REMARK  Name = BDB013859
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        1.692  -0.363   1.185  0.00  0.00    -0.338 N 
ATOM      2  H   LIG    1        2.029   0.571   1.441  0.00  0.00    +0.146 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1        2.038  -0.703  -0.132  0.00  0.00    +0.060 A 
ATOM      4  C   LIG    1        2.998   0.021  -0.868  0.00  0.00    +0.082 A 
ATOM      5  C   LIG    1        3.370  -0.391  -2.156  0.00  0.00    +0.036 A 
ATOM      6  C   LIG    1        2.791  -1.530  -2.676  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        1.893  -2.274  -2.008  0.00  0.00    -0.261 NA
ATOM      8  C   LIG    1        1.554  -1.850  -0.764  0.00  0.00    +0.134 A 
BRANCH   4   9
ATOM      9  C   LIG    1        3.600   1.256  -0.300  0.00  0.00    +0.339 C 
ATOM     10  O   LIG    1        3.234   1.841   0.705  0.00  0.00    -0.245 OA
BRANCH   9  11
ATOM     11  O   LIG    1        4.645   1.713  -1.018  0.00  0.00    -0.477 OA
ATOM     12  H   LIG    1        4.944   2.505  -0.523  0.00  0.00    +0.295 HD
ENDBRANCH   9  11
ENDBRANCH   4   9
ENDBRANCH   1   3
BRANCH   1  13
ATOM     13  C   LIG    1        0.344  -0.619   1.697  0.00  0.00    +0.137 C 
BRANCH  13  17
ATOM     14  C   LIG    1       -1.163   3.787  -0.263  0.00  0.00    +0.044 C 
ATOM     15  C   LIG    1       -1.482   2.378   0.140  0.00  0.00    -0.050 A 
ATOM     16  C   LIG    1       -0.491   1.555   0.685  0.00  0.00    +0.008 A 
ATOM     17  C   LIG    1       -0.746   0.209   1.031  0.00  0.00    -0.027 A 
ATOM     18  C   LIG    1       -2.050  -0.322   0.849  0.00  0.00    -0.040 A 
ATOM     19  C   LIG    1       -3.031   0.532   0.305  0.00  0.00    +0.004 A 
ATOM     20  C   LIG    1       -2.754   1.851  -0.060  0.00  0.00    +0.003 A 
BRANCH  18  21
ATOM     21  C   LIG    1       -2.422  -1.736   1.266  0.00  0.00    +0.019 C 
ATOM     22  C   LIG    1       -2.015  -2.899   0.388  0.00  0.00    +0.009 C 
ATOM     23  C   LIG    1       -3.462  -2.543   0.520  0.00  0.00    +0.009 C 
ENDBRANCH  18  21
ENDBRANCH  13  17
ENDBRANCH   1  13
TORSDOF 6