COMPND      HEPTANE
AUTHOR      DAVE WOODCOCK  96 01 05
ATOM      1  C           1      -3.721   0.559  -0.573  1.00  0.00
ATOM      2  C           1      -2.486  -0.350  -0.500  1.00  0.00
ATOM      3  C           1      -1.223   0.467  -0.214  1.00  0.00
ATOM      4  C           1      -0.001  -0.456  -0.145  1.00  0.00
ATOM      5  C           1       1.262   0.362   0.143  1.00  0.00
ATOM      6  C           1       2.484  -0.559   0.211  1.00  0.00
ATOM      7  C           1       3.747   0.256   0.499  1.00  0.00
ATOM      8  H           1      -3.845   1.076   0.379  1.00  0.00
ATOM      9  H           1      -4.606  -0.049  -0.766  1.00  0.00
ATOM     10  H           1      -3.601   1.292  -1.372  1.00  0.00
ATOM     11  H           1      -2.373  -0.870  -1.453  1.00  0.00
ATOM     12  H           1      -2.632  -1.083   0.294  1.00  0.00
ATOM     13  H           1      -1.335   0.986   0.739  1.00  0.00
ATOM     14  H           1      -1.076   1.199  -1.008  1.00  0.00
ATOM     15  H           1       0.114  -0.974  -1.098  1.00  0.00
ATOM     16  H           1      -0.146  -1.189   0.650  1.00  0.00
ATOM     17  H           1       1.147   0.880   1.096  1.00  0.00
ATOM     18  H           1       1.407   1.094  -0.652  1.00  0.00
ATOM     19  H           1       2.603  -1.078  -0.741  1.00  0.00
ATOM     20  H           1       2.343  -1.292   1.007  1.00  0.00
ATOM     21  H           1       3.641   0.773   1.453  1.00  0.00
ATOM     22  H           1       3.901   0.988  -0.295  1.00  0.00
ATOM     23  H           1       4.606  -0.414   0.544  1.00  0.00
TER      24              1
END