REMARK  Name = BDB013662
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.467   0.070  -0.009  0.00  0.00    -0.325 N 
ATOM      2  H   LIG    1        0.088   0.354   0.891  0.00  0.00    +0.148 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1        1.815  -0.117  -0.100  0.00  0.00    +0.149 A 
ATOM      4  C   LIG    1        2.465  -0.331   1.175  0.00  0.00    +0.046 A 
ATOM      5  C   LIG    1        3.827  -0.518   1.191  0.00  0.00    +0.117 A 
ATOM      6  N   LIG    1        4.233  -0.701   2.483  0.00  0.00    -0.356 N 
ATOM      7  H   LIG    1        5.192  -0.863   2.767  0.00  0.00    +0.165 HD
ATOM      8  C   LIG    1        3.137  -0.636   3.307  0.00  0.00    +0.084 A 
ATOM      9  C   LIG    1        4.639  -0.518   0.009  0.00  0.00    +0.291 A 
ATOM     10  O   LIG    1        5.855  -0.688   0.047  0.00  0.00    -0.264 OA
ATOM     11  N   LIG    1        3.896  -0.305  -1.165  0.00  0.00    -0.229 N 
ATOM     12  C   LIG    1        4.559  -0.290  -2.453  0.00  0.00    +0.176 C 
ATOM     13  C   LIG    1        2.023  -0.411   2.522  0.00  0.00    +0.031 A 
ATOM     14  N   LIG    1        2.507  -0.109  -1.204  0.00  0.00    -0.153 NA
ENDBRANCH   1   3
BRANCH   1  15
ATOM     15  C   LIG    1       -0.316   0.596  -1.123  0.00  0.00    +0.126 C 
BRANCH  15  16
ATOM     16  C   LIG    1       -1.785   0.914  -0.679  0.00  0.00    +0.103 C 
BRANCH  16  17
ATOM     17  C   LIG    1       -2.615  -0.373  -0.758  0.00  0.00    -0.029 A 
ATOM     18  C   LIG    1       -2.422  -1.435   0.140  0.00  0.00    +0.005 A 
ATOM     19  C   LIG    1       -3.184  -2.601   0.042  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1       -4.149  -2.722  -0.955  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1       -4.354  -1.678  -1.854  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1       -3.593  -0.511  -1.758  0.00  0.00    +0.005 A 
ENDBRANCH  16  17
BRANCH  16  24
ATOM     23  C   LIG    1       -1.149   2.871   0.655  0.00  0.00    +0.105 C 
ATOM     24  N   LIG    1       -1.862   1.583   0.665  0.00  0.00    -0.300 NA
ATOM     25  C   LIG    1       -3.259   1.841   1.051  0.00  0.00    +0.105 C 
ENDBRANCH  16  24
ENDBRANCH  15  16
ENDBRANCH   1  15
TORSDOF 5