data_r5ed8sf
# 
_audit.revision_id     1_0 
_audit.creation_date   2016-01-13 
_audit.update_record   "Initial release" 
# 
_cell.entry_id      5ed8 
_cell.length_a      63.3740 
_cell.length_b      63.3740 
_cell.length_c      192.7860 
_cell.angle_alpha   90.0000 
_cell.angle_beta    90.0000 
_cell.angle_gamma   90.0000 
# 
_diffrn.id                  1 
_diffrn.crystal_id          1 
_diffrn.ambient_temp        ? 
_diffrn.crystal_treatment   ? 
_diffrn.details             ? 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   0.979 
# 
_diffrn_reflns.diffrn_id         1 
_diffrn_reflns.pdbx_d_res_high   2.500 
_diffrn_reflns.pdbx_d_res_low    60.205 
_diffrn_reflns.limit_h_max       25 
_diffrn_reflns.limit_h_min       0 
_diffrn_reflns.limit_k_max       17 
_diffrn_reflns.limit_k_min       0 
_diffrn_reflns.limit_l_max       77 
_diffrn_reflns.limit_l_min       0 
_diffrn_reflns.number            14384 
_diffrn_reflns.pdbx_number_obs   14304 
# 
_entry.id   5ed8 
# 
_exptl_crystal.id   1 
# 
_reflns_scale.group_code   1 
# 
_symmetry.entry_id               5ed8 
_symmetry.space_group_name_H-M   "P 41 21 2" 
_symmetry.Int_Tables_number      92 
# 
loop_
_symmetry_equiv.id 
_symmetry_equiv.pos_as_xyz 
1 "X,  Y,  Z"               
2 "-Y+1/2,  X+1/2,  Z+1/4"  
3 "Y+1/2,  -X+1/2,  Z+3/4"  
4 "X+1/2,  -Y+1/2,  -Z+3/4" 
5 "-X+1/2,  Y+1/2,  -Z+1/4" 
6 "-X,  -Y,  Z+1/2"         
7 "Y,  X,  -Z"              
8 "-Y,  -X,  -Z+1/2"        
# 
loop_
_refln.crystal_id 
_refln.wavelength_id 
_refln.scale_group_code 
_refln.index_h 
_refln.index_k 
_refln.index_l 
_refln.status 
_refln.F_meas_au 
_refln.F_meas_sigma_au 
1 1 1 0  0  8  o 29.15244  0.3528952 
1 1 1 0  0  20 o 61.09341  0.7402665 
1 1 1 0  0  24 o 40.71974  0.5080407 
1 1 1 0  0  32 o 67.76372  0.7967559 
1 1 1 0  0  36 o 20.76705  0.6451612 
1 1 1 0  0  44 o 12.28844  0.6746845 
1 1 1 0  0  48 o 32.56308  1.656891  
1 1 1 0  0  56 o 30.34570  1.452168  
1 1 1 0  0  60 o 30.96124  1.032601  
1 1 1 0  0  64 o 11.30510  0.5547311 
1 1 1 0  0  68 o 45.11936  0.6417292 
1 1 1 0  0  72 o 15.10323  0.5259799 
1 1 1 0  0  76 o 0.000000  3.162459  
1 1 1 1  0  5  o 23.97932  0.2904353 
1 1 1 1  0  6  o 19.75102  0.2661076 
1 1 1 1  0  7  o 41.53900  0.7174988 
1 1 1 1  0  8  o 35.53535  0.3516986 
1 1 1 1  0  9  o 27.14566  0.2452232 
1 1 1 1  0  10 o 37.88356  0.3255279 
1 1 1 1  0  15 o 44.17516  0.3356883 
1 1 1 1  0  16 o 12.85728  0.1215313 
1 1 1 1  0  18 f 50.44685  0.4989238 
1 1 1 1  0  21 o 3.820301  0.1272533 
1 1 1 1  0  22 o 22.27729  0.1806701 
1 1 1 1  0  23 o 7.832256  0.1288589 
1 1 1 1  0  24 o 66.61751  0.5593223 
1 1 1 1  0  25 o 38.25016  0.2613341 
1 1 1 1  0  26 o 6.721577  0.1242858 
1 1 1 1  0  27 o 38.28207  0.2618721 
1 1 1 1  0  28 o 3.477702  0.1713364 
1 1 1 1  0  29 o 88.31116  0.6455301 
1 1 1 1  0  30 o 16.81907  0.1514332 
1 1 1 1  0  31 o 16.97393  0.1653372 
1 1 1 1  0  32 o 32.87850  0.2387671 
