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- ; Stick colour
- 2(0.700000, 0.700000, 0.700000)
- ; Model
- BS
- ; Definitions
- C = 62.979862, 25.191945(0.500000, 0.500000, 0.500000)
- H = 37.787917, 15.115167(1.000000, 1.000000, 1.000000)
- O = 58.781205, 24.352213(1.000000, 0.000000, 0.000000)
- ; Instances
- C1 : 77.281539 -56.295600 8.363726
- C2 : 37.929202 -67.911605 57.558976
- C3 : -22.756934 -73.788886 38.811550
- C4 : -39.639315 -24.615469 2.407090
- C5 : 2.092401 -17.963536 -45.911900
- C6 : -9.728919 30.692186 -85.002241
- O7 : 55.678187 -118.122930 84.549625
- O8 : -57.948401 -75.203414 87.576018
- O9 : -93.908223 -32.806630 -20.809386
- O10 : 56.600632 -8.511099 -21.817484
- O11 : -9.870414 82.847910 -56.206168
- H12 : 80.462442 -111.761544 122.493313
- H13 : -72.669734 -118.527681 88.436323
- H14 : -125.090812 -11.705437 5.207595
- H15 : 15.104041 120.199167 -64.902008
- O16 : 83.730677 -101.335858 -30.294993
- H17 : 125.090812 -120.199167 -25.009303
- H18 : 1.325306 -54.358759 -71.139533
- H19 : 6.372512 40.171915 -122.493313
- H20 : -49.734567 25.131484 -102.804968
- H21 : 119.637596 -48.985737 24.080560
- H22 : -27.157127 -112.632346 15.013559
- H23 : -39.787528 12.801707 28.759124
- H24 : 41.617723 -32.691587 86.549026
- ; Bonds
- O9, H14
- C4, O9
- C4, C5
- C3, C4
- C3, O8
- O8, H13
- C2, C3
- C2, O7
- O7, H12
- C1, C2
- C1, O16
- C1, O10
- C5, O10
- C5, C6
- C6, H19
- C6, H20
- C6, O11
- O11, H15
- C5, H18
- O16, H17
- C1, H21
- C3, H22
- C4, H23
- C2, H24
-