File: stb.bs

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file content (76 lines) | stat: -rw-r--r-- 3,015 bytes parent folder | download | duplicates (8)
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*   oxidation2                                                
  
 atom  C       -1.3183    -.0110    6.5956
 atom  C        1.3229    -.0111    6.5612
 atom  C        7.0794   -1.5023    -.0066
 atom  C        7.0794    1.5023     .0066
 atom  C        -.0307    6.6406    1.3324
 atom  C        -.0300    6.6441   -1.3096
 atom  C        1.3229     .0111   -6.5612
 atom  C       -1.3183     .0110   -6.5956
 atom  C       -6.6283    1.3226     .0022
 atom  C       -6.6283   -1.3226    -.0022
 atom  C        -.0307   -6.6406   -1.3324
 atom  C        -.0300   -6.6441    1.3096
 atom  C        2.7045    2.2312    5.7143
 atom  C        2.2088    5.7762    2.7160
 atom  C        5.7728    2.7744    2.2630
 atom  C       -2.7128    2.2330    5.7571
 atom  C       -5.7762    2.7066    2.2439
 atom  C       -2.2652    5.7767    2.7178
 atom  C       -2.7124   -2.2520    5.7492
 atom  C       -5.7760   -2.7140    2.2348
 atom  C       -2.2642   -5.7850    2.6980
 atom  C        2.7054   -2.2502    5.7052
 atom  C        2.2102   -5.7846    2.6960
 atom  C        5.7800   -2.7837    2.2538
 atom  C       -2.7128   -2.2330   -5.7571
 atom  C       -2.2652   -5.7767   -2.7178
 atom  C       -5.7762   -2.7066   -2.2439
 atom  C        2.7045   -2.2312   -5.7143
 atom  C        5.7728   -2.7744   -2.2630
 atom  C        2.2088   -5.7762   -2.7160
 atom  C        2.7054    2.2502   -5.7052
 atom  C        5.7800    2.7837   -2.2538
 atom  C        2.2102    5.7846   -2.6960
 atom  C       -2.7124    2.2520   -5.7492
 atom  C       -2.2642    5.7850   -2.6980
 atom  C       -5.7760    2.7140   -2.2348
 atom  C        1.3674    4.3851    4.9349
 atom  C        4.9423    1.4098    4.3309
 atom  C        4.3461    4.9380    1.3964
 atom  C       -4.9485    1.3796    4.3793
 atom  C       -1.3973    4.3825    4.9492
 atom  C       -4.4024    4.9524    1.3932
 atom  C       -4.9483   -1.3941    4.3745
 atom  C       -1.3964   -4.3984    4.9340
 atom  C       -4.4020   -4.9568    1.3765
 atom  C        1.3684   -4.4013    4.9195
 atom  C        4.3485   -4.9431    1.3800
 atom  C        4.9440   -1.4247    4.3246
 atom  C       -1.3973   -4.3825   -4.9492
 atom  C       -4.9485   -1.3796   -4.3793
 atom  C       -4.4024   -4.9524   -1.3932
 atom  C        4.9423   -1.4098   -4.3309
 atom  C        1.3674   -4.3851   -4.9349
 atom  C        4.3461   -4.9380   -1.3964
 atom  C        4.9440    1.4247   -4.3246
 atom  C        1.3684    4.4013   -4.9195
 atom  C        4.3485    4.9431   -1.3800
 atom  C       -1.3964    4.3984   -4.9340
 atom  C       -4.4020    4.9568   -1.3765
 atom  C       -4.9483    1.3941   -4.3745
 atom  O        9.8930   -1.4812    -.0283
 atom  O        9.8930    1.4812     .0283
  
 spec  C        1.0000     .33
 spec  O        1.0000     .50
  
 bonds   C     C       .0000   3.0000    .1429     .00
 bonds   C     O       .0000   3.0000    .1429     .00
 bonds   O     O       .0000   3.0000    .1429     .00

 amp     .0000
 scale  20
 dist   60.0199
 inc 5