1 1 1 1  0  33 o 23.54127  0.1857498 
1 1 1 1  0  34 o 34.56487  0.2447398 
1 1 1 1  0  35 o 7.286116  0.1539907 
1 1 1 1  0  36 o 18.42437  0.3051766 
1 1 1 1  0  37 o 17.97064  0.3063900 
1 1 1 1  0  38 o 35.14210  0.5947604 
1 1 1 1  0  39 f 46.55721  0.7194389 
1 1 1 1  0  40 o 9.753317  0.2093921 
1 1 1 1  0  41 o 35.05098  0.5946496 
1 1 1 1  0  42 o 11.60960  0.2502304 
1 1 1 1  0  43 o 37.92805  0.6400207 
1 1 1 1  0  44 o 5.940938  0.2913699 
1 1 1 1  0  45 o 12.54830  0.2908744 
1 1 1 1  0  46 f 18.24838  0.4423251 
1 1 1 1  0  47 o 2.031842  0.5875575 
1 1 1 1  0  48 o 3.625057  0.3954704 
1 1 1 1  0  49 o 14.84892  0.3846456 
1 1 1 1  0  50 o 3.452531  0.5097251 
1 1 1 1  0  51 f 88.93903  1.990378  
1 1 1 1  0  52 o 27.00284  0.5784354 
1 1 1 1  0  53 o 48.95639  1.002849  
1 1 1 1  0  54 o 18.82091  0.4201102 
1 1 1 1  0  55 o 2.706736  0.5995435 
1 1 1 1  0  56 o 10.78659  0.3527083 
1 1 1 1  0  57 o 3.171639  0.4932995 
1 1 1 1  0  58 o 11.35898  0.2906226 
1 1 1 1  0  59 o 28.64236  0.4451873 
1 1 1 1  0  60 o 4.259297  0.4040360 
1 1 1 1  0  61 o 11.92828  0.2723096 
1 1 1 1  0  62 o 6.790430  0.3546639 
1 1 1 1  0  63 o 0.000000  1.973777  
1 1 1 1  0  64 o 13.55086  0.2824062 
1 1 1 1  0  65 o 0.000000  2.003020  
1 1 1 1  0  66 o 16.05135  0.2426849 
1 1 1 1  0  67 o 17.33660  0.2530538 
1 1 1 1  0  68 o 14.46811  0.2648344 
1 1 1 1  0  69 o 14.03357  0.2545794 
1 1 1 1  0  70 o 6.652012  0.3575204 
1 1 1 1  0  71 o 7.254124  0.3445062 
1 1 1 1  0  72 o 3.375894  0.7091967 
1 1 1 1  0  73 o 11.42788  0.2839501 
1 1 1 1  0  74 o 0.000000  2.003020  
1 1 1 1  0  75 o 4.204337  0.4962546 
1 1 1 1  0  76 o 2.953292  0.6877708 
1 1 1 1  0  77 o 4.737556  0.4845673 
1 1 1 1  1  4  o 13.69173  0.2316157 
1 1 1 1  1  6  o 18.76057  0.2631517 
1 1 1 1  1  7  o 22.18182  0.2877917 
1 1 1 1  1  8  o 36.05355  0.4384278 
1 1 1 1  1  9  o 32.79350  0.4105625 
1 1 1 1  1  10 f 5.644832  0.1524531 
1 1 1 1  1  11 o 12.31915  0.2105991 
1 1 1 1  1  12 o 32.04831  0.4244637 
1 1 1 1  1  13 o 54.26561  0.9243422 
1 1 1 1  1  15 o 57.53085  0.6662339 
1 1 1 1  1  16 o 22.54840  0.2551400 
1 1 1 1  1  17 o 38.89684  0.4680716 
1 1 1 1  1  19 o 39.37821  0.4039951 
1 1 1 1  1  20 o 5.456267  0.1159916 
1 1 1 1  1  21 o 34.01289  0.2529254 
1 1 1 1  1  22 o 44.03674  0.3137979 
1 1 1 1  1  23 o 12.66362  0.1256455 
1 1 1 1  1  24 o 23.64232  0.1983801 
1 1 1 1  1  25 o 32.21029  0.2445794 
1 1 1 1  1  26 o 20.96352  0.1726445 
1 1 1 1  1  27 o 14.56824  0.1449612 
1 1 1 1  1  28 o 1.181317  0.4181936 
1 1 1 1  1  29 f 17.36006  0.1600347 
1 1 1 1  1  30 o 57.86090  0.4130596 
1 1 1 1  1  31 o 28.37517  0.2296053 
1 1 1 1  1  32 o 61.92577  0.4294961 
1 1 1 1  1  33 o 18.25634  0.1822273 
1 1 1 1  1  34 o 2.236196  0.2928515 
1 1 1 1  1  35 o 17.21544  0.1747463 
1 1 1 1  1  36 o 37.76596  0.6986945 
1 1 1 1  1  37 o 45.16251  0.7533351 
