61
#symbol   rx   ry   rz   vx   vy   vz   charge   damp   ---  Molecular Workbench
C  3.451  0.685  -0  0  0  0  0  0
C  3.451  -0.685  -0  0  0  0  0  0
C  -3.451  0.685  -0  0  0  0  0  0
C  -3.451  -0.685  -0  0  0  0  0  0
C  0.685  0  3.451  0  0  0  0  0
C  -0.685  0  3.451  0  0  0  0  0
C  0.685  0  -3.451  0  0  0  0  0
C  -0.685  0  -3.451  0  0  0  0  0
C  0  3.451  0.685  0  0  0  0  0
C  0  3.451  -0.685  0  0  0  0  0
C  0  -3.451  0.685  0  0  0  0  0
C  0  -3.451  -0.685  0  0  0  0  0
C  3.0039999  1.4089999  1.1720001  0  0  0  0  0
C  3.0039999  1.4089999  -1.1720001  0  0  0  0  0
C  3.0039999  -1.4089999  1.1720001  0  0  0  0  0
C  3.0039999  -1.4089999  -1.1720001  0  0  0  0  0
C  -3.0039999  1.4089999  1.1720001  0  0  0  0  0
C  -3.0039999  1.4089999  -1.1720001  0  0  0  0  0
C  -3.0039999  -1.4089999  1.1720001  0  0  0  0  0
C  -3.0039999  -1.4089999  -1.1720001  0  0  0  0  0
C  1.4089999  1.1720001  3.0039999  0  0  0  0  0
C  1.4089999  -1.1720001  3.0039999  0  0  0  0  0
C  -1.4089999  1.1720001  3.0039999  0  0  0  0  0
C  -1.4089999  -1.1720001  3.0039999  0  0  0  0  0
C  1.4089999  1.1720001  -3.0039999  0  0  0  0  0
C  1.4089999  -1.1720001  -3.0039999  0  0  0  0  0
C  -1.4089999  1.1720001  -3.0039999  0  0  0  0  0
C  -1.4089999  -1.1720001  -3.0039999  0  0  0  0  0
C  1.1720001  3.0039999  1.4089999  0  0  0  0  0
C  -1.1720001  3.0039999  1.4089999  0  0  0  0  0
C  1.1720001  3.0039999  -1.4089999  0  0  0  0  0
C  -1.1720001  3.0039999  -1.4089999  0  0  0  0  0
C  1.1720001  -3.0039999  1.4089999  0  0  0  0  0
C  -1.1720001  -3.0039999  1.4089999  0  0  0  0  0
C  1.1720001  -3.0039999  -1.4089999  0  0  0  0  0
C  -1.1720001  -3.0039999  -1.4089999  0  0  0  0  0
C  2.5809999  0.724  2.28  0  0  0  0  0
C  2.5809999  0.724  -2.28  0  0  0  0  0
C  2.5809999  -0.724  2.28  0  0  0  0  0
C  2.5809999  -0.724  -2.28  0  0  0  0  0
C  -2.5809999  0.724  2.28  0  0  0  0  0
C  -2.5809999  0.724  -2.28  0  0  0  0  0
C  -2.5809999  -0.724  2.28  0  0  0  0  0
C  -2.5809999  -0.724  -2.28  0  0  0  0  0
C  0.724  2.28  2.5809999  0  0  0  0  0
C  0.724  -2.28  2.5809999  0  0  0  0  0
C  -0.724  2.28  2.5809999  0  0  0  0  0
C  -0.724  -2.28  2.5809999  0  0  0  0  0
C  0.724  2.28  -2.5809999  0  0  0  0  0
C  0.724  -2.28  -2.5809999  0  0  0  0  0
C  -0.724  2.28  -2.5809999  0  0  0  0  0
C  -0.724  -2.28  -2.5809999  0  0  0  0  0
C  2.28  2.5809999  0.724  0  0  0  0  0
C  -2.28  2.5809999  0.724  0  0  0  0  0
C  2.28  2.5809999  -0.724  0  0  0  0  0
C  -2.28  2.5809999  -0.724  0  0  0  0  0
