# MSI CERIUS2 DataModel File Version 2 0
(1 Model
 (A I Id 1)
 (A C Label "benzyl")
 (2 Atom
  (A C ACL "6 C")
  (A D XYZ (1.1712199999999999 0.042500000000000003 -0.52759999999999996))
  (A I Id 1)
  (A C Label "C1")
 )
 (3 Atom
  (A C ACL "6 C")
  (A D XYZ (2.5683500000000001 -0.050610000000000002 -0.51868000000000003))
  (A I Id 2)
  (A C Label "C2")
 )
 (4 Atom
  (A C ACL "6 C")
  (A D XYZ (0.55108000000000001 1.2928599999999999 -0.52573000000000003))
  (A I Id 3)
  (A C Label "C3")
 )
 (5 Atom
  (A C ACL "6 C")
  (A D XYZ (-0.84748999999999997 1.3826099999999999 -0.52690999999999999))
  (A I Id 4)
  (A C Label "C4")
 )
 (6 Atom
  (A C ACL "6 C")
  (A D XYZ (-1.6214500000000001 0.21542 -0.52766000000000002))
  (A I Id 5)
  (A C Label "C5")
 )
 (7 Atom
  (A C ACL "6 C")
  (A D XYZ (-0.99997999999999998 -1.03729 -0.52837999999999996))
  (A I Id 6)
  (A C Label "C6")
 )
 (8 Atom
  (A C ACL "6 C")
  (A D XYZ (0.39789999999999998 -1.12721 -0.52791999999999994))
  (A I Id 7)
  (A C Label "C7")
 )
 (9 Atom
  (A C ACL "113 X")
  (A D XYZ (2.8247399999999998 -0.96448 -0.50168000000000001))
  (A I Id 8)
  (A C Label "X8")
 )
 (10 Bond
  (A O Atom1 2)
  (A O Atom2 4)
 )
 (11 Bond
  (A I Type 2)
  (A O Atom1 2)
  (A O Atom2 8)
 )
 (12 Bond
  (A O Atom1 2)
  (A O Atom2 3)
 )
 (13 Bond
  (A O Atom1 3)
  (A O Atom2 9)
 )
 (14 Bond
  (A I Type 2)
  (A O Atom1 4)
  (A O Atom2 5)
 )
 (15 Bond
  (A O Atom1 5)
  (A O Atom2 6)
 )
 (16 Bond
  (A I Type 2)
  (A O Atom1 6)
  (A O Atom2 7)
 )
 (17 Bond
  (A O Atom1 7)
  (A O Atom2 8)
 )
 (18 Atom
  (A C ACL "0 H")
  (A D XYZ (2.9181978953583423 0.36182449880320328 -1.2997076783253514))
  (A I Id 9)
 )
 (19 Bond
  (A O Atom1 3)
  (A O Atom2 18)
 )
 (20 Atom
  (A C ACL "0 H")
  (A D XYZ (2.9100284563888152 0.38847501621373415 0.25135907756447096))
  (A I Id 10)
 )
 (21 Bond
  (A O Atom1 3)
  (A O Atom2 20)
 )
 (22 Atom
  (A C ACL "0 H")
  (A D XYZ (1.0770781577812087 2.0839488917118567 -0.52365553118107822))
  (A I Id 11)
 )
 (23 Bond
  (A O Atom1 4)
  (A O Atom2 22)
 )
 (24 Atom
  (A C ACL "0 H")
  (A D XYZ (-1.2688268340514037 2.2340647482406029 -0.52719977589894429))
  (A I Id 12)
 )
 (25 Bond
  (A O Atom1 5)
  (A O Atom2 24)
 )
 (26 Atom
  (A C ACL "0 H")
  (A D XYZ (-2.5696289046245466 0.27421425504363656 -0.52767997144678591))
  (A I Id 13)
 )
 (27 Bond
  (A O Atom1 6)
  (A O Atom2 26)
 )
 (28 Atom
  (A C ACL "0 H")
  (A D XYZ (-1.5258948662202014 -1.828436579549648 -0.52918196975015008))
  (A I Id 14)
 )
 (29 Bond
  (A O Atom1 7)
  (A O Atom2 28)
 )
 (30 Atom
  (A C ACL "0 H")
  (A D XYZ (0.8222399050974164 -1.9771721378827936 -0.52782456611361228))
  (A I Id 15)
 )
 (31 Bond
  (A O Atom1 8)
  (A O Atom2 30)
 )
)