1 1 1 1  1  38 o 21.88227  0.3884926 
1 1 1 1  1  39 o 25.83525  0.4562303 
1 1 1 1  1  40 o 0.000000  1.466769  
1 1 1 1  1  41 o 22.95096  0.4068211 
1 1 1 1  1  42 o 43.64481  0.7338996 
1 1 1 1  1  43 o 1.252975  0.6911190 
1 1 1 1  1  44 o 47.28527  0.7950733 
1 1 1 1  1  45 o 9.612196  0.2978460 
1 1 1 1  1  46 o 30.70003  0.6466241 
1 1 1 1  1  47 o 35.30553  0.7399580 
1 1 1 1  1  48 o 12.90468  0.3116446 
1 1 1 1  1  50 f 77.97919  1.597987  
1 1 1 1  1  51 o 2.652488  0.5556080 
1 1 1 1  1  52 o 26.12842  0.5101990 
1 1 1 1  1  53 o 26.47111  0.5134165 
1 1 1 1  1  54 o 19.08323  0.3950649 
1 1 1 1  1  55 o 48.15043  0.9008911 
1 1 1 1  1  56 o 17.62928  0.3817645 
1 1 1 1  1  57 o 25.89931  0.3656135 
1 1 1 1  1  58 o 26.66807  0.3799478 
1 1 1 1  1  59 o 7.972064  0.2548543 
1 1 1 1  1  60 o 16.87430  0.2734519 
1 1 1 1  1  61 o 2.943431  0.5840737 
1 1 1 1  1  62 o 9.786051  0.2580348 
1 1 1 1  1  63 o 0.000000  2.060260  
1 1 1 1  1  64 o 12.38036  0.2740686 
1 1 1 1  1  65 o 25.12092  0.2487509 
1 1 1 1  1  66 o 9.603118  0.2893062 
1 1 1 1  1  67 o 11.36154  0.2680812 
1 1 1 1  1  68 o 2.143257  0.8877661 
1 1 1 1  1  69 o 13.96712  0.2455447 
1 1 1 1  1  70 o 4.536932  0.5269076 
1 1 1 1  1  71 o 0.000000  1.988452  
1 1 1 1  1  72 o 2.540518  0.7920379 
1 1 1 1  1  73 o 0.8353170 1.502576  
1 1 1 1  1  74 o 7.298077  0.3463288 
1 1 1 1  1  75 o 4.852753  0.4302554 
1 1 1 1  1  76 o 0.000000  2.088292  
1 1 1 2  0  0  o 29.74968  0.3912620 
1 1 1 2  0  1  o 21.47458  0.1994419 
1 1 1 2  0  3  o 31.29003  0.4034373 
1 1 1 2  0  5  o 25.68288  0.3407367 
1 1 1 2  0  7  o 29.96002  0.3732188 
1 1 1 2  0  8  o 11.74158  0.2110463 
1 1 1 2  0  9  o 6.756091  0.1531802 
1 1 1 2  0  10 o 18.61901  0.2835900 
1 1 1 2  0  11 o 54.93810  0.6654051 
1 1 1 2  0  12 o 39.46817  0.4060000 
1 1 1 2  0  14 o 15.71084  0.1894603 
1 1 1 2  0  15 o 47.97924  0.4739372 
1 1 1 2  0  16 o 52.53595  0.4386705 
1 1 1 2  0  17 o 40.13073  0.3088801 
1 1 1 2  0  18 o 43.83491  0.3020603 
1 1 1 2  0  19 o 72.68098  0.6804316 
1 1 1 2  0  20 o 55.41706  0.4722477 
1 1 1 2  0  21 o 20.17482  0.1679052 
1 1 1 2  0  22 o 26.59493  0.2047302 
1 1 1 2  0  23 o 9.824596  0.1759769 
1 1 1 2  0  24 o 8.700940  0.1687732 
1 1 1 2  0  25 o 28.99946  0.2237060 
1 1 1 2  0  26 o 5.205395  0.1214571 
1 1 1 2  0  27 f 36.69378  0.2660463 
1 1 1 2  0  28 o 32.50231  0.2415104 
1 1 1 2  0  29 o 15.41381  0.1464260 
1 1 1 2  0  30 o 3.180792  0.1691655 
1 1 1 2  0  31 o 6.992922  0.1317981 
1 1 1 2  0  32 o 13.28215  0.1328575 
1 1 1 2  0  33 o 60.89178  0.3954810 
1 1 1 2  0  34 o 63.01201  0.4060986 
1 1 1 2  0  35 o 9.533232  0.1302456 
1 1 1 2  0  36 f 17.75253  0.3036506 
1 1 1 2  0  37 o 19.84061  0.3284467 
1 1 1 2  0  38 o 22.71668  0.4008836 
1 1 1 2  0  39 o 11.72671  0.2453553 
1 1 1 2  0  40 o 13.54442  0.2657063 
1 1 1 2  0  41 o 13.44748  0.2591027 
1 1 1 2  0  42 o 40.65042  0.6872180 
