REMARK  Name = BDB057106
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.190  -1.039   2.996  0.00  0.00    +0.182 C 
ENDROOT
BRANCH   1   2
ATOM      2  N   LIG    1       -3.145  -1.019   1.892  0.00  0.00    -0.224 N 
ATOM      3  C   LIG    1       -3.780  -2.196   1.513  0.00  0.00    +0.275 A 
ATOM      4  O   LIG    1       -3.632  -3.276   2.081  0.00  0.00    -0.266 OA
ATOM      5  C   LIG    1       -4.664  -2.113   0.336  0.00  0.00    +0.050 A 
ATOM      6  C   LIG    1       -4.844  -0.893  -0.311  0.00  0.00    +0.015 A 
ATOM      7  C   LIG    1       -5.600  -0.851  -1.491  0.00  0.00    +0.011 A 
ATOM      8  C   LIG    1       -6.213  -2.009  -1.980  0.00  0.00    +0.001 A 
ATOM      9  C   LIG    1       -6.062  -3.218  -1.306  0.00  0.00    +0.001 A 
ATOM     10  C   LIG    1       -4.165   0.278   0.279  0.00  0.00    +0.102 A 
ATOM     11  C   LIG    1       -5.281  -3.275  -0.153  0.00  0.00    +0.014 A 
ATOM     12  N   LIG    1       -3.353   0.199   1.288  0.00  0.00    -0.167 NA
BRANCH  10  13
ATOM     13  C   LIG    1       -4.364   1.623  -0.229  0.00  0.00    +0.040 A 
ATOM     14  C   LIG    1       -5.543   2.247  -0.593  0.00  0.00    +0.118 A 
ATOM     15  N   LIG    1       -5.212   3.521  -0.955  0.00  0.00    -0.274 N 
ATOM     16  C   LIG    1       -6.107   4.561  -1.402  0.00  0.00    +0.172 C 
ATOM     17  N   LIG    1       -3.898   3.781  -0.851  0.00  0.00    -0.179 NA
ATOM     18  C   LIG    1       -3.390   2.640  -0.378  0.00  0.00    +0.144 A 
ENDBRANCH  10  13
ENDBRANCH   1   2
BRANCH   1  22
ATOM     19  C   LIG    1        1.852  -1.506   1.534  0.00  0.00    +0.037 A 
ATOM     20  C   LIG    1        1.097  -2.629   1.889  0.00  0.00    +0.013 A 
ATOM     21  C   LIG    1       -0.209  -2.479   2.362  0.00  0.00    +0.006 A 
ATOM     22  C   LIG    1       -0.769  -1.202   2.504  0.00  0.00    -0.026 A 
ATOM     23  C   LIG    1       -0.006  -0.080   2.154  0.00  0.00    +0.006 A 
ATOM     24  C   LIG    1        1.300  -0.227   1.679  0.00  0.00    +0.013 A 
BRANCH  19  27
ATOM     25  N   LIG    1        3.706  -0.791   0.121  0.00  0.00    -0.308 N 
ATOM     26  H   LIG    1        3.102  -0.042  -0.185  0.00  0.00    +0.149 HD
ATOM     27  C   LIG    1        3.237  -1.717   1.031  0.00  0.00    +0.244 C 
ATOM     28  O   LIG    1        3.887  -2.686   1.407  0.00  0.00    -0.270 OA
BRANCH  25  33
ATOM     29  C   LIG    1        7.142   2.595  -1.598  0.00  0.00    +0.104 C 
ATOM     30  N   LIG    1        7.116   1.222  -1.101  0.00  0.00    -0.305 NA
ATOM     31  C   LIG    1        6.471   1.155   0.218  0.00  0.00    +0.086 C 
ATOM     32  C   LIG    1        6.083  -0.273   0.591  0.00  0.00    +0.037 C 
ATOM     33  C   LIG    1        5.067  -0.852  -0.406  0.00  0.00    +0.076 C 
ATOM     34  C   LIG    1        5.137  -0.154  -1.771  0.00  0.00    +0.037 C 
ATOM     35  C   LIG    1        6.563   0.284  -2.086  0.00  0.00    +0.086 C 
ENDBRANCH  25  33
ENDBRANCH  19  27
ENDBRANCH   1  22
TORSDOF 5