C  2.28  -2.5809999  0.724  0  0  0  0  0
C  -2.28  -2.5809999  0.724  0  0  0  0  0
C  2.28  -2.5809999  -0.724  0  0  0  0  0
C  -2.28  -2.5809999  -0.724  0  0  0  0  0
Xe  15.9499092  -0.05232  0  -0.01  0  0  0  0
bond 0 1 4.5 1.37
bond 0 12 4.5 1.4483
bond 0 13 4.5 1.4483
bond 1 14 4.5 1.4483
bond 1 15 4.5 1.4483
bond 2 3 4.5 1.37
bond 2 16 4.5 1.4483
bond 2 17 4.5 1.4483
bond 3 18 4.5 1.4483
bond 3 19 4.5 1.4483
bond 4 5 4.5 1.37
bond 4 20 4.5 1.4483
bond 4 21 4.5 1.4483
bond 5 22 4.5 1.4483
bond 5 23 4.5 1.4483
bond 6 7 4.5 1.37
bond 6 24 4.5 1.4483
bond 6 25 4.5 1.4483
bond 7 26 4.5 1.4483
bond 7 27 4.5 1.4483
bond 8 9 4.5 1.37
bond 8 28 4.5 1.4483
bond 8 29 4.5 1.4483
bond 9 30 4.5 1.4483
bond 9 31 4.5 1.4483
bond 10 11 4.5 1.37
bond 10 32 4.5 1.4483
bond 10 33 4.5 1.4483
bond 11 34 4.5 1.4483
bond 11 35 4.5 1.4483
bond 12 36 4.5 1.3696098
bond 12 52 4.5 1.4486099
bond 13 37 4.5 1.3696098
bond 13 54 4.5 1.4486099
bond 14 38 4.5 1.3696098
bond 14 56 4.5 1.4486099
bond 15 39 4.5 1.3696098
bond 15 58 4.5 1.4486099
bond 16 40 4.5 1.3696098
bond 16 53 4.5 1.4486099
bond 17 41 4.5 1.3696098
bond 17 55 4.5 1.4486099
bond 18 42 4.5 1.3696098
bond 18 57 4.5 1.4486099
bond 19 43 4.5 1.3696098
bond 19 59 4.5 1.4486099
bond 20 36 4.5 1.4486099
bond 20 44 4.5 1.3696098
bond 21 38 4.5 1.4486099
bond 21 45 4.5 1.3696098
bond 22 40 4.5 1.4486099
bond 22 46 4.5 1.3696098
bond 23 42 4.5 1.4486099
bond 23 47 4.5 1.3696098
bond 24 37 4.5 1.4486099
bond 24 48 4.5 1.3696098
bond 25 39 4.5 1.4486099
bond 25 49 4.5 1.3696098
bond 26 41 4.5 1.4486099
bond 26 50 4.5 1.3696098
bond 27 43 4.5 1.4486099
bond 27 51 4.5 1.3696098
bond 28 44 4.5 1.4486099
bond 28 52 4.5 1.3696098
bond 29 46 4.5 1.4486099
bond 29 53 4.5 1.3696098
bond 30 48 4.5 1.4486099
bond 30 54 4.5 1.3696098
bond 31 50 4.5 1.4486099
bond 31 55 4.5 1.3696098
bond 32 45 4.5 1.4486099
bond 32 56 4.5 1.3696098
bond 33 47 4.5 1.4486099
bond 33 57 4.5 1.3696098
bond 34 49 4.5 1.4486099
bond 34 58 4.5 1.3696098
bond 35 51 4.5 1.4486099
bond 35 59 4.5 1.3696098
bond 36 38 4.5 1.448
bond 37 39 4.5 1.448
bond 40 42 4.5 1.448
bond 41 43 4.5 1.448
bond 44 46 4.5 1.448
bond 45 47 4.5 1.448
bond 48 50 4.5 1.448
bond 49 51 4.5 1.448
bond 52 54 4.5 1.448
bond 53 55 4.5 1.448
bond 56 58 4.5 1.448
bond 57 59 4.5 1.448
angle 0 1 14 50.0 2.09428
angle 1 14 38 50.0 2.0943499
angle 14 38 36 50.0 2.0945599
angle 38 36 12 50.0 2.0945599
angle 36 12 0 50.0 2.0943499
angle 12 0 1 50.0 2.09428
angle 0 1 15 50.0 2.09428
angle 1 15 39 50.0 2.0943499
angle 15 39 37 50.0 2.0945599
angle 39 37 13 50.0 2.0945599
angle 37 13 0 50.0 2.0943499