1 1 1 2  0  43 o 47.08871  0.7922651 
1 1 1 2  0  44 o 25.66703  0.4524904 
1 1 1 2  0  45 o 14.25556  0.3266441 
1 1 1 2  0  46 o 5.434912  0.2866533 
1 1 1 2  0  47 o 0.000000  1.755491  
1 1 1 2  0  48 o 30.52338  0.7080573 
1 1 1 2  0  49 o 31.98930  0.7545258 
1 1 1 2  0  50 o 49.33617  1.117015  
1 1 1 2  0  51 o 4.663333  0.4462306 
1 1 1 2  0  52 o 22.21980  0.4968823 
1 1 1 2  0  53 o 29.16142  0.6146359 
1 1 1 2  0  54 o 4.211246  0.4458491 
1 1 1 2  0  55 o 5.397337  0.3899086 
1 1 1 2  0  56 o 16.55073  0.3940583 
1 1 1 2  0  57 o 9.974375  0.2561269 
1 1 1 2  0  58 o 33.05400  0.4932729 
1 1 1 2  0  59 o 6.274151  0.3163880 
1 1 1 2  0  60 o 16.54722  0.3098412 
1 1 1 2  0  61 o 29.68217  0.2894939 
1 1 1 2  0  62 o 9.038551  0.2568913 
1 1 1 2  0  63 o 0.000000  1.898701  
1 1 1 2  0  64 o 8.184402  0.2690999 
1 1 1 2  0  65 o 1.486457  0.9488891 
1 1 1 2  0  66 o 9.889484  0.2496712 
1 1 1 2  0  67 o 8.311300  0.2617286 
1 1 1 2  0  68 o 10.87517  0.2249088 
1 1 1 2  0  69 o 4.749813  0.3881217 
1 1 1 2  0  70 o 5.999375  0.3255430 
1 1 1 2  0  71 o 12.11930  0.2116548 
1 1 1 2  0  72 o 1.722050  1.211487  
1 1 1 2  0  73 o 0.000000  1.867826  
1 1 1 2  0  74 o 13.44099  0.2401132 
1 1 1 2  0  75 o 0.000000  1.836431  
1 1 1 2  0  76 o 8.293790  0.2758453 
1 1 1 2  1  1  f 35.51980  0.3080587 
1 1 1 2  1  2  o 42.98164  0.4119869 
1 1 1 2  1  3  o 35.35161  0.3478083 
1 1 1 2  1  4  o 42.32524  0.5147900 
1 1 1 2  1  5  o 48.11116  0.5677047 
1 1 1 2  1  7  o 11.88677  0.1603438 
1 1 1 2  1  8  f 21.32650  0.2143148 
1 1 1 2  1  10 o 55.18785  0.6499349 
1 1 1 2  1  11 o 31.57583  0.2960112 
1 1 1 2  1  13 o 41.95753  0.3738953 
1 1 1 2  1  15 o 9.311069  0.1854977 
1 1 1 2  1  16 o 37.20366  0.3352975 
1 1 1 2  1  18 o 52.11478  0.3591444 
1 1 1 2  1  19 o 52.05953  0.3340038 
1 1 1 2  1  20 o 29.42542  0.2077404 
1 1 1 2  1  21 o 88.56165  0.8260418 
1 1 1 2  1  22 o 18.29611  0.1377274 
1 1 1 2  1  23 f 25.11166  0.1753661 
1 1 1 2  1  24 o 26.30585  0.1806318 
1 1 1 2  1  25 o 23.52521  0.1674764 
1 1 1 2  1  26 o 31.38188  0.2068386 
1 1 1 2  1  27 o 3.144019  0.1534559 
1 1 1 2  1  28 o 18.93794  0.1407135 
1 1 1 2  1  29 o 30.33803  0.1834401 
1 1 1 2  1  30 o 16.16326  0.1200680 
1 1 1 2  1  31 o 49.43508  0.2639434 
1 1 1 2  1  32 o 19.08171  0.1320969 
1 1 1 2  1  33 o 37.15048  0.2005807 
1 1 1 2  1  34 o 16.53140  0.1243968 
1 1 1 2  1  35 f 22.12933  0.1414364 
1 1 1 2  1  36 o 37.77597  0.4513784 
1 1 1 2  1  37 o 38.65767  0.4612724 
1 1 1 2  1  38 o 20.47379  0.2596366 
1 1 1 2  1  39 o 7.100194  0.1418963 
1 1 1 2  1  40 o 29.24305  0.3586905 
1 1 1 2  1  41 o 36.66842  0.4389980 
1 1 1 2  1  42 o 45.93863  0.5473347 
1 1 1 2  1  43 o 35.51407  0.4296410 
1 1 1 2  1  44 o 30.74923  0.3758985 
1 1 1 2  1  45 o 43.54945  0.6408427 
1 1 1 2  1  46 o 16.17045  0.2603990 
1 1 1 2  1  47 o 21.25823  0.3297729 
1 1 1 2  1  48 o 34.73352  0.5176147 
