data_r7bhisf
# 
_audit.revision_id     1_0 
_audit.creation_date   2022-07-20 
_audit.update_record   "Initial release" 
# 
_cell.entry_id      7bhi 
_cell.length_a      40.471 
_cell.length_b      55.010 
_cell.length_c      89.990 
_cell.angle_alpha   81.380 
_cell.angle_beta    86.360 
_cell.angle_gamma   89.950 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   0.9724 
# 
_entry.id   7bhi 
# 
_exptl_crystal.id   1 
# 
_reflns_scale.group_code   1 
# 
_symmetry.entry_id               7bhi 
_symmetry.space_group_name_H-M   "P 1" 
_symmetry.Int_Tables_number      1 
# 
loop_
_refln.crystal_id 
_refln.wavelength_id 
_refln.scale_group_code 
_refln.index_h 
_refln.index_k 
_refln.index_l 
_refln.status 
_refln.pdbx_r_free_flag 
_refln.F_meas_au 
_refln.F_meas_sigma_au 
_refln.intensity_meas 
_refln.intensity_sigma 
_refln.pdbx_I_plus 
_refln.pdbx_I_plus_sigma 
_refln.pdbx_I_minus 
_refln.pdbx_I_minus_sigma 
_refln.pdbx_F_plus 
_refln.pdbx_F_plus_sigma 
_refln.pdbx_F_minus 
_refln.pdbx_F_minus_sigma 
_refln.pdbx_anom_difference 
_refln.pdbx_anom_difference_sigma 
1 1 1 -14 -6  1  o 13 105.81  22.24  357.34    130.76   390.62   196.47   330.88    175.20   107.06  30.50  99.31   28.96  7.75    42.06  
1 1 1 -14 -6  2  o 8  72.71   23.56  164.16    112.29   203.41   170.56   134.13    149.18   81.49   28.99  70.95   26.80  10.54   39.48  
1 1 1 -14 -6  3  o 8  63.56   22.55  114.46    103.10   101.18   163.99   123.14    132.58   68.62   27.46  67.85   25.34  0.77    37.37  
1 1 1 -14 -5  1  o 7  122.57  21.35  471.86    144.80   337.69   227.95   562.63    187.48   100.07  33.61  131.76  25.71  -31.69  42.32  
1 1 1 -14 -5  2  o 2  277.66  34.29  2635.40   535.00   2628.06  761.98   2642.53   751.35   248.28  54.92  250.83  53.79  -2.55   76.87  
1 1 1 -14 -5  3  o 14 121.43  20.97  462.81    140.91   494.01   219.17   440.82    183.97   119.91  31.45  114.90  28.12  5.01    42.19  
1 1 1 -14 -5  4  o 17 125.65  20.33  492.84    141.65   508.49   215.28   480.89    188.12   121.97  30.76  120.20  27.81  1.78    41.47  
1 1 1 -14 -5  5  o 5  59.62   22.23  91.24     101.98   131.69   156.94   61.67     134.17   71.35   27.36  60.19   24.57  11.16   36.77  
1 1 1 -14 -4  1  o 17 162.84  21.65  823.84    197.40   721.83   285.58   917.16    273.16   143.94  34.92  166.81  29.61  -22.88  45.78  
1 1 1 -14 -4  2  o 15 200.70  24.55  1272.73   276.98   1239.57  400.13   1303.23   383.80   186.21  38.70  193.81  35.81  -7.60   52.73  
1 1 1 -14 -4  3  o 14 123.89  27.92  508.04    193.78   0.00     0.00     508.04    193.78   ?       ?      123.89  27.92  0.00    27.92  
1 1 1 -14 -4  4  o 15 193.01  36.74  1315.65   392.19   0.00     0.00     1315.65   392.19   ?       ?      193.01  36.74  0.00    36.74  
1 1 1 -14 -4  5  o 13 234.79  48.28  2196.91   629.04   0.00     0.00     2196.91   629.04   ?       ?      234.79  48.28  0.00    48.28  
1 1 1 -14 -4  6  o 6  63.40   25.27  84.22     138.33   0.00     0.00     84.22     138.33   ?       ?      63.40   25.27  0.00    25.27  
1 1 1 -14 -3  1  o 12 176.53  33.18  1051.60   323.89   0.00     0.00     1051.60   323.89   ?       ?      176.53  33.18  0.00    33.18  
1 1 1 -14 -3  2  o 16 169.42  32.23  964.88    302.00   0.00     0.00     964.88    302.00   ?       ?      169.42  32.23  0.00    32.23  
1 1 1 -14 -3  3  o 6  202.12  38.04  1442.26   425.21   0.00     0.00     1442.26   425.21   ?       ?      202.12  38.04  0.00    38.04  
