REMARK  Name = BDB007996
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -1.528  -0.145  -0.575  0.00  0.00    -0.303 NA
ATOM      2  H   LIG    1       -1.787   0.838  -0.656  0.00  0.00    +0.123 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1       -0.226  -0.322  -1.239  0.00  0.00    +0.178 C 
BRANCH   3   5
ATOM      4  N   LIG    1        1.543   0.393   0.410  0.00  0.00    -0.299 N 
ATOM      5  C   LIG    1        0.760   0.720  -0.692  0.00  0.00    +0.229 C 
ATOM      6  O   LIG    1        0.804   1.837  -1.221  0.00  0.00    -0.274 OA
BRANCH   4   8
ATOM      7  C   LIG    1        2.347  -1.952   0.669  0.00  0.00    +0.024 C 
ATOM      8  C   LIG    1        1.420  -0.856   1.164  0.00  0.00    +0.104 C 
ENDBRANCH   4   8
BRANCH   4   9
ATOM      9  C   LIG    1        2.513   1.391   0.879  0.00  0.00    +0.123 C 
BRANCH   9  10
ATOM     10  C   LIG    1        3.735   1.587  -0.049  0.00  0.00    +0.102 C 
BRANCH  10  11
ATOM     11  N   LIG    1        4.684   0.453  -0.081  0.00  0.00    -0.307 NA
ATOM     12  C   LIG    1        5.463   0.368   1.157  0.00  0.00    +0.104 C 
ATOM     13  C   LIG    1        5.591   0.592  -1.224  0.00  0.00    +0.104 C 
ENDBRANCH  10  11
ENDBRANCH   9  10
ENDBRANCH   4   9
ENDBRANCH   3   5
ENDBRANCH   1   3
BRANCH   1  14
ATOM     14  C   LIG    1       -2.547  -0.986  -1.213  0.00  0.00    +0.137 C 
BRANCH  14  15
ATOM     15  C   LIG    1       -3.877  -0.960  -0.481  0.00  0.00    +0.056 A 
ATOM     16  N   LIG    1       -4.333  -2.136   0.021  0.00  0.00    -0.259 NA
ATOM     17  C   LIG    1       -5.497  -2.131   0.706  0.00  0.00    +0.112 A 
ATOM     18  C   LIG    1       -6.266  -1.002   0.896  0.00  0.00    +0.034 A 
ATOM     19  C   LIG    1       -5.808   0.189   0.340  0.00  0.00    +0.062 A 
ATOM     20  C   LIG    1       -4.593   0.225  -0.347  0.00  0.00    +0.039 A 
BRANCH  19  21
ATOM     21  C   LIG    1       -6.620   1.408   0.536  0.00  0.00    +0.337 C 
ATOM     22  O   LIG    1       -7.200   1.659   1.577  0.00  0.00    -0.245 OA
BRANCH  21  23
ATOM     23  O   LIG    1       -6.689   2.182  -0.567  0.00  0.00    -0.477 OA
ATOM     24  H   LIG    1       -6.336   1.776  -1.380  0.00  0.00    +0.295 HD
ENDBRANCH  21  23
ENDBRANCH  19  21
ENDBRANCH  14  15
ENDBRANCH   1  14
TORSDOF 10