1 1 1 2  1  49 o 51.97569  0.7965769 
1 1 1 2  1  50 o 37.29965  0.5516661 
1 1 1 2  1  51 o 23.50296  0.3621246 
1 1 1 2  1  52 o 11.20176  0.2337431 
1 1 1 2  1  53 o 10.25888  0.1909315 
1 1 1 2  1  54 o 25.98001  0.3600790 
1 1 1 2  1  55 o 25.52961  0.3562364 
1 1 1 2  1  56 o 19.90206  0.2857283 
1 1 1 2  1  57 o 12.81198  0.1735539 
1 1 1 2  1  58 o 6.176075  0.1900774 
1 1 1 2  1  59 o 14.67759  0.1869832 
1 1 1 2  1  60 o 2.812096  0.3778234 
1 1 1 2  1  61 o 12.26713  0.1507538 
1 1 1 2  1  62 o 12.55062  0.1519668 
1 1 1 2  1  63 o 9.939336  0.1653527 
1 1 1 2  1  64 o 12.58763  0.1652111 
1 1 1 2  1  65 o 10.53295  0.1670479 
1 1 1 2  1  66 o 10.98159  0.1629326 
1 1 1 2  1  67 o 6.930279  0.2148151 
1 1 1 2  1  68 o 16.97393  0.1415727 
1 1 1 2  1  69 o 7.181621  0.2035761 
1 1 1 2  1  70 o 6.100293  0.2154255 
1 1 1 2  1  71 o 7.854497  0.1901736 
1 1 1 2  1  72 o 6.691231  0.2306522 
1 1 1 2  1  73 o 8.283267  0.1839793 
1 1 1 2  1  74 o 6.033202  0.2363145 
1 1 1 2  1  75 o 8.734289  0.1974844 
1 1 1 2  1  76 o 5.183005  0.2945342 
1 1 1 2  2  0  o 33.65025  0.4173061 
1 1 1 2  2  2  o 28.24475  0.3691746 
1 1 1 2  2  3  o 24.04470  0.3409745 
1 1 1 2  2  4  o 62.84939  1.069643  
1 1 1 2  2  6  o 19.83475  0.2895737 
1 1 1 2  2  7  o 34.55814  0.4347317 
1 1 1 2  2  8  o 7.731384  0.1674056 
1 1 1 2  2  11 f 26.17845  0.3464281 
1 1 1 2  2  12 o 39.23767  0.4926025 
1 1 1 2  2  14 o 8.095108  0.2893277 
1 1 1 2  2  15 o 2.630475  0.3424400 
1 1 1 2  2  18 o 87.95654  1.423680  
1 1 1 2  2  19 o 19.19715  0.3079914 
1 1 1 2  2  20 o 41.66898  0.5262432 
1 1 1 2  2  21 o 2.003020  0.5029312 
1 1 1 2  2  22 o 46.33688  0.6102347 
1 1 1 2  2  23 o 49.60768  0.5037981 
1 1 1 2  2  24 o 18.67203  0.2904643 
1 1 1 2  2  25 o 36.50790  0.3889365 
1 1 1 2  2  26 o 18.70159  0.2532364 
1 1 1 2  2  27 o 37.34561  0.3818423 
1 1 1 2  2  28 o 7.486851  0.1803394 
1 1 1 2  2  29 o 8.470679  0.1900710 
1 1 1 2  2  30 o 17.51512  0.2062712 
1 1 1 2  2  31 o 11.27420  0.1816267 
1 1 1 2  2  32 o 14.36324  0.1870266 
1 1 1 2  2  33 o 2.893623  0.2503960 
1 1 1 2  2  34 o 18.53450  0.1966001 
1 1 1 2  2  35 o 27.05017  0.5131782 
1 1 1 2  2  36 o 4.092201  0.2549266 
1 1 1 2  2  37 o 2.115953  0.3899978 
1 1 1 2  2  38 o 30.83704  0.5809481 
1 1 1 2  2  39 o 8.412129  0.2586856 
1 1 1 2  2  40 o 8.511766  0.2888439 
1 1 1 2  2  41 o 62.19373  1.135382  
1 1 1 2  2  42 o 34.99370  0.6576374 
1 1 1 2  2  43 o 28.15196  0.5380689 
1 1 1 2  2  44 o 18.40701  0.3752452 
1 1 1 2  2  45 o 5.402721  0.3137610 
1 1 1 2  2  46 o 43.66412  0.9888862 
1 1 1 2  2  47 o 9.980203  0.3041516 
1 1 1 2  2  48 o 12.43893  0.3435096 
1 1 1 2  2  49 o 45.23584  1.154344  
1 1 1 2  2  50 o 2.262049  0.6416037 
1 1 1 2  2  51 o 16.85706  0.3549963 
1 1 1 2  2  52 o 15.96053  0.3459898 
1 1 1 2  2  53 o 16.74458  0.3522305 
1 1 1 2  2  54 o 41.47526  0.7839906 
1 1 1 2  2  55 o 17.12060  0.3745863 
