REMARK  Name = BDB014430
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.605  -1.622  -1.997  0.00  0.00    +0.145 C 
ENDROOT
BRANCH   1   2
ATOM      2  O   LIG    1       -2.722  -2.012  -2.814  0.00  0.00    -0.389 OA
ATOM      3  H   LIG    1       -3.495  -1.583  -2.389  0.00  0.00    +0.210 HD
ENDBRANCH   1   2
BRANCH   1   4
ATOM      4  C   LIG    1       -0.332  -1.660  -2.855  0.00  0.00    +0.136 C 
BRANCH   4   7
ATOM      5  O   LIG    1        1.140   0.496  -1.791  0.00  0.00    -0.273 OA
ATOM      6  C   LIG    1        1.555  -0.643  -1.603  0.00  0.00    +0.239 C 
ATOM      7  N   LIG    1        0.893  -1.760  -2.081  0.00  0.00    -0.311 N 
ATOM      8  H   LIG    1        1.258  -2.683  -1.886  0.00  0.00    +0.149 HD
BRANCH   6   9
ATOM      9  C   LIG    1        2.838  -0.980  -0.830  0.00  0.00    +0.255 C 
BRANCH   9  10
ATOM     10  O   LIG    1        3.347   0.126  -0.102  0.00  0.00    -0.367 OA
BRANCH  10  11
ATOM     11  C   LIG    1        4.460  -0.186   0.739  0.00  0.00    +0.119 C 
ATOM     12  C   LIG    1        5.743  -0.366  -0.080  0.00  0.00    +0.031 C 
ATOM     13  C   LIG    1        6.970  -0.530   0.812  0.00  0.00    +0.003 C 
ATOM     14  C   LIG    1        7.105   0.619   1.806  0.00  0.00    +0.000 C 
ATOM     15  C   LIG    1        5.832   0.801   2.627  0.00  0.00    +0.003 C 
ATOM     16  C   LIG    1        4.612   0.972   1.730  0.00  0.00    +0.031 C 
ENDBRANCH  10  11
ENDBRANCH   9  10
ENDBRANCH   6   9
ENDBRANCH   4   7
ENDBRANCH   1   4
BRANCH   1  17
ATOM     17  C   LIG    1       -1.895  -0.228  -1.398  0.00  0.00    +0.117 C 
BRANCH  17  18
ATOM     18  N   LIG    1       -3.269  -0.162  -0.835  0.00  0.00    -0.295 NA
ATOM     19  C   LIG    1       -3.644   1.259  -0.645  0.00  0.00    +0.120 C 
ATOM     20  C   LIG    1       -4.964   1.448   0.072  0.00  0.00    -0.030 A 
ATOM     21  C   LIG    1       -5.503   0.427   0.875  0.00  0.00    -0.042 A 
ATOM     22  C   LIG    1       -6.709   0.638   1.555  0.00  0.00    +0.004 A 
ATOM     23  C   LIG    1       -7.366   1.865   1.460  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1       -6.826   2.886   0.681  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1       -4.813  -0.910   0.950  0.00  0.00    +0.051 C 
ATOM     26  C   LIG    1       -5.630   2.680  -0.007  0.00  0.00    +0.005 A 
ATOM     27  C   LIG    1       -3.357  -0.853   0.465  0.00  0.00    +0.089 C 
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 8