REMARK  Name = BDB053773
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.147  -0.032  -0.782  0.00  0.00    +0.066 A 
ATOM      2  C   LIG    1        1.192  -1.040  -1.785  0.00  0.00    +0.016 A 
ATOM      3  C   LIG    1        0.053  -1.833  -1.636  0.00  0.00    +0.073 A 
ATOM      4  C   LIG    1       -0.140  -2.961  -2.436  0.00  0.00    +0.137 A 
ATOM      5  N   LIG    1        0.756  -3.261  -3.404  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1        1.832  -2.467  -3.572  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1       -0.692  -1.313  -0.581  0.00  0.00    -0.310 N 
ATOM      8  C   LIG    1        2.112  -1.356  -2.797  0.00  0.00    +0.030 A 
ATOM      9  C   LIG    1       -0.059  -0.171  -0.098  0.00  0.00    +0.041 A 
ENDROOT
BRANCH   1  11
ATOM     10  O   LIG    1        2.367   1.840  -1.470  0.00  0.00    -0.270 OA
ATOM     11  C   LIG    1        2.131   1.026  -0.581  0.00  0.00    +0.249 C 
ATOM     12  N   LIG    1        2.776   1.058   0.650  0.00  0.00    -0.295 N 
ATOM     13  C   LIG    1        2.758  -0.034   1.631  0.00  0.00    +0.123 C 
ATOM     14  C   LIG    1        4.049  -0.076   2.468  0.00  0.00    +0.100 C 
ATOM     15  N   LIG    1        4.344   1.175   3.183  0.00  0.00    -0.313 NA
ATOM     16  H   LIG    1        5.348   1.228   3.356  0.00  0.00    +0.122 HD
ATOM     17  C   LIG    1        3.900   2.368   2.441  0.00  0.00    +0.100 C 
ATOM     18  C   LIG    1        3.689   2.164   0.932  0.00  0.00    +0.123 C 
ENDBRANCH   1  11
BRANCH   7  19
ATOM     19  C   LIG    1       -1.903  -1.875  -0.091  0.00  0.00    +0.047 A 
ATOM     20  C   LIG    1       -2.937  -2.186  -0.981  0.00  0.00    +0.026 A 
ATOM     21  C   LIG    1       -4.123  -2.740  -0.497  0.00  0.00    +0.002 A 
ATOM     22  C   LIG    1       -4.273  -2.991   0.867  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1       -3.238  -2.688   1.753  0.00  0.00    +0.002 A 
ATOM     24  C   LIG    1       -2.051  -2.129   1.277  0.00  0.00    +0.026 A 
ENDBRANCH   7  19
BRANCH   9  25
ATOM     25  C   LIG    1       -0.687   0.801   0.868  0.00  0.00    +0.089 C 
BRANCH  25  26
ATOM     26  C   LIG    1       -1.808   1.606   0.247  0.00  0.00    -0.042 A 
ATOM     27  C   LIG    1       -1.535   2.554  -0.751  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1       -2.568   3.292  -1.331  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1       -3.884   3.093  -0.920  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -4.169   2.156   0.071  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1       -3.137   1.417   0.653  0.00  0.00    +0.004 A 
ENDBRANCH  25  26
ENDBRANCH   9  25
TORSDOF 4