1 1 1 2  2  56 o 0.000000  1.670634  
1 1 1 2  2  57 o 5.546111  0.2811858 
1 1 1 2  2  58 o 12.05194  0.2435946 
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1 1 1 24 3  3  o 5.205395  0.7110247 
1 1 1 24 3  4  o 4.231906  0.7275135 
1 1 1 24 3  5  o 6.047641  0.5296513 
1 1 1 24 3  6  o 0.000000  2.470901  
1 1 1 24 3  7  o 3.843063  0.7764233 
1 1 1 24 3  8  o 5.233246  0.6089987 
1 1 1 24 3  9  o 4.792468  0.6531323 
1 1 1 24 3  10 o 2.652488  1.059742  
1 1 1 24 3  11 o 4.106385  0.7583352 
1 1 1 24 3  12 f 4.049349  0.7733555 
1 1 1 24 3  13 o 3.543950  0.8695498 
1 1 1 24 3  14 o 3.106810  0.9064800 
1 1 1 24 3  15 o 0.000000  2.447255  
1 1 1 24 3  16 o 3.486052  0.8207613 
1 1 1 24 3  17 o 0.000000  2.312888  
1 1 1 24 3  18 f 3.393074  0.8456971 
1 1 1 24 3  19 o 0.000000  2.374907  
1 1 1 24 3  20 f 3.903115  0.7664490 
1 1 1 24 3  21 o 3.608982  0.6843091 
1 1 1 24 3  22 o 3.208096  0.8051945 
1 1 1 24 3  23 o 2.156779  1.051316  
1 1 1 24 4  0  o 2.652488  1.250627  
1 1 1 24 4  1  o 2.505951  0.9884306 
1 1 1 24 4  2  o 4.613189  0.5922056 
1 1 1 24 4  3  o 0.000000  2.236196  
1 1 1 24 4  4  o 6.100293  0.4592950 
1 1 1 24 4  5  o 2.046100  1.134692  
1 1 1 24 4  6  o 4.183540  0.6391647 
1 1 1 24 4  7  o 4.606882  0.5761232 
1 1 1 24 4  8  o 2.597106  0.9550379 
1 1 1 24 4  9  o 4.613189  0.5754230 
1 1 1 24 4  10 f 3.502692  0.7770343 
1 1 1 24 4  11 o 2.350296  0.9822598 
1 1 1 24 4  12 o 1.406048  1.364385  
1 1 1 24 4  13 o 2.728134  0.8888948 
1 1 1 24 4  14 f 2.017482  1.089328  
1 1 1 24 4  15 o 2.674319  0.8941565 
1 1 1 24 4  16 o 2.863322  0.9569783 
1 1 1 24 4  17 o 2.585888  1.023094  
1 1 1 24 4  18 o 0.000000  2.374907  
1 1 1 24 4  19 o 2.337893  1.046602  
1 1 1 24 4  20 o 3.002110  0.9084469 
1 1 1 24 4  21 o 4.935915  0.6258993 
1 1 1 24 5  0  o 2.017482  1.226661  
1 1 1 24 5  1  o 0.000000  2.262049  
1 1 1 24 5  2  o 0.000000  2.210041  
1 1 1 24 5  3  o 2.674319  0.8614175 
1 1 1 24 5  4  o 3.288646  0.7246440 
1 1 1 24 5  5  o 2.619399  0.8583027 
1 1 1 24 5  6  o 0.000000  2.183572  
1 1 1 24 5  7  o 4.619487  0.5747254 
1 1 1 24 5  8  o 0.000000  2.210041  
1 1 1 24 5  9  o 2.574620  0.8694803 
1 1 1 24 5  10 o 0.000000  2.274865  
1 1 1 24 5  11 f 2.337893  0.9507533 
1 1 1 24 5  12 o 1.929082  1.082696  
1 1 1 24 5  13 o 3.680770  0.6529613 
1 1 1 24 5  14 o 0.000000  2.262049  
1 1 1 24 5  15 o 2.088292  0.9523072 
1 1 1 24 5  16 o 1.617584  1.131780  
1 1 1 24 5  17 o 0.000000  2.387117  
1 1 1 24 5  18 o 3.235169  0.7123852 
1 1 1 24 5  19 o 2.863322  0.7697464 
1 1 1 24 6  0  o 1.581230  1.468917  
1 1 1 24 6  1  o 0.000000  2.143257  
1 1 1 24 6  2  o 1.670634  0.9927918 
1 1 1 24 6  3  o 2.619399  0.7822321 
1 1 1 24 6  4  o 2.842942  0.8535907 
1 1 1 24 6  5  o 1.898701  1.014947  
1 1 1 24 6  6  o 3.217145  0.7304087 
1 1 1 24 6  7  o 0.000000  2.411352  
1 1 1 24 6  8  o 2.652488  0.8584945 
