HEADER
HETATM    1  C1  ORG A   1      -0.352  -0.024   0.032
HETATM    2  O1  ORG A   1      -0.467   1.066  -0.562
HETATM    3  C2  ORG A   1      -0.185  -0.017   1.523
HETATM    4  C3  ORG A   1       0.517  -1.046   2.195
HETATM    5  C4  ORG A   1      -0.715   1.054   2.279
HETATM    6  H1  ORG A   1       0.957  -1.864   1.637
HETATM    7  C5  ORG A   1       0.664  -1.013   3.595
HETATM    8  H2  ORG A   1      -1.242   1.855   1.779
HETATM    9  H3  ORG A   1       1.201  -1.807   4.101
HETATM   10  C6  ORG A   1       0.120   0.051   4.339
HETATM   11  C7  ORG A   1      -0.567   1.087   3.679
HETATM   12  H4  ORG A   1       0.234   0.075   5.416
HETATM   13  H5  ORG A   1      -0.982   1.909   4.248
HETATM   14  C8  ORG A   1      -0.380  -1.296  -0.765
HETATM   15  C9  ORG A   1      -0.827  -2.502  -0.176
HETATM   16  C10 ORG A   1       0.022  -1.312  -2.126
HETATM   17  H6  ORG A   1      -1.168  -2.513   0.852
HETATM   18  C11 ORG A   1      -0.850  -3.700  -0.914
HETATM   19  O2  ORG A   1       0.456  -0.167  -2.787
HETATM   20  H7  ORG A   1      -1.194  -4.611  -0.443
HETATM   21  C12 ORG A   1      -0.434  -3.727  -2.261
HETATM   22  C13 ORG A   1      -0.001  -2.520  -2.856
HETATM   23  O3  ORG A   1      -0.479  -4.949  -2.932
HETATM   24  H8  ORG A   1       0.319  -2.502  -3.888
HETATM   25  H9  ORG A   1       0.367   0.569  -2.179
HETATM   26  C14 ORG A   1      -0.061  -4.943  -4.278
HETATM   27  H10 ORG A   1      -0.703  -4.278  -4.866
HETATM   28  H11 ORG A   1       0.984  -4.625  -4.346
HETATM   29  H12 ORG A   1      -0.150  -5.959  -4.667
CONECT    1    2    3   14
CONECT    2    1
CONECT    3    4    5    1
CONECT    4    3    6    7
CONECT    5    3    8   11
CONECT    6    4
CONECT    7    4    9   10
CONECT    8    5
CONECT    9    7
CONECT   10    7   11   12
CONECT   11   10   13    5
CONECT   12   10
CONECT   13   11
CONECT   14   15   16    1
CONECT   15   14   17   18
CONECT   16   14   19   22
CONECT   17   15
CONECT   18   15   20   21
CONECT   19   16   25
CONECT   20   18
CONECT   21   18   22   23
CONECT   22   21   24   16
CONECT   23   21   26
CONECT   24   22
CONECT   25   19
CONECT   26   23   27   28   29
CONECT   27   26
CONECT   28   26
CONECT   29   26
END  
