REMARK  Name = BDB060907
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.719  -0.939   0.181  0.00  0.00    +0.112 A 
ATOM      2  C   LIG    1        0.595  -1.089  -0.628  0.00  0.00    +0.132 A 
ATOM      3  N   LIG    1        0.377  -2.477  -0.669  0.00  0.00    -0.285 N 
ATOM      4  C   LIG    1        1.236  -3.016   0.297  0.00  0.00    +0.140 A 
ATOM      5  C   LIG    1        1.154  -4.406   0.579  0.00  0.00    +0.050 A 
ATOM      6  C   LIG    1        0.304  -5.191  -0.110  0.00  0.00    -0.045 A 
ATOM      7  C   LIG    1       -0.527  -4.623  -1.162  0.00  0.00    +0.025 A 
ATOM      8  C   LIG    1        0.176  -6.663   0.144  0.00  0.00    +0.044 C 
ATOM      9  C   LIG    1       -0.494  -3.300  -1.433  0.00  0.00    +0.024 A 
ATOM     10  C   LIG    1       -1.322  -2.756  -2.556  0.00  0.00    +0.064 C 
ATOM     11  N   LIG    1        2.051  -2.119   0.799  0.00  0.00    -0.226 NA
ENDROOT
BRANCH   1  15
ATOM     12  C   LIG    1        4.072   2.567   0.848  0.00  0.00    +0.120 A 
ATOM     13  C   LIG    1        3.868   1.636   1.869  0.00  0.00    +0.046 A 
ATOM     14  C   LIG    1        3.098   0.491   1.646  0.00  0.00    +0.014 A 
ATOM     15  C   LIG    1        2.505   0.266   0.398  0.00  0.00    +0.004 A 
ATOM     16  C   LIG    1        2.728   1.193  -0.627  0.00  0.00    +0.014 A 
ATOM     17  C   LIG    1        3.501   2.340  -0.404  0.00  0.00    +0.046 A 
BRANCH  12  19
ATOM     18  C   LIG    1        5.091   4.609   0.188  0.00  0.00    +0.277 C 
ATOM     19  O   LIG    1        4.842   3.642   1.199  0.00  0.00    -0.495 OA
ENDBRANCH  12  19
ENDBRANCH   1  15
BRANCH   2  20
ATOM     20  N   LIG    1       -0.180  -0.169  -1.298  0.00  0.00    -0.323 N 
ATOM     21  H   LIG    1       -0.598  -0.502  -2.160  0.00  0.00    +0.148 HD
BRANCH  20  22
ATOM     22  C   LIG    1       -1.190   0.634  -0.555  0.00  0.00    +0.034 C 
ATOM     23  C   LIG    1       -0.547   1.740   0.310  0.00  0.00    +0.029 C 
ATOM     24  C   LIG    1       -1.626   2.603   0.991  0.00  0.00    -0.008 C 
ATOM     25  C   LIG    1       -2.503   3.264  -0.083  0.00  0.00    +0.007 C 
ATOM     26  C   LIG    1       -3.177   2.186  -0.944  0.00  0.00    -0.008 C 
ATOM     27  C   LIG    1       -4.046   1.288  -0.050  0.00  0.00    +0.007 C 
ATOM     28  C   LIG    1       -3.178   0.618   1.027  0.00  0.00    -0.008 C 
ATOM     29  C   LIG    1       -2.502   1.704   1.880  0.00  0.00    +0.007 C 
ATOM     30  C   LIG    1       -2.092   1.329  -1.615  0.00  0.00    +0.029 C 
ATOM     31  C   LIG    1       -2.096  -0.242   0.347  0.00  0.00    +0.029 C 
ENDBRANCH  20  22
ENDBRANCH   2  20
TORSDOF 4