1 1 1 -14 -3  4  o 8  182.88  34.51  1153.09   349.00   0.00     0.00     1153.09   349.00   ?       ?      182.88  34.51  0.00    34.51  
1 1 1 -14 -3  5  o 6  237.12  28.45  1835.55   379.52   1805.44  542.69   1864.37   530.94   216.79  45.08  222.98  43.04  -6.19   62.32  
1 1 1 -14 -3  6  o 15 232.76  28.36  1775.11   371.15   1687.91  532.68   1857.38   517.41   207.29  45.97  223.02  41.95  -15.73  62.24  
1 1 1 -14 -3  7  o 2  322.22  43.34  3931.95   781.35   4020.69  1109.25  3844.55   1100.79  272.45  70.41  263.66  71.11  8.79    100.07 
1 1 1 -14 -3  8  o 13 182.16  23.35  1053.33   238.56   1027.20  350.91   1075.78   325.28   168.05  37.34  175.85  33.44  -7.80   50.13  
1 1 1 -14 -2  1  o 8  128.92  28.23  545.18    203.17   0.00     0.00     545.18    203.17   ?       ?      128.92  28.23  0.00    28.23  
1 1 1 -14 -2  2  o 16 135.99  28.91  609.45    218.77   0.00     0.00     609.45    218.77   ?       ?      135.99  28.91  0.00    28.91  
1 1 1 -14 -2  3  o 10 217.73  41.52  1719.05   500.01   0.00     0.00     1719.05   500.01   ?       ?      217.73  41.52  0.00    41.52  
1 1 1 -14 -2  4  o 10 177.64  21.80  980.75    217.66   904.86   307.80   1056.66   307.84   162.03  34.17  177.77  31.31  -15.74  46.34  
1 1 1 -14 -2  5  f 0  164.44  21.06  839.77    194.20   731.99   276.35   944.94    272.97   145.11  33.80  169.10  29.17  -23.99  44.65  
1 1 1 -14 -2  6  o 11 59.74   21.47  97.96     93.83    66.01    132.27   130.33    133.12   60.42   24.49  68.86   25.45  -8.44   35.32  
1 1 1 -14 -2  7  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -14 -2  8  o 10 79.35   26.37  200.65    140.36   200.65   140.36   0.00      0.00     79.35   26.37  ?       ?      0.00    26.37  
1 1 1 -14 -1  1  x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -14 -1  2  o 19 74.17   21.51  172.34    96.88    140.00   157.82   191.89    122.73   73.08   27.57  78.27   24.55  -5.19   36.91  
1 1 1 -14 -1  3  o 2  212.90  25.23  1433.17   302.33   1436.58  433.04   1429.92   422.27   201.31  38.88  201.85  37.83  -0.54   54.25  
1 1 1 -14 -1  4  o 4  112.77  20.23  396.70    126.13   445.70   186.10   355.06    171.54   115.90  28.23  103.46  28.14  12.45   39.86  
1 1 1 -14 -1  5  o 1  120.82  30.58  495.78    212.21   495.78   212.21   0.00      0.00     120.82  30.58  ?       ?      0.00    30.58  
1 1 1 -14 -1  6  o 9  265.83  65.54  3504.63   993.75   3504.63  993.75   0.00      0.00     265.83  65.54  ?       ?      0.00    65.54  
1 1 1 -14 -1  7  o 8  177.67  36.05  1126.84   355.09   1126.84  355.09   0.00      0.00     177.67  36.05  ?       ?      0.00    36.05  
1 1 1 -14 -1  8  o 17 229.46  48.98  2177.25   625.49   2177.25  625.49   0.00      0.00     229.46  48.98  ?       ?      0.00    48.98  
1 1 1 -14 -1  9  o 15 163.54  20.44  836.33    187.76   857.24   267.55   816.04    263.55   158.12  30.58  153.91  30.90  4.21    43.48  
1 1 1 -14 0   1  o 3  141.16  31.23  667.55    246.34   667.55   246.34   0.00      0.00     141.16  31.23  ?       ?      0.00    31.23  
1 1 1 -14 0   2  o 2  105.02  19.56  342.68    113.57   373.57   183.04   323.34    144.81   106.01  29.17  99.90   25.24  6.11    38.57  
1 1 1 -14 0   3  o 16 66.14   20.96  133.24    89.23    100.19   156.75   149.09    108.53   68.05   26.97  70.19   23.19  -2.14   35.57  
1 1 1 -14 0   4  o 7  233.60  47.17  2108.73   610.71   2108.73  610.71   0.00      0.00     233.60  47.17  ?       ?      0.00    47.17  
1 1 1 -14 0   5  o 12 108.45  29.38  396.45    187.45   396.45   187.45   0.00      0.00     108.45  29.38  ?       ?      0.00    29.38  
