CCL Home Page
Up Directory CCL chemx.test
                      SEBROG            10.830  21.196   8.872
                       90.000  90.000  90.000
  50   0  8-Chloro-7-hydroxy-3-methyl-5-phenyl-1,2,4,5-tetrahydro-3-b
   0 10 J.G.Berger,W.K.Chang,J.W.Clader,D.Hou,R.E.Chipkin,A.T.McPha
   1 C1     -0.15390   0.33230   0.29810    2  11  29  30   0   0   0   0   0.000   0
   2 C2     -0.11540   0.34430   0.45740    1   3  31  32   0   0   0   0   0.000   0
   3 N1      0.00730   0.31740   0.50010    2   4  12  33   0   0   0   0   0.000   0
   4 C3      0.11560   0.34510   0.41710    3   5  34  35   0   0   0   0   0.000   0
   5 C4      0.11680   0.32820   0.24930    4   6  15  36   0   0   0   0   0.000   0
   6 C5      0.03450   0.37240   0.15400    5   7  11   0   0   0   0   0   0.000   0
   7 C6      0.08480   0.41020   0.04430    6   8  37   0   0   0   0   0   0.000   0
   8 C7      0.01180   0.45000  -0.04340    7   9  13   0   0   0   0   0   0.000   0
   9 C8     -0.11490   0.44930  -0.01870    8  10  14   0   0   0   0   0   0.000   0
  10 C9     -0.16580   0.41210   0.08870    9  11  38   0   0   0   0   0   0.000   0
  11 C10    -0.09340   0.37300   0.17810   10   1   6   0   0   0   0   0   0.000   0
  12 C11     0.02770   0.32300   0.66580    3  39  40  41   0   0   0   0   0.000   0
  13 O1      0.05830   0.48760  -0.15230    8  42   0   0   0   0   0   0   0.000   0
  14 CL1    -0.20743   0.49842  -0.12875    9   0   0   0   0   0   0   0   0.000   0
  15 C12     0.24990   0.32650   0.19320    5  16  20   0   0   0   0   0   0.000   0
  16 C13     0.33550   0.37230   0.23610   15  17  43   0   0   0   0   0   0.000   0
  17 C14     0.45410   0.37080   0.18190   16  18  44   0   0   0   0   0   0.000   0
  18 C15     0.49010   0.32520   0.08050   17  19  45   0   0   0   0   0   0.000   0
  19 C16     0.40800   0.27990   0.03980   18  46  20   0   0   0   0   0   0.000   0
  20 C17     0.28730   0.28000   0.09640   15  47  19   0   0   0   0   0   0.000   0
  21 C18     0.51960   0.33750  -0.39420   22  25  26   0   0   0   0   0   0.000   0
  22 C19     0.55360   0.39920  -0.33000   21  23  48   0   0   0   0   0   0.000   0
  23 C20     0.48550   0.44270  -0.26000   22  24  49   0   0   0   0   0   0.000   0
  24 C21     0.35100   0.44390  -0.22540   23  27  28   0   0   0   0   0   0.000   0
  25 O2      0.60130   0.30470  -0.44970   21   0   0   0   0   0   0   0   0.000   0
  26 O3      0.40840   0.31870  -0.38990   21  50   0   0   0   0   0   0   0.000   0
  27 O4      0.28340   0.39790  -0.26740   24   0   0   0   0   0   0   0   0.000   0
  28 O5      0.30870   0.48920  -0.15520   24   0   0   0   0   0   0   0   0.000   0
  29 H1     -0.24970   0.33950   0.29140    1   0   0   0   0   0   0   0   0.000   0
  30 H2     -0.13360   0.28500   0.27310    1   0   0   0   0   0   0   0   0.000   0
  31 H3     -0.18240   0.32460   0.52880    2   0   0   0   0   0   0   0   0.000   0
  32 H4     -0.11190   0.39330   0.47390    2   0   0   0   0   0   0   0   0.000   0
  33 H5      0.00330   0.27210   0.46930    3   0   0   0   0   0   0   0   0.000   0
  34 H6      0.19720   0.32810   0.46640    4   0   0   0   0   0   0   0   0.000   0
  35 H7      0.11220   0.39440   0.42750    4   0   0   0   0   0   0   0   0.000   0
  36 H8      0.07790   0.28310   0.23640    5   0   0   0   0   0   0   0   0.000   0
  37 H9      0.17600   0.40910   0.02690    7   0   0   0   0   0   0   0   0.000   0
  38 H10    -0.25730   0.41280   0.10400   10   0   0   0   0   0   0   0   0.000   0
  39 H11     0.11420   0.30390   0.69360   12   0   0   0   0   0   0   0   0.000   0
  40 H12     0.02510   0.37080   0.69710   12   0   0   0   0   0   0   0   0.000   0
  41 H13    -0.04190   0.29830   0.72330   12   0   0   0   0   0   0   0   0.000   0
  42 H14     0.14600   0.48800  -0.15300   13   0   0   0   0   0   0   0   0.000   0
  43 H15     0.31010   0.40660   0.30710   16   0   0   0   0   0   0   0   0.000   0
  44 H16     0.51510   0.40320   0.21640   17   0   0   0   0   0   0   0   0.000   0
  45 H17     0.57540   0.32550   0.03750   18   0   0   0   0   0   0   0   0.000   0
  46 H18     0.43410   0.24600  -0.03170   19   0   0   0   0   0   0   0   0.000   0
  47 H19     0.22830   0.24600   0.06600   20   0   0   0   0   0   0   0   0.000   0
  48 H20     0.64290   0.41040  -0.34070   22   0   0   0   0   0   0   0   0.000   0
  49 H21     0.53240   0.48060  -0.22510   23   0   0   0   0   0   0   0   0.000   0
  50 H22     0.34600   0.34500  -0.34500   26   0   0   0   0   0   0   0   0.000   0
Modified: Wed Feb 7 17:00:00 1996 GMT
Page accessed 4381 times since Sat Apr 17 22:01:44 1999 GMT