angle 13 0 1 50.0 2.09428
angle 13 37 24 50.0 2.0938499
angle 37 24 48 50.0 2.0949399
angle 24 48 30 50.0 2.0938499
angle 48 30 54 50.0 2.0949399
angle 30 54 13 50.0 2.0938499
angle 54 13 37 50.0 2.0949399
angle 6 7 26 50.0 2.09428
angle 7 26 50 50.0 2.0943499
angle 26 50 48 50.0 2.0945599
angle 50 48 24 50.0 2.0945599
angle 48 24 6 50.0 2.0943499
angle 24 6 7 50.0 2.09428
angle 6 7 27 50.0 2.09428
angle 7 27 51 50.0 2.0943499
angle 27 51 49 50.0 2.0945599
angle 51 49 25 50.0 2.0945599
angle 49 25 6 50.0 2.0943499
angle 25 6 7 50.0 2.09428
angle 15 58 34 50.0 2.0938499
angle 58 34 49 50.0 2.0949399
angle 34 49 25 50.0 2.0938499
angle 49 25 39 50.0 2.0949399
angle 25 39 15 50.0 2.0938499
angle 39 15 58 50.0 2.0949399
angle 10 11 34 50.0 2.09428
angle 11 34 58 50.0 2.0943499
angle 34 58 56 50.0 2.0945599
angle 58 56 32 50.0 2.0945599
angle 56 32 10 50.0 2.0943499
angle 32 10 11 50.0 2.09428
angle 10 11 35 50.0 2.09428
angle 11 35 59 50.0 2.0943499
angle 35 59 57 50.0 2.0945599
angle 59 57 33 50.0 2.0945599
angle 57 33 10 50.0 2.0943499
angle 33 10 11 50.0 2.09428
angle 18 42 23 50.0 2.0938499
angle 42 23 47 50.0 2.0949399
angle 23 47 33 50.0 2.0938499
angle 47 33 57 50.0 2.0949399
angle 33 57 18 50.0 2.0938499
angle 57 18 42 50.0 2.0949399
angle 2 3 18 50.0 2.09428
angle 3 18 42 50.0 2.0943499
angle 18 42 40 50.0 2.0945599
angle 42 40 16 50.0 2.0945599
angle 40 16 2 50.0 2.0943499
angle 16 2 3 50.0 2.09428
angle 4 5 23 50.0 2.09428
angle 5 23 47 50.0 2.0943499
angle 23 47 45 50.0 2.0945599
angle 47 45 21 50.0 2.0945599
angle 45 21 4 50.0 2.0943499
angle 21 4 5 50.0 2.09428
angle 12 36 20 50.0 2.0938499
angle 36 20 44 50.0 2.0949399
angle 20 44 28 50.0 2.0938499
angle 44 28 52 50.0 2.0949399
angle 28 52 12 50.0 2.0938499
angle 52 12 36 50.0 2.0949399
angle 14 56 32 50.0 2.0938499
angle 56 32 45 50.0 2.0949399
angle 32 45 21 50.0 2.0938499
angle 45 21 38 50.0 2.0949399
angle 21 38 14 50.0 2.0938499
angle 38 14 56 50.0 2.0949399
angle 8 9 30 50.0 2.09428
angle 9 30 54 50.0 2.0943499
angle 30 54 52 50.0 2.0945599
angle 54 52 28 50.0 2.0945599
angle 52 28 8 50.0 2.0943499
angle 28 8 9 50.0 2.09428
angle 8 9 31 50.0 2.09428
angle 9 31 55 50.0 2.0943499
angle 31 55 53 50.0 2.0945599
angle 55 53 29 50.0 2.0945599
angle 53 29 8 50.0 2.0943499
angle 29 8 9 50.0 2.09428
angle 16 53 29 50.0 2.0938499
angle 53 29 46 50.0 2.0949399
angle 29 46 22 50.0 2.0938499
angle 46 22 40 50.0 2.0949399
angle 22 40 16 50.0 2.0938499
angle 40 16 53 50.0 2.0949399
angle 17 55 31 50.0 2.0938499
angle 55 31 50 50.0 2.0949399
angle 31 50 26 50.0 2.0938499
angle 50 26 41 50.0 2.0949399
angle 26 41 17 50.0 2.0938499
