REMARK  Name = BDB057770
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.646  -0.490   0.384  0.00  0.00    -0.282 N 
ATOM      2  H   LIG    1       -0.058   0.318   0.545  0.00  0.00    +0.155 HD
ATOM      3  C   LIG    1       -0.090  -1.737   0.603  0.00  0.00    +0.248 C 
ATOM      4  O   LIG    1       -0.674  -2.814   0.606  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1   8
ATOM      5  C   LIG    1       -4.638   0.558  -0.651  0.00  0.00    -0.043 A 
ATOM      6  C   LIG    1       -4.256  -0.789  -0.568  0.00  0.00    +0.006 A 
ATOM      7  C   LIG    1       -2.950  -1.166  -0.225  0.00  0.00    +0.023 A 
ATOM      8  C   LIG    1       -1.983  -0.199   0.039  0.00  0.00    +0.034 A 
ATOM      9  C   LIG    1       -2.342   1.149  -0.055  0.00  0.00    +0.023 A 
ATOM     10  C   LIG    1       -3.648   1.518  -0.397  0.00  0.00    +0.006 A 
BRANCH   5  12
ATOM     11  C   LIG    1       -7.219   0.450  -0.224  0.00  0.00    +0.059 C 
ATOM     12  C   LIG    1       -6.043   0.955  -1.033  0.00  0.00    +0.037 C 
ATOM     13  C   LIG    1       -6.833   1.894  -0.150  0.00  0.00    +0.028 C 
BRANCH  11  14
ATOM     14  N   LIG    1       -8.457   0.087  -0.914  0.00  0.00    -0.327 NA
ATOM     15  H   LIG    1       -8.420  -0.883  -1.229  0.00  0.00    +0.118 HD
ATOM     16  H   LIG    1       -9.252   0.146  -0.279  0.00  0.00    +0.118 HD
ENDBRANCH  11  14
ENDBRANCH   5  12
ENDBRANCH   1   8
BRANCH   3  17
ATOM     17  C   LIG    1        1.367  -1.738   0.906  0.00  0.00    +0.041 A 
ATOM     18  C   LIG    1        2.243  -0.813   0.334  0.00  0.00    +0.043 A 
ATOM     19  C   LIG    1        3.597  -0.872   0.659  0.00  0.00    +0.090 A 
ATOM     20  N   LIG    1        4.082  -1.819   1.509  0.00  0.00    -0.253 NA
ATOM     21  C   LIG    1        3.216  -2.716   2.031  0.00  0.00    +0.112 A 
ATOM     22  C   LIG    1        1.864  -2.719   1.761  0.00  0.00    +0.033 A 
BRANCH  19  23
ATOM     23  C   LIG    1        4.585   0.080   0.098  0.00  0.00    +0.090 A 
ATOM     24  N   LIG    1        4.107   1.016  -0.769  0.00  0.00    -0.253 NA
ATOM     25  C   LIG    1        4.974   1.910  -1.294  0.00  0.00    +0.112 A 
ATOM     26  C   LIG    1        6.323   1.922  -1.012  0.00  0.00    +0.035 A 
ATOM     27  C   LIG    1        6.809   0.951  -0.142  0.00  0.00    +0.062 A 
ATOM     28  C   LIG    1        5.935   0.030   0.437  0.00  0.00    +0.045 A 
BRANCH  27  29
ATOM     29  C   LIG    1        8.252   0.958   0.177  0.00  0.00    +0.337 C 
ATOM     30  O   LIG    1        8.898   1.987   0.272  0.00  0.00    -0.245 OA
BRANCH  29  31
ATOM     31  O   LIG    1        8.786  -0.274   0.302  0.00  0.00    -0.477 OA
ATOM     32  H   LIG    1        8.204  -1.014   0.050  0.00  0.00    +0.295 HD
ENDBRANCH  29  31
ENDBRANCH  27  29
ENDBRANCH  19  23
ENDBRANCH   3  17
TORSDOF 7