HEADER
HETATM    1  C1  ORG A   1      -2.115   2.511  -1.057
HETATM    2  H1  ORG A   1      -1.461   2.898  -1.843
HETATM    3  N1  ORG A   1      -3.452   2.371  -1.605
HETATM    4  C2  ORG A   1      -1.605   1.180  -0.549
HETATM    5  H2  ORG A   1      -2.164   3.232  -0.238
HETATM    6  H3  ORG A   1      -3.359   1.908  -2.502
HETATM    7  H4  ORG A   1      -3.940   1.734  -0.989
HETATM    8  O1  ORG A   1      -2.355   0.187  -0.595
HETATM    9  C3  ORG A   1       0.305  -0.136   0.417
HETATM   10  H5  ORG A   1       1.339   0.087   0.726
HETATM   11  N2  ORG A   1      -0.290   1.102  -0.020
HETATM   12  C4  ORG A   1       0.358  -1.145  -0.719
HETATM   13  C5  ORG A   1      -0.433  -0.680   1.652
HETATM   14  H6  ORG A   1       0.247   1.949   0.071
HETATM   15  O2  ORG A   1       1.002  -0.813  -1.907
HETATM   16  O3  ORG A   1      -0.151  -2.274  -0.586
HETATM   17  H7  ORG A   1       1.269   0.116  -1.839
HETATM   18  H8  ORG A   1      -0.441   0.081   2.440
HETATM   19  H9  ORG A   1      -1.457  -0.927   1.380
HETATM   20  H10 ORG A   1       0.070  -1.579   2.023
CONECT    1    2    3    4    5
CONECT    2    1
CONECT    3    1    6    7
CONECT    4    1    8   11
CONECT    5    1
CONECT    6    3
CONECT    7    3
CONECT    8    4
CONECT    9   10   11   12   13
CONECT   10    9
CONECT   11    9   14    4
CONECT   12    9   15   16
CONECT   13    9   18   19   20
CONECT   14   11
CONECT   15   12   17
CONECT   16   12
CONECT   17   15
CONECT   18   13
CONECT   19   13
CONECT   20   13
END  
