REMARK  Name = BDB014007
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.203  -0.286  -2.388  0.00  0.00    +0.160 C 
ATOM      2  C   LIG    1        0.845   0.443  -2.227  0.00  0.00    +0.240 C 
ATOM      3  O   LIG    1        0.376   1.059  -3.191  0.00  0.00    -0.273 OA
ATOM      4  N   LIG    1        0.159   0.338  -1.009  0.00  0.00    -0.265 N 
ATOM      5  C   LIG    1        0.521  -0.584   0.022  0.00  0.00    +0.040 A 
ATOM      6  C   LIG    1        0.915  -1.902  -0.290  0.00  0.00    -0.026 A 
ATOM      7  C   LIG    1        1.300  -2.776   0.740  0.00  0.00    +0.005 A 
ATOM      8  C   LIG    1        1.286  -2.357   2.068  0.00  0.00    +0.000 A 
ATOM      9  C   LIG    1        0.886  -1.063   2.381  0.00  0.00    +0.002 A 
ATOM     10  C   LIG    1        0.898  -2.402  -1.710  0.00  0.00    +0.039 C 
ATOM     11  C   LIG    1        0.504  -0.184   1.366  0.00  0.00    +0.024 A 
ATOM     12  C   LIG    1        2.017  -1.797  -2.555  0.00  0.00    +0.036 C 
ENDROOT
BRANCH   1  14
ATOM     13  C   LIG    1        3.871   1.187  -1.286  0.00  0.00    +0.230 C 
ATOM     14  N   LIG    1        3.136   0.022  -1.300  0.00  0.00    -0.303 N 
ATOM     15  H   LIG    1        3.059  -0.501  -0.437  0.00  0.00    +0.149 HD
ATOM     16  O   LIG    1        3.862   1.999  -2.209  0.00  0.00    -0.274 OA
BRANCH  13  17
ATOM     17  C   LIG    1        4.676   1.417   0.015  0.00  0.00    +0.137 C 
ATOM     18  C   LIG    1        3.882   2.396   0.880  0.00  0.00    +0.034 C 
BRANCH  17  20
ATOM     19  C   LIG    1        6.863   2.233   0.772  0.00  0.00    +0.101 C 
ATOM     20  N   LIG    1        6.025   1.877  -0.358  0.00  0.00    -0.309 NA
ATOM     21  H   LIG    1        5.931   2.670  -0.999  0.00  0.00    +0.122 HD
ENDBRANCH  17  20
ENDBRANCH  13  17
ENDBRANCH   1  14
BRANCH   4  22
ATOM     22  C   LIG    1       -1.002   1.223  -0.804  0.00  0.00    +0.149 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -2.285   0.510  -0.396  0.00  0.00    -0.022 A 
ATOM     24  C   LIG    1       -3.020  -0.326  -1.281  0.00  0.00    -0.013 A 
ATOM     25  C   LIG    1       -4.169  -0.991  -0.787  0.00  0.00    -0.017 A 
ATOM     26  C   LIG    1       -4.908  -1.842  -1.626  0.00  0.00    +0.008 A 
ATOM     27  C   LIG    1       -4.542  -2.039  -2.955  0.00  0.00    +0.001 A 
ATOM     28  C   LIG    1       -3.433  -1.380  -3.463  0.00  0.00    +0.001 A 
ATOM     29  C   LIG    1       -4.576  -0.798   0.543  0.00  0.00    +0.012 A 
ATOM     30  C   LIG    1       -3.893   0.056   1.418  0.00  0.00    -0.043 A 
ATOM     31  C   LIG    1       -2.686  -0.534  -2.639  0.00  0.00    +0.009 A 
ATOM     32  C   LIG    1       -2.750   0.695   0.924  0.00  0.00    +0.009 A 
BRANCH  30  33
ATOM     33  C   LIG    1       -4.347   0.247   2.844  0.00  0.00    +0.019 C 
ATOM     34  C   LIG    1       -4.608   1.638   3.377  0.00  0.00    +0.009 C 
ATOM     35  C   LIG    1       -5.757   0.708   3.134  0.00  0.00    +0.009 C 
ENDBRANCH  30  33
ENDBRANCH  22  23
ENDBRANCH   4  22
TORSDOF 6