REMARK  Name = BDB004138
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        1.347   0.409  -0.441  0.00  0.00    -0.270 N 
ATOM      2  C   LIG    1        0.300   0.223   0.481  0.00  0.00    +0.240 C 
ATOM      3  O   LIG    1        0.321  -0.307   1.584  0.00  0.00    -0.273 OA
ATOM      4  C   LIG    1       -0.932   0.932  -0.091  0.00  0.00    +0.165 C 
ATOM      5  C   LIG    1       -0.619   1.064  -1.577  0.00  0.00    +0.051 C 
ATOM      6  C   LIG    1        0.896   1.165  -1.591  0.00  0.00    +0.116 C 
ENDROOT
BRANCH   4   7
ATOM      7  N   LIG    1       -2.212   0.315   0.280  0.00  0.00    -0.274 N 
ATOM      8  C   LIG    1       -2.520  -0.939  -0.205  0.00  0.00    +0.309 C 
ATOM      9  O   LIG    1       -1.811  -1.560  -0.995  0.00  0.00    -0.252 OA
ATOM     10  N   LIG    1       -3.684  -1.520   0.206  0.00  0.00    -0.240 N 
ATOM     11  H   LIG    1       -3.700  -2.384  -0.327  0.00  0.00    +0.159 HD
ATOM     12  C   LIG    1       -4.870  -0.885  -0.040  0.00  0.00    +0.220 C 
ATOM     13  O   LIG    1       -5.619  -1.259  -0.939  0.00  0.00    -0.275 OA
ATOM     14  C   LIG    1       -5.274   0.182   0.951  0.00  0.00    +0.098 C 
ATOM     15  C   LIG    1       -4.292   1.331   1.086  0.00  0.00    +0.028 C 
ATOM     16  C   LIG    1       -2.893   0.857   1.452  0.00  0.00    +0.110 C 
ENDBRANCH   4   7
BRANCH   1  20
ATOM     17  C   LIG    1        5.418  -0.791   0.016  0.00  0.00    +0.025 A 
ATOM     18  C   LIG    1        5.028   0.041  -1.030  0.00  0.00    +0.024 A 
ATOM     19  C   LIG    1        3.688   0.423  -1.184  0.00  0.00    +0.025 A 
ATOM     20  C   LIG    1        2.704   0.018  -0.270  0.00  0.00    +0.036 A 
ATOM     21  C   LIG    1        3.119  -0.769   0.810  0.00  0.00    +0.025 A 
ATOM     22  C   LIG    1        4.460  -1.148   0.962  0.00  0.00    +0.024 A 
BRANCH  17  23
ATOM     23  N   LIG    1        6.770  -1.072   0.234  0.00  0.00    -0.358 N 
ATOM     24  H   LIG    1        7.331  -1.074  -0.613  0.00  0.00    +0.142 HD
ATOM     25  H   LIG    1        6.928  -1.899   0.801  0.00  0.00    +0.142 HD
ENDBRANCH  17  23
ENDBRANCH   1  20
TORSDOF 3