1 1 1 24 6  9  o 1.562735  1.249361  
1 1 1 24 6  10 o 2.812096  0.8765639 
1 1 1 24 6  11 o 1.820531  1.181578  
1 1 1 24 6  12 o 4.439771  0.6298075 
1 1 1 24 6  13 o 2.312888  1.037070  
1 1 1 24 6  14 f 3.895659  0.6220082 
1 1 1 24 6  15 o 0.000000  2.249160  
1 1 1 24 6  16 o 1.738851  1.204580  
1 1 1 24 7  0  o 3.235169  1.217679  
1 1 1 24 7  1  o 1.466769  1.602382  
1 1 1 24 7  2  o 2.287610  1.272709  
1 1 1 24 7  3  o 1.804491  1.412654  
1 1 1 24 7  4  o 0.000000  2.470901  
1 1 1 24 7  5  o 2.641504  1.148234  
1 1 1 24 7  6  o 1.883326  1.440493  
1 1 1 24 7  7  o 2.312888  1.263726  
1 1 1 24 7  8  o 0.000000  2.893623  
1 1 1 24 7  9  o 1.788307  1.383332  
1 1 1 24 7  10 o 1.525073  1.505950  
1 1 1 24 7  11 o 1.653140  1.250513  
1 1 1 24 7  12 o 2.706736  0.6863372 
1 1 1 24 8  0  o 3.125470  1.274835  
1 1 1 24 8  1  o 0.6379839 2.184432  
1 1 1 24 8  2  o 2.210041  1.208641  
1 1 1 24 8  3  o 3.031023  0.9750165 
1 1 1 24 8  4  o 4.663333  0.7555070 
1 1 1 25 0  1  o 1.275968  2.349090  
1 1 1 25 0  2  o 0.000000  3.358625  
1 1 1 25 0  3  o 2.933537  1.512777  
1 1 1 25 0  4  o 2.791342  1.549092  
1 1 1 25 0  5  o 0.000000  3.477702  
1 1 1 25 0  6  o 0.6379839 2.831348  
1 1 1 25 0  7  o 0.000000  3.367270  
1 1 1 25 0  8  o 2.236196  1.769843  
1 1 1 25 0  9  o 3.969587  1.235807  
1 1 1 25 0  10 o 7.727623  0.6948692 
1 1 1 25 0  11 o 8.425942  0.6575289 
1 1 1 25 0  12 o 2.325424  1.871992  
1 1 1 25 1  0  o 1.635459  2.005604  
1 1 1 25 1  1  o 3.494381  0.9974703 
1 1 1 25 1  2  o 4.169618  0.8422837 
1 1 1 25 1  3  o 5.040823  0.7614747 
1 1 1 25 1  4  o 0.000000  2.738770  
1 1 1 25 1  5  o 1.804491  1.484155  
1 1 1 25 1  6  o 2.963120  1.093403  
1 1 1 25 1  7  o 5.227687  0.6838157 
1 1 1 25 1  8  o 5.035051  0.7219733 
1 1 1 25 1  9  o 4.027752  0.8190057 
1 1 1 25 1  10 o 6.411659  0.5562736 
1 1 1 25 1  11 o 7.067360  0.5427390 
1 1 1 25 1  12 o 6.147767  0.6126267 
1 1 1 25 2  0  o 0.000000  3.235169  
1 1 1 25 2  1  o 5.955601  0.6701354 
1 1 1 25 2  2  o 7.132877  0.5645893 
1 1 1 25 2  3  o 4.700591  0.8139773 
1 1 1 25 2  4  o 3.235169  1.058122  
1 1 1 25 2  5  o 1.364067  1.834953  
1 1 1 25 2  6  o 4.176585  0.8353170 
1 1 1 25 2  7  o 1.738851  1.549795  
1 1 1 25 2  8  o 1.635459  1.714499  
1 1 1 25 2  9  o 1.562735  1.506416  
1 1 1 25 2  10 f 5.634521  0.6071098 
1 1 1 25 2  11 o 6.921884  0.5025761 
1 1 1 25 3  0  o 5.069578  1.030715  
1 1 1 25 3  1  o 0.000000  2.717456  
1 1 1 25 3  2  o 4.694402  0.7565345 
1 1 1 25 3  3  o 3.208096  1.058022  
1 1 1 25 3  4  o 0.000000  2.759919  
1 1 1 25 3  5  f 0.000000  2.641504  
1 1 1 25 3  6  o 2.791342  1.163570  
1 1 1 25 3  7  o 4.846758  0.7774337 
1 1 1 25 3  8  o 2.738770  1.126922  
1 1 1 25 4  0  o 1.131024  1.928639  
1 1 1 25 4  1  o 0.3410167 2.129884  
1 1 1 25 4  2  f 0.000000  2.337893  
1 1 1 25 4  3  o 2.482640  1.036614  
1 1 1 0  0  4  x ?         ?         
