REMARK  Name = BDB000201
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.499  -1.541  -0.377  0.00  0.00    +0.159 C 
ATOM      2  C   LIG    1       -0.009  -1.395   1.079  0.00  0.00    +0.237 C 
ATOM      3  O   LIG    1       -0.668  -0.882   1.982  0.00  0.00    -0.274 OA
ATOM      4  N   LIG    1        1.256  -1.894   1.281  0.00  0.00    -0.285 N 
ATOM      5  C   LIG    1        1.994  -2.555   0.226  0.00  0.00    +0.077 C 
ATOM      6  C   LIG    1        3.378  -2.795   0.824  0.00  0.00    +0.025 C 
ATOM      7  C   LIG    1        3.090  -2.919   2.322  0.00  0.00    +0.034 C 
ATOM      8  C   LIG    1        1.988  -1.716  -1.047  0.00  0.00    +0.025 C 
ATOM      9  C   LIG    1        1.973  -1.897   2.556  0.00  0.00    +0.162 C 
ATOM     10  C   LIG    1        0.612  -1.091  -1.339  0.00  0.00    +0.033 C 
ENDROOT
BRANCH   1  12
ATOM     11  C   LIG    1       -2.519  -0.900  -1.675  0.00  0.00    +0.230 C 
ATOM     12  N   LIG    1       -1.716  -0.773  -0.567  0.00  0.00    -0.303 N 
ATOM     13  H   LIG    1       -1.896   0.031   0.032  0.00  0.00    +0.149 HD
ATOM     14  O   LIG    1       -2.330  -1.743  -2.546  0.00  0.00    -0.274 OA
BRANCH  11  15
ATOM     15  C   LIG    1       -3.712   0.088  -1.675  0.00  0.00    +0.137 C 
BRANCH  15  16
ATOM     16  N   LIG    1       -3.295   1.363  -1.039  0.00  0.00    -0.320 NA
ATOM     17  H   LIG    1       -2.644   1.833  -1.669  0.00  0.00    +0.119 HD
ATOM     18  H   LIG    1       -4.105   1.975  -0.965  0.00  0.00    +0.119 HD
ENDBRANCH  15  16
BRANCH  15  20
ATOM     19  C   LIG    1       -5.488   1.166  -3.176  0.00  0.00    +0.006 C 
ATOM     20  C   LIG    1       -4.242   0.296  -3.101  0.00  0.00    +0.024 C 
ENDBRANCH  15  20
ENDBRANCH  11  15
ENDBRANCH   1  12
BRANCH   9  21
ATOM     21  C   LIG    1        2.515  -0.478   2.839  0.00  0.00    +0.234 C 
ATOM     22  N   LIG    1        1.522   0.435   3.136  0.00  0.00    -0.310 N 
ATOM     23  H   LIG    1        0.565   0.133   2.956  0.00  0.00    +0.149 HD
ATOM     24  O   LIG    1        3.707  -0.185   2.794  0.00  0.00    -0.274 OA
BRANCH  22  25
ATOM     25  C   LIG    1        1.766   1.854   3.073  0.00  0.00    +0.139 C 
BRANCH  25  26
ATOM     26  C   LIG    1        1.444   2.375   1.694  0.00  0.00    -0.030 A 
ATOM     27  C   LIG    1        0.137   2.762   1.363  0.00  0.00    +0.005 A 
ATOM     28  C   LIG    1       -0.163   3.209   0.076  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        0.834   3.260  -0.896  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        2.133   2.862  -0.583  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1        2.436   2.418   0.705  0.00  0.00    +0.005 A 
ENDBRANCH  25  26
ENDBRANCH  22  25
ENDBRANCH   9  21
TORSDOF 7