0.00  0.00    -0.342 N 
ATOM      6  H   LIG    1       -4.814   0.031  -1.375  0.00  0.00    +0.167 HD
ATOM      7  C   LIG    1       -3.941   1.827  -0.623  0.00  0.00    +0.105 A 
ATOM      8  C   LIG    1       -4.968   2.799  -1.064  0.00  0.00    +0.086 C 
ATOM      9  C   LIG    1       -2.590  -1.488  -0.333  0.00  0.00    -0.006 A 
ATOM     10  C   LIG    1       -3.350  -2.444  -0.884  0.00  0.00    +0.019 C 
ATOM     11  C   LIG    1       -1.312  -1.791   0.323  0.00  0.00    +0.015 A 
ATOM     12  N   LIG    1       -2.832   2.100   0.043  0.00  0.00    -0.232 NA
ATOM     13  C   LIG    1       -0.528  -0.828   0.895  0.00  0.00    -0.017 A 
ENDROOT
BRANCH  13  14
ATOM     14  C   LIG    1        0.799  -1.261   1.523  0.00  0.00    +0.112 C 
BRANCH  14  15
ATOM     15  C   LIG    1        2.036  -0.766   0.774  0.00  0.00    -0.026 A 
ATOM     16  C   LIG    1        2.230  -1.148  -0.566  0.00  0.00    +0.006 A 
ATOM     17  C   LIG    1        3.358  -0.733  -1.281  0.00  0.00    +0.004 A 
ATOM     18  C   LIG    1        4.330   0.064  -0.671  0.00  0.00    -0.050 A 
ATOM     19  C   LIG    1        5.520   0.543  -1.448  0.00  0.00    +0.044 C 
ATOM     20  C   LIG    1        4.144   0.459   0.656  0.00  0.00    +0.004 A 
ATOM     21  C   LIG    1        3.016   0.043   1.371  0.00  0.00    +0.006 A 
ENDBRANCH  14  15
BRANCH  14  22
ATOM     22  N   LIG    1        0.830  -1.001   2.970  0.00  0.00    -0.320 NA
ATOM     23  H   LIG    1       -0.031  -1.359   3.377  0.00  0.00    +0.119 HD
ATOM     24  H   LIG    1        1.589  -1.545   3.374  0.00  0.00    +0.119 HD
ENDBRANCH  14  22
ENDBRANCH  13  14
TORSDOF 3