1 1 1 0  0  12 x ?         ?         
1 1 1 0  0  16 x ?         ?         
1 1 1 0  0  28 x ?         ?         
1 1 1 0  0  40 x ?         ?         
1 1 1 0  0  52 x ?         ?         
1 1 1 1  0  1  x ?         ?         
1 1 1 1  0  2  x ?         ?         
1 1 1 1  0  3  x ?         ?         
1 1 1 1  0  4  x ?         ?         
1 1 1 1  0  11 x ?         ?         
1 1 1 1  0  12 x ?         ?         
1 1 1 1  0  13 x ?         ?         
1 1 1 1  0  14 x ?         ?         
1 1 1 1  0  17 x ?         ?         
1 1 1 1  0  19 x ?         ?         
1 1 1 1  0  20 x ?         ?         
1 1 1 1  1  0  x ?         ?         
1 1 1 1  1  1  x ?         ?         
1 1 1 1  1  2  x ?         ?         
1 1 1 1  1  3  x ?         ?         
1 1 1 1  1  5  x ?         ?         
1 1 1 1  1  14 x ?         ?         
1 1 1 1  1  18 x ?         ?         
1 1 1 1  1  49 x ?         ?         
1 1 1 2  0  2  x ?         ?         
1 1 1 2  0  4  x ?         ?         
1 1 1 2  0  6  x ?         ?         
1 1 1 2  0  13 x ?         ?         
1 1 1 2  1  0  x ?         ?         
1 1 1 2  1  6  x ?         ?         
1 1 1 2  1  9  x ?         ?         
1 1 1 2  1  12 x ?         ?         
1 1 1 2  1  14 x ?         ?         
1 1 1 2  1  17 x ?         ?         
1 1 1 2  2  1  x ?         ?         
1 1 1 2  2  5  x ?         ?         
1 1 1 2  2  9  x ?         ?         
1 1 1 2  2  10 x ?         ?         
1 1 1 2  2  13 x ?         ?         
1 1 1 2  2  16 x ?         ?         
1 1 1 2  2  17 x ?         ?         
1 1 1 3  0  1  x ?         ?         
1 1 1 3  0  4  x ?         ?         
1 1 1 3  0  12 x ?         ?         
1 1 1 3  0  13 x ?         ?         
1 1 1 3  0  14 x ?         ?         
1 1 1 3  1  5  x ?         ?         
1 1 1 3  1  8  x ?         ?         
1 1 1 3  1  12 x ?         ?         
1 1 1 3  1  13 x ?         ?         
1 1 1 3  2  9  x ?         ?         
1 1 1 3  3  15 x ?         ?         
1 1 1 3  3  42 x ?         ?         
1 1 1 4  0  15 x ?         ?         
1 1 1 4  0  57 x ?         ?         
1 1 1 4  1  2  x ?         ?         
1 1 1 4  1  10 x ?         ?         
1 1 1 4  2  4  x ?         ?         
1 1 1 4  2  14 x ?         ?         
1 1 1 4  4  0  x ?         ?         
1 1 1 4  4  2  x ?         ?         
1 1 1 4  4  47 x ?         ?         
1 1 1 5  0  13 x ?         ?         
1 1 1 5  2  13 x ?         ?         
1 1 1 7  0  44 x ?         ?         
1 1 1 8  0  50 x ?         ?         
1 1 1 10 0  47 x ?         ?         
1 1 1 11 0  45 x ?         ?         
1 1 1 11 11 11 x ?         ?         
1 1 1 13 1  0  x ?         ?         
1 1 1 13 13 4  x ?         ?         
1 1 1 16 0  28 x ?         ?         
1 1 1 16 1  5  x ?         ?         
1 1 1 17 0  10 x ?         ?         
1 1 1 17 0  23 x ?         ?         
1 1 1 17 0  43 x ?         ?         
1 1 1 18 0  12 x ?         ?         
1 1 1 19 0  43 x ?         ?         
1 1 1 19 3  43 x ?         ?         
# 
#END OF REFLECTIONS
