REMARK  Name = BDB063340
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.551   0.785  -0.590  0.00  0.00    +0.045 A 
ATOM      2  C   LIG    1       -2.539   1.697  -0.126  0.00  0.00    +0.173 A 
ATOM      3  N   LIG    1       -3.739   1.717  -0.795  0.00  0.00    -0.253 N 
ATOM      4  C   LIG    1       -4.464   2.713  -0.208  0.00  0.00    +0.232 A 
ATOM      5  N   LIG    1       -3.784   3.235   0.788  0.00  0.00    -0.137 NA
ATOM      6  C   LIG    1       -4.021   0.883  -1.883  0.00  0.00    +0.203 A 
ATOM      7  N   LIG    1       -3.096   0.079  -2.339  0.00  0.00    -0.223 NA
ATOM      8  N   LIG    1       -2.568   2.592   0.843  0.00  0.00    -0.129 NA
ATOM      9  C   LIG    1       -1.884   0.054  -1.678  0.00  0.00    +0.126 A 
ENDROOT
BRANCH   1  14
ATOM     10  N   LIG    1        3.630   0.526   1.622  0.00  0.00    -0.342 N 
ATOM     11  C   LIG    1        2.359   0.361   1.103  0.00  0.00    +0.049 A 
ATOM     12  C   LIG    1        1.876   1.637   0.800  0.00  0.00    +0.000 A 
ATOM     13  C   LIG    1        0.586   1.771   0.246  0.00  0.00    +0.018 A 
ATOM     14  C   LIG    1       -0.198   0.633  -0.005  0.00  0.00    -0.012 A 
ATOM     15  C   LIG    1        0.310  -0.630   0.323  0.00  0.00    +0.011 A 
ATOM     16  C   LIG    1        2.886   2.571   1.159  0.00  0.00    +0.027 A 
ATOM     17  C   LIG    1        1.588  -0.790   0.875  0.00  0.00    +0.027 A 
ATOM     18  C   LIG    1        3.949   1.862   1.666  0.00  0.00    +0.087 A 
BRANCH  10  19
ATOM     19  C   LIG    1        4.501  -0.534   2.118  0.00  0.00    +0.157 C 
BRANCH  19  23
ATOM     20  C   LIG    1        7.744  -1.401  -0.595  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1        6.433  -1.698  -0.962  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1        5.382  -1.417  -0.087  0.00  0.00    +0.005 A 
ATOM     23  C   LIG    1        5.631  -0.834   1.165  0.00  0.00    -0.028 A 
ATOM     24  C   LIG    1        6.956  -0.540   1.520  0.00  0.00    +0.005 A 
ATOM     25  C   LIG    1        8.006  -0.823   0.644  0.00  0.00    +0.000 A 
ENDBRANCH  19  23
ENDBRANCH  10  19
ENDBRANCH   1  14
BRANCH   6  26
ATOM     26  N   LIG    1       -5.245   0.893  -2.521  0.00  0.00    -0.307 N 
ATOM     27  H   LIG    1       -5.155   0.276  -3.327  0.00  0.00    +0.149 HD
BRANCH  26  28
ATOM     28  C   LIG    1       -6.470   0.537  -1.803  0.00  0.00    +0.178 C 
BRANCH  28  29
ATOM     29  C   LIG    1       -6.388  -0.700  -0.981  0.00  0.00    +0.122 A 
ATOM     30  O   LIG    1       -6.064  -0.529   0.333  0.00  0.00    -0.466 OA
ATOM     31  C   LIG    1       -6.016  -1.764   0.895  0.00  0.00    +0.195 A 
ATOM     32  C   LIG    1       -6.307  -2.728  -0.041  0.00  0.00    +0.041 A 
ATOM     33  C   LIG    1       -6.547  -2.042  -1.256  0.00  0.00    +0.046 A 
ENDBRANCH  28  29
ENDBRANCH  26  28
ENDBRANCH   6  26
TORSDOF 6