REMARK  Name = BDB015992
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.138   0.534  -0.034  0.00  0.00    +0.162 A 
ATOM      2  N   LIG    1       -0.089   0.314  -0.543  0.00  0.00    -0.212 NA
ATOM      3  C   LIG    1       -1.086   1.160  -0.206  0.00  0.00    +0.132 A 
ATOM      4  C   LIG    1       -0.863   2.251   0.634  0.00  0.00    +0.060 A 
ATOM      5  C   LIG    1        0.430   2.385   1.101  0.00  0.00    +0.126 A 
ATOM      6  N   LIG    1        1.443   1.552   0.790  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        4.557  -1.157  -0.230  0.00  0.00    -0.014 A 
ATOM      8  C   LIG    1        3.522  -0.270   0.110  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1        2.214  -0.408  -0.403  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        1.980  -1.482  -1.282  0.00  0.00    +0.011 A 
ATOM     11  C   LIG    1        2.996  -2.374  -1.630  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        4.277  -2.212  -1.106  0.00  0.00    +0.008 A 
BRANCH   7  17
ATOM     13  C   LIG    1        9.487  -1.180   0.386  0.00  0.00    +0.172 C 
ATOM     14  N   LIG    1        8.070  -0.993   0.581  0.00  0.00    -0.274 N 
ATOM     15  N   LIG    1        7.630  -0.394   1.701  0.00  0.00    -0.179 NA
ATOM     16  C   LIG    1        6.303  -0.381   1.546  0.00  0.00    +0.142 A 
ATOM     17  C   LIG    1        5.886  -0.976   0.331  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1        7.067  -1.360  -0.270  0.00  0.00    +0.116 A 
ENDBRANCH   7  17
ENDBRANCH   1   9
BRANCH   4  19
ATOM     19  C   LIG    1       -1.905   3.186   1.048  0.00  0.00    +0.097 A 
ATOM     20  N   LIG    1       -3.172   2.783   1.254  0.00  0.00    -0.171 NA
ATOM     21  N   LIG    1       -3.829   3.898   1.617  0.00  0.00    -0.274 N 
ATOM     22  C   LIG    1       -5.242   3.827   1.898  0.00  0.00    +0.172 C 
ATOM     23  C   LIG    1       -3.035   5.002   1.674  0.00  0.00    +0.108 A 
ATOM     24  C   LIG    1       -1.779   4.578   1.311  0.00  0.00    +0.049 A 
ENDBRANCH   4  19
BRANCH   3  25
ATOM     25  N   LIG    1       -2.344   0.980  -0.807  0.00  0.00    -0.325 N 
ATOM     26  H   LIG    1       -3.074   1.301  -0.163  0.00  0.00    +0.148 HD
BRANCH  25  27
ATOM     27  C   LIG    1       -2.618  -0.301  -1.436  0.00  0.00    +0.076 C 
ATOM     28  C   LIG    1       -2.694  -1.512  -0.494  0.00  0.00    +0.027 C 
ATOM     29  C   LIG    1       -3.563  -2.537  -1.257  0.00  0.00    +0.009 C 
ATOM     30  C   LIG    1       -4.547  -3.053  -0.215  0.00  0.00    +0.084 C 
ATOM     31  N   LIG    1       -4.757  -1.901   0.655  0.00  0.00    -0.315 NA
ATOM     32  H   LIG    1       -5.148  -2.188   1.550  0.00  0.00    +0.122 HD
ATOM     33  C   LIG    1       -4.231  -1.760  -2.406  0.00  0.00    +0.007 C 
ATOM     34  C   LIG    1       -3.422  -1.326   0.842  0.00  0.00    +0.086 C 
ATOM     35  C   LIG    1       -3.984  -0.287  -2.114  0.00  0.00    +0.023 C 
ENDBRANCH  25  27
ENDBRANCH   3  25
TORSDOF 5