# MSI CERIUS2 DataModel File Version 3 0 (1 Model (A I InCell 0) (A I PeriodicType 100) (A D A3 (5.6399999999999997 0 0)) (A D B3 (0 5.6399999999999997 0)) (A D C3 (0 0 5.6399999999999997)) (A C SpaceGroup "225 1") (A I Id 75) (A C Label "halite") (A I CRY/APPLYSPEC 1) (A I CRY/BONDING 16) (A I CRY/DISPLAY (192 256)) (A D CRY/TOLERANCE 0.050000000000000003) (4 Atom (A I Cell0Offset (0 -1 -1)) (A I faceFlags (0 1 1)) (A I Id 4) (A C SymType "Symmetry") ) (5 Atom (A I Cell0Offset (-1 0 -1)) (A I faceFlags (1 0 1)) (A I Id 6) (A C SymType "Symmetry") ) (6 Atom (A I faceFlags (1 0 0)) (A I Id 3) (A C SymType "Symmetry") ) (7 Atom (A I Cell0Offset (-1 -1 0)) (A I faceFlags (1 1 0)) (A I Id 8) (A C SymType "Symmetry") ) (8 Atom (A I faceFlags (0 1 0)) (A I Id 5) (A C SymType "Symmetry") ) (2 Atom (A C ACL "11 Na") (A I faceFlags (1 1 1)) (A I Id 1) (A C Label "Na1") (A O SymChildren (2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 \ 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 \ 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 8 8 8 8 8 8 8 8 \ 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 \ 8 8 8 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 \ 9 9 9 9 9 9 9 9 9 9 9 9 9 9)) ) (3 Atom (A C ACL "17 Cl") (A D XYZ (2.8199999999999998 2.8199999999999998 2.8199999999999998)) (A I Id 2) (A C Label "Cl1") (A O SymChildren (10 11 12 3 12 10 11 3 11 12 10 13 14 15 16 13 16 14 15 13 \ 15 16 14 14 13 15 16 14 16 13 15 14 15 16 13 10 3 11 12 10 12 3 11 10 11 \ 12 3 4 17 18 19 4 19 17 18 4 18 19 17 20 21 22 23 20 23 21 22 20 22 23 21 \ 21 20 22 23 21 23 20 22 21 22 23 20 17 4 18 19 17 19 4 18 17 18 19 4 5 24 \ 25 26 5 26 24 25 5 25 26 24 27 28 29 30 27 30 28 29 27 29 30 28 28 27 29 \ 30 28 30 27 29 28 29 30 27 24 5 25 26 24 26 5 25 24 25 26 5 7 31 32 33 7 \ 33 31 32 7 32 33 31 34 35 36 37 34 37 35 36 34 36 37 35 35 34 36 37 35 37 \ 34 36 35 36 37 34 31 7 32 33 31 33 7 32 31 32 33 7)) ) (9 Atom (A I faceFlags (0 0 1)) (A I Id 7) (A C SymType "Symmetry") ) (10 Atom (A C SymType "Periodic") (A O PerParent 3) (A I PerTrans (-1 -1 0)) ) (11 Atom (A C SymType "Periodic") (A O PerParent 3) (A I PerTrans (-1 0 -1)) ) (12 Atom (A C SymType "Periodic") (A O PerParent 3) (A I PerTrans (0 -1 -1)) ) (13 Atom (A C SymType "Periodic") (A O PerParent 3) (A I PerTrans (0 0 -1)) ) (14 Atom (A C SymType "Periodic") (A O PerParent 3) (A I PerTrans (-1 -1 -1)) ) (15 Atom (A C SymType "Periodic") (A O PerParent 3) (A I PerTrans (0 -1 0)) ) (16 Atom (A C SymType "Periodic") (A O PerParent 3) (A I PerTrans (-1 0 0)) ) (17 Atom (A I faceFlags (0 1 1)) (A C SymType "Periodic") (A O PerParent 4) (A I PerTrans (-1 -1 0)) ) (18 Atom (A I faceFlags (0 1 1)) (A C SymType "Periodic") (A O PerParent 4) (A I PerTrans (-1 0 -1)) ) (19 Atom (A I faceFlags (0 1 1)) (A C SymType "Periodic") (A O PerParent 4) (A I PerTrans (0 -1 -1)) ) (20 Atom (A I faceFlags (0 1 1)) (A C SymType "Periodic") (A O PerParent 4) (A I PerTrans (0 0 -1)) ) (21 Atom (A I faceFlags (0 1 1)) (A C SymType "Periodic") (A O PerParent 4) (A I PerTrans (-1 -1 -1)) ) (22 Atom (A I faceFlags (0 1 1)) (A C SymType "Periodic") (A O PerParent 4) (A I PerTrans (0 -1 0)) ) (23 Atom (A I faceFlags (0 1 1)) (A C SymType "Periodic") (A O PerParent 4) (A I PerTrans (-1 0 0)) ) (24 Atom (A I faceFlags (1 0 1)) (A C SymType "Periodic") (A O PerParent 5) (A I PerTrans (-1 -1 0)) ) (25 Atom (A I faceFlags (1 0 1)) (A C SymType "Periodic") (A O PerParent 5) (A I PerTrans (-1 0 -1)) ) (26 Atom (A I faceFlags (1 0 1)) (A C SymType "Periodic") (A O PerParent 5) (A I PerTrans (0 -1 -1)) ) (27 Atom (A I faceFlags (1 0 1)) (A C SymType "Periodic") (A O PerParent 5) (A I PerTrans (0 0 -1)) ) (28 Atom (A I faceFlags (1 0 1)) (A C SymType "Periodic") (A O PerParent 5) (A I PerTrans (-1 -1 -1)) ) (29 Atom (A I faceFlags (1 0 1)) (A C SymType "Periodic") (A O PerParent 5) (A I PerTrans (0 -1 0)) ) (30 Atom (A I faceFlags (1 0 1)) (A C SymType "Periodic") (A O PerParent 5) (A I PerTrans (-1 0 0)) ) (31 Atom (A I faceFlags (1 1 0)) (A C SymType "Periodic") (A O PerParent 7) (A I PerTrans (-1 -1 0)) ) (32 Atom (A I faceFlags (1 1 0)) (A C SymType "Periodic") (A O PerParent 7) (A I PerTrans (-1 0 -1)) ) (33 Atom (A I faceFlags (1 1 0)) (A C SymType "Periodic") (A O PerParent 7) (A I PerTrans (0 -1 -1)) ) (34 Atom (A I faceFlags (1 1 0)) (A C SymType "Periodic") (A O PerParent 7) (A I PerTrans (0 0 -1)) ) (35 Atom (A I faceFlags (1 1 0)) (A C SymType "Periodic") (A O PerParent 7) (A I PerTrans (-1 -1 -1)) ) (36 Atom (A I faceFlags (1 1 0)) (A C SymType "Periodic") (A O PerParent 7) (A I PerTrans (0 -1 0)) ) (37 Atom (A I faceFlags (1 1 0)) (A C SymType "Periodic") (A O PerParent 7) (A I PerTrans (-1 0 0)) ) )