REMARK  Name = BDB060327
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.042  -0.964  -0.764  0.00  0.00    +0.080 C 
ATOM      2  C   LIG    1       -0.731  -0.655  -2.060  0.00  0.00    +0.028 C 
ATOM      3  C   LIG    1       -2.208  -0.818  -1.712  0.00  0.00    +0.039 C 
ATOM      4  C   LIG    1       -2.229  -0.488  -0.247  0.00  0.00    -0.026 C 
ATOM      5  C   LIG    1       -0.986  -0.561   0.259  0.00  0.00    -0.003 C 
ENDROOT
BRANCH   4   6
ATOM      6  C   LIG    1       -3.451  -0.158   0.463  0.00  0.00    +0.046 A 
ATOM      7  N   LIG    1       -3.334   0.548   1.635  0.00  0.00    -0.322 N 
ATOM      8  H   LIG    1       -2.421   0.838   1.958  0.00  0.00    +0.169 HD
ATOM      9  C   LIG    1       -4.384   0.986   2.405  0.00  0.00    +0.257 A 
ATOM     10  O   LIG    1       -4.202   1.634   3.430  0.00  0.00    -0.267 OA
ATOM     11  C   LIG    1       -5.745   0.634   1.933  0.00  0.00    +0.048 A 
ATOM     12  C   LIG    1       -5.889  -0.123   0.756  0.00  0.00    +0.010 A 
ATOM     13  C   LIG    1       -7.185  -0.495   0.340  0.00  0.00    +0.033 A 
ATOM     14  C   LIG    1       -8.293   0.009   1.043  0.00  0.00    +0.023 A 
ATOM     15  C   LIG    1       -8.134   0.768   2.204  0.00  0.00    +0.003 A 
ATOM     16  C   LIG    1       -6.857   1.070   2.660  0.00  0.00    +0.014 A 
ATOM     17  C   LIG    1       -4.672  -0.485   0.007  0.00  0.00    +0.036 A 
BRANCH  13  18
ATOM     18  N   LIG    1       -7.427  -1.184  -0.866  0.00  0.00    -0.357 N 
ATOM     19  H   LIG    1       -8.350  -1.605  -0.913  0.00  0.00    +0.142 HD
ATOM     20  H   LIG    1       -6.706  -1.857  -1.101  0.00  0.00    +0.142 HD
ENDBRANCH  13  18
ENDBRANCH   4   6
BRANCH   1  24
ATOM     21  N   LIG    1        4.269  -0.191  -0.476  0.00  0.00    -0.327 N 
ATOM     22  C   LIG    1        3.430   0.083   0.714  0.00  0.00    +0.120 C 
ATOM     23  C   LIG    1        2.051  -0.608   0.579  0.00  0.00    +0.104 C 
ATOM     24  N   LIG    1        1.317  -0.239  -0.660  0.00  0.00    -0.293 NA
ATOM     25  C   LIG    1        2.205  -0.533  -1.815  0.00  0.00    +0.104 C 
ATOM     26  C   LIG    1        3.576   0.178  -1.725  0.00  0.00    +0.120 C 
BRANCH  21  30
ATOM     27  C   LIG    1        8.341   0.870   0.049  0.00  0.00    +0.052 A 
ATOM     28  C   LIG    1        7.591   1.483  -0.954  0.00  0.00    +0.020 A 
ATOM     29  C   LIG    1        6.244   1.142  -1.138  0.00  0.00    +0.024 A 
ATOM     30  C   LIG    1        5.610   0.192  -0.323  0.00  0.00    +0.030 A 
ATOM     31  C   LIG    1        6.392  -0.419   0.672  0.00  0.00    +0.024 A 
ATOM     32  C   LIG    1        7.739  -0.088   0.863  0.00  0.00    +0.020 A 
BRANCH  27  34
ATOM     33  N   LIG    1       10.836   1.496   0.387  0.00  0.00    -0.191 NA
ATOM     34  C   LIG    1        9.720   1.215   0.236  0.00  0.00    +0.099 C 
ENDBRANCH  27  34
ENDBRANCH  21  30
ENDBRANCH   1  24
TORSDOF 5