angle 41 17 55 50.0 2.0949399
angle 2 3 19 50.0 2.09428
angle 3 19 43 50.0 2.0943499
angle 19 43 41 50.0 2.0945599
angle 43 41 17 50.0 2.0945599
angle 41 17 2 50.0 2.0943499
angle 17 2 3 50.0 2.09428
angle 19 43 27 50.0 2.0938499
angle 43 27 51 50.0 2.0949399
angle 27 51 35 50.0 2.0938499
angle 51 35 59 50.0 2.0949399
angle 35 59 19 50.0 2.0938499
angle 59 19 43 50.0 2.0949399
angle 4 5 22 50.0 2.09428
angle 5 22 46 50.0 2.0943499
angle 22 46 44 50.0 2.0945599
angle 46 44 20 50.0 2.0945599
angle 44 20 4 50.0 2.0943499
angle 20 4 5 50.0 2.09428
torsion 0 1 14 56 100.0 2.51333
torsion 0 1 15 58 100.0 2.51333
torsion 1 0 12 52 100.0 2.51333
torsion 1 0 13 54 100.0 2.51333
torsion 2 3 18 57 100.0 2.51333
torsion 2 3 19 59 100.0 2.51333
torsion 3 2 16 53 100.0 2.51333
torsion 3 2 17 55 100.0 2.51333
torsion 4 5 22 40 100.0 2.51333
torsion 4 5 23 42 100.0 2.51333
torsion 5 4 20 36 100.0 2.51333
torsion 5 4 21 38 100.0 2.51333
torsion 6 7 26 41 100.0 2.51333
torsion 6 7 27 43 100.0 2.51333
torsion 7 6 24 37 100.0 2.51333
torsion 7 6 25 39 100.0 2.51333
torsion 8 9 30 48 100.0 2.51333
torsion 8 9 31 50 100.0 2.51333
torsion 9 8 28 44 100.0 2.51333
torsion 9 8 29 46 100.0 2.51333
torsion 10 11 34 49 100.0 2.51333
torsion 10 11 35 51 100.0 2.51333
torsion 11 10 32 45 100.0 2.51333
torsion 11 10 33 47 100.0 2.51333
torsion 44 46 22 40 100.0 2.51333
torsion 44 46 29 53 100.0 2.5132301
torsion 46 44 20 36 100.0 2.51333
torsion 46 44 28 52 100.0 2.5132301
torsion 45 47 23 42 100.0 2.51333
torsion 45 47 33 57 100.0 2.5132301
torsion 47 45 21 38 100.0 2.51333
torsion 47 45 32 56 100.0 2.5132301
torsion 48 50 26 41 100.0 2.51333
torsion 48 50 31 55 100.0 2.5132301
torsion 50 48 24 37 100.0 2.51333
torsion 50 48 30 54 100.0 2.5132301
torsion 49 51 27 43 100.0 2.51333
torsion 49 51 35 59 100.0 2.5132301
torsion 51 49 25 39 100.0 2.51333
torsion 51 49 34 58 100.0 2.5132301
torsion 14 38 36 12 100.0 1.0475299
torsion 13 37 39 15 100.0 1.0475299
torsion 16 40 42 18 100.0 1.0475299
torsion 17 41 43 19 100.0 1.0475299
torsion 52 54 13 37 100.0 2.5132301
torsion 52 54 30 48 100.0 2.51333
torsion 54 52 12 36 100.0 2.5132301
torsion 54 52 28 44 100.0 2.51333
torsion 53 55 31 50 100.0 2.51333
torsion 53 55 17 41 100.0 2.5132301
torsion 55 53 29 46 100.0 2.51333
torsion 55 53 16 40 100.0 2.5132301
torsion 56 58 34 49 100.0 2.51333
torsion 56 58 15 39 100.0 2.5132301
torsion 58 56 32 45 100.0 2.51333
torsion 58 56 14 38 100.0 2.5132301
torsion 57 59 19 43 100.0 2.5132301
torsion 57 59 35 51 100.0 2.51333
torsion 59 57 18 42 100.0 2.5132301
torsion 59 57 33 47 100.0 2.51333
