# MSI CERIUS2 DataModel File Version 1 0
(1 Model
 (A C Label vinyl)
 (2 Atom
  (A I ACL "6 C")
  (A D XYZ (1.4403 0.0943 0.52515))
  (A C Label C1)
 )
 (3 Atom
  (A I ACL "1 H")
  (A D XYZ (2.1763 -0.5447 0.70115))
  (A C Label H2)
 )
 (4 Atom
  (A I ACL "1 H")
  (A D XYZ (1.6213 1.0683 0.56815))
  (A C Label H3)
 )
 (5 Atom
  (A I ACL "6 C")
  (A D XYZ (0.2163 -0.3497 0.23515))
  (A C Label C4)
 )
 (6 Atom
  (A I ACL "1 H")
  (A D XYZ (-0.5197 0.2893 0.05915))
  (A C Label H5)
 )
 (7 Atom
  (A I ACL "108 X")
  (A D XYZ (0.0353 -1.3237 0.19215))
  (A C Label X6)
 )
 (8 Bond
  (A I Type 2)
  (A O Atom1 2)
  (A O Atom2 5)
 )
 (9 Bond
  (A O Atom1 2)
  (A O Atom2 4)
 )
 (10 Bond
  (A O Atom1 2)
  (A O Atom2 3)
 )
 (11 Bond
  (A O Atom1 5)
  (A O Atom2 7)
 )
 (12 Bond
  (A O Atom1 5)
  (A O Atom2 6)
 )
)
