REMARK  Name = BDB055674
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.441  -1.756  -0.232  0.00  0.00    +0.120 C 
ATOM      2  C   LIG    1       -0.192  -1.037   0.209  0.00  0.00    -0.021 A 
ATOM      3  C   LIG    1        0.883  -1.391  -0.613  0.00  0.00    -0.042 A 
ATOM      4  C   LIG    1        2.156  -0.895  -0.381  0.00  0.00    +0.012 A 
ATOM      5  C   LIG    1        2.361  -0.011   0.694  0.00  0.00    -0.017 A 
ATOM      6  C   LIG    1        1.272   0.314   1.534  0.00  0.00    +0.009 A 
ATOM      7  C   LIG    1        0.468  -2.380  -1.659  0.00  0.00    +0.038 C 
ATOM      8  C   LIG    1       -0.005  -0.203   1.301  0.00  0.00    +0.006 A 
ATOM      9  C   LIG    1       -1.062  -2.244  -1.645  0.00  0.00    +0.034 C 
ENDROOT
BRANCH   1  11
ATOM     10  C   LIG    1       -2.910   0.303  -0.708  0.00  0.00    +0.111 A 
ATOM     11  N   LIG    1       -2.658  -0.962  -0.176  0.00  0.00    -0.316 N 
ATOM     12  C   LIG    1       -3.827  -1.375   0.426  0.00  0.00    +0.135 A 
ATOM     13  C   LIG    1       -4.689  -0.323   0.260  0.00  0.00    +0.096 A 
ATOM     14  C   LIG    1       -6.007  -0.385   0.768  0.00  0.00    +0.047 A 
ATOM     15  C   LIG    1       -6.395  -1.499   1.415  0.00  0.00    +0.088 A 
ATOM     16  N   LIG    1       -5.523  -2.564   1.577  0.00  0.00    -0.327 N 
ATOM     17  H   LIG    1       -5.829  -3.401   2.058  0.00  0.00    +0.168 HD
ATOM     18  C   LIG    1       -4.212  -2.587   1.104  0.00  0.00    +0.275 A 
ATOM     19  O   LIG    1       -3.496  -3.569   1.268  0.00  0.00    -0.266 OA
ATOM     20  N   LIG    1       -4.144   0.701  -0.428  0.00  0.00    -0.232 NA
BRANCH  10  22
ATOM     21  C   LIG    1       -1.669   2.465  -0.846  0.00  0.00    +0.012 C 
ATOM     22  C   LIG    1       -1.959   1.131  -1.517  0.00  0.00    +0.071 C 
ENDBRANCH  10  22
ENDBRANCH   1  11
BRANCH   5  23
ATOM     23  C   LIG    1        3.690   0.574   0.936  0.00  0.00    -0.007 A 
ATOM     24  C   LIG    1        4.283   1.537   0.082  0.00  0.00    +0.028 A 
ATOM     25  C   LIG    1        5.585   1.990   0.372  0.00  0.00    +0.012 A 
ATOM     26  C   LIG    1        6.285   1.530   1.488  0.00  0.00    +0.001 A 
ATOM     27  C   LIG    1        5.697   0.600   2.335  0.00  0.00    +0.001 A 
ATOM     28  C   LIG    1        4.415   0.125   2.060  0.00  0.00    +0.009 A 
BRANCH  24  29
ATOM     29  C   LIG    1        3.627   2.104  -1.101  0.00  0.00    +0.180 A 
ATOM     30  N   LIG    1        2.279   2.280  -1.271  0.00  0.00    -0.239 N 
ATOM     31  H   LIG    1        1.514   2.053  -0.651  0.00  0.00    +0.192 HD
ATOM     32  N   LIG    1        2.022   2.839  -2.460  0.00  0.00    -0.046 NA
ATOM     33  N   LIG    1        3.209   3.029  -3.012  0.00  0.00    -0.023 NA
ATOM     34  N   LIG    1        4.212   2.591  -2.182  0.00  0.00    -0.108 NA
ENDBRANCH  24  29
ENDBRANCH   5  23
TORSDOF 4