REMARK  Name = BDB001135
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.767   0.382  -2.045  0.00  0.00    +0.064 A 
ATOM      2  C   LIG    1       -1.049   0.800  -0.909  0.00  0.00    +0.102 A 
ATOM      3  C   LIG    1       -1.224   2.140  -0.478  0.00  0.00    +0.090 A 
ATOM      4  N   LIG    1       -0.586   2.631   0.598  0.00  0.00    -0.251 NA
ATOM      5  C   LIG    1        0.241   1.788   1.257  0.00  0.00    +0.139 A 
ATOM      6  C   LIG    1        0.441   0.473   0.872  0.00  0.00    +0.090 A 
ATOM      7  C   LIG    1       -2.071   2.994  -1.169  0.00  0.00    +0.030 A 
ATOM      8  C   LIG    1       -2.770   2.573  -2.295  0.00  0.00    +0.003 A 
ATOM      9  N   LIG    1       -0.204  -0.019  -0.217  0.00  0.00    -0.243 NA
ATOM     10  C   LIG    1       -2.617   1.267  -2.733  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   6  11
ATOM     11  C   LIG    1        1.340  -0.456   1.575  0.00  0.00    +0.002 A 
ATOM     12  C   LIG    1        1.469  -0.450   2.976  0.00  0.00    +0.010 A 
ATOM     13  C   LIG    1        2.330  -1.339   3.629  0.00  0.00    +0.001 A 
ATOM     14  C   LIG    1        3.078  -2.254   2.894  0.00  0.00    +0.000 A 
ATOM     15  C   LIG    1        2.964  -2.284   1.507  0.00  0.00    +0.001 A 
ATOM     16  C   LIG    1        2.103  -1.396   0.857  0.00  0.00    +0.010 A 
ENDBRANCH   6  11
BRANCH   1  20
ATOM     17  N   LIG    1       -0.973  -1.936  -1.894  0.00  0.00    -0.325 N 
ATOM     18  H   LIG    1       -0.480  -1.687  -1.039  0.00  0.00    +0.145 HD
ATOM     19  H   LIG    1       -0.898  -2.875  -2.259  0.00  0.00    +0.145 HD
ATOM     20  C   LIG    1       -1.682  -1.006  -2.592  0.00  0.00    +0.244 C 
ATOM     21  O   LIG    1       -2.241  -1.315  -3.639  0.00  0.00    -0.270 OA
ENDBRANCH   1  20
TORSDOF 2