REMARK  Name = BDB057370
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.190   0.543   0.319  0.00  0.00    +0.084 A 
ATOM      2  C   LIG    1       -0.737   0.487  -0.023  0.00  0.00    +0.061 A 
ATOM      3  C   LIG    1        0.212   1.433   0.298  0.00  0.00    +0.147 A 
ATOM      4  N   LIG    1        1.531   1.244   0.052  0.00  0.00    -0.196 NA
ATOM      5  C   LIG    1        1.939   0.135  -0.581  0.00  0.00    +0.220 A 
ATOM      6  N   LIG    1        1.074  -0.803  -0.981  0.00  0.00    -0.222 NA
ATOM      7  N   LIG    1       -0.070   2.667   0.875  0.00  0.00    -0.321 N 
ATOM      8  H   LIG    1        0.788   3.201   0.945  0.00  0.00    +0.169 HD
ATOM      9  C   LIG    1       -1.185   3.390   0.684  0.00  0.00    +0.180 A 
ATOM     10  N   LIG    1       -1.193   4.727   0.679  0.00  0.00    -0.154 NA
ATOM     11  N   LIG    1       -2.476   5.041   0.430  0.00  0.00    -0.278 N 
ATOM     12  H   LIG    1       -2.726   6.023   0.384  0.00  0.00    +0.189 HD
ATOM     13  C   LIG    1       -3.295   3.958   0.288  0.00  0.00    +0.060 A 
ATOM     14  C   LIG    1       -4.750   4.076   0.055  0.00  0.00    +0.067 C 
ATOM     15  C   LIG    1       -2.474   2.869   0.449  0.00  0.00    +0.129 A 
ATOM     16  C   LIG    1       -0.231  -0.607  -0.700  0.00  0.00    +0.128 A 
ATOM     17  N   LIG    1       -2.964   1.571   0.491  0.00  0.00    -0.241 NA
ENDROOT
BRANCH   1  22
ATOM     18  C   LIG    1       -4.935  -4.525   0.964  0.00  0.00    +0.044 C 
ATOM     19  C   LIG    1       -4.238  -3.204   0.822  0.00  0.00    -0.050 A 
ATOM     20  C   LIG    1       -3.081  -2.931   1.565  0.00  0.00    +0.004 A 
ATOM     21  C   LIG    1       -2.414  -1.713   1.415  0.00  0.00    +0.010 A 
ATOM     22  C   LIG    1       -2.893  -0.770   0.499  0.00  0.00    +0.001 A 
ATOM     23  C   LIG    1       -4.050  -1.029  -0.241  0.00  0.00    +0.010 A 
ATOM     24  C   LIG    1       -4.712  -2.248  -0.087  0.00  0.00    +0.004 A 
ENDBRANCH   1  22
BRANCH   5  25
ATOM     25  N   LIG    1        3.295  -0.028  -0.862  0.00  0.00    -0.297 N 
ATOM     26  C   LIG    1        3.699  -1.420  -1.103  0.00  0.00    +0.123 C 
ATOM     27  C   LIG    1        5.194  -1.509  -1.491  0.00  0.00    +0.103 C 
ATOM     28  N   LIG    1        6.132  -0.804  -0.591  0.00  0.00    -0.302 NA
ATOM     29  C   LIG    1        6.261  -1.485   0.696  0.00  0.00    +0.105 C 
ATOM     30  C   LIG    1        5.666   0.590  -0.428  0.00  0.00    +0.103 C 
ATOM     31  C   LIG    1        4.189   0.757   0.000  0.00  0.00    +0.123 C 
ENDBRANCH   5  25
TORSDOF 2