1 1 1 -14 0   6  o 6  176.67  35.63  1102.19   348.83   1102.19  348.83   0.00      0.00     176.67  35.63  ?       ?      0.00    35.63  
1 1 1 -14 0   7  o 10 104.09  30.02  371.53    189.28   371.53   189.28   0.00      0.00     104.09  30.02  ?       ?      0.00    30.02  
1 1 1 -14 0   8  o 7  190.93  23.61  1164.26   253.27   1155.00  364.46   1172.91   352.21   178.05  36.87  181.30  35.11  -3.24   50.91  
1 1 1 -14 0   9  o 15 269.41  33.15  2531.09   501.89   2775.70  714.64   2293.03   705.02   254.94  50.62  222.09  55.47  32.85   75.09  
1 1 1 -14 1   1  o 5  222.13  26.03  1566.54   325.67   1492.57  462.78   1639.11   458.39   203.23  41.08  216.04  38.37  -12.82  56.21  
1 1 1 -14 1   2  o 1  107.48  19.36  358.46    115.04   318.68   169.38   392.54    156.75   98.24   28.42  110.04  25.34  -11.81  38.08  
1 1 1 -14 1   3  o 15 312.53  38.86  3449.52   682.15   3765.25  967.09   3136.88   962.35   293.01  59.53  255.01  65.42  38.00   88.45  
1 1 1 -14 1   4  o 3  172.61  33.57  1022.21   320.67   1022.21  320.67   0.00      0.00     172.61  33.57  ?       ?      0.00    33.57  
1 1 1 -14 1   5  o 1  69.22   27.14  113.30    157.08   113.30   157.08   0.00      0.00     69.22   27.14  ?       ?      0.00    27.14  
1 1 1 -14 1   6  o 8  244.82  28.95  1978.40   398.95   2187.05  571.24   1779.72   557.43   240.27  42.99  210.54  47.28  29.73   63.91  
1 1 1 -14 1   7  o 17 56.25   21.39  76.85     95.47    54.40    156.30   90.22     120.58   62.29   26.07  61.61   23.88  0.68    35.36  
1 1 1 -14 1   8  o 7  156.55  20.61  769.25    180.76   845.93   265.12   702.65    247.09   156.86  30.54  142.12  31.15  14.74   43.62  
1 1 1 -14 1   9  o 10 183.48  22.99  1077.35   236.87   1071.76  342.52   1082.47   327.92   171.01  36.03  173.94  34.06  -2.94   49.58  
1 1 1 -14 2   1  o 8  159.72  20.57  787.89    184.23   778.25   267.04   796.65    254.50   151.86  31.66  155.08  29.67  -3.22   43.39  
1 1 1 -14 2   2  o 3  230.46  27.21  1709.26   353.08   1728.69  504.37   1690.59   494.45   216.77  42.05  214.82  41.60  1.95    59.15  
1 1 1 -14 2   3  o 17 114.10  29.76  439.72    196.90   439.72   196.90   0.00      0.00     114.10  29.76  ?       ?      0.00    29.76  
1 1 1 -14 2   4  o 9  129.48  29.16  562.90    211.50   562.90   211.50   0.00      0.00     129.48  29.16  ?       ?      0.00    29.16  
1 1 1 -14 2   5  o 10 127.69  29.61  552.94    212.79   552.94   212.79   0.00      0.00     127.69  29.61  ?       ?      0.00    29.61  
1 1 1 -14 2   6  f 0  200.29  23.95  1279.79   269.90   1243.31  385.89   1314.72   377.63   184.66  37.68  192.33  35.51  -7.67   51.78  
1 1 1 -14 2   7  o 8  149.46  19.47  695.21    163.09   749.71   242.31   650.07    220.51   148.38  29.49  138.50  28.68  9.88    41.13  
1 1 1 -14 2   8  o 19 71.74   20.70  164.61    89.97    117.89   148.30   191.82    113.19   67.97   26.45  76.91   23.48  -8.94   35.37  
1 1 1 -14 2   9  o 17 191.15  23.25  1175.53   249.87   1227.22  358.25   1126.57   348.70   183.43  35.30  174.85  35.94  8.58    50.38  
1 1 1 -14 3   1  o 17 55.77   20.91  76.64     90.50    -32.16   141.64   151.71    117.65   52.26   23.30  71.00   24.15  -18.74  33.55  
1 1 1 -14 3   2  o 13 200.05  23.93  1265.60   269.34   1321.12  386.00   1212.92   376.00   193.98  35.99  185.00  36.70  8.98    51.40  
1 1 1 -14 3   3  o 10 69.87   26.81  124.96    150.79   124.96   150.79   0.00      0.00     69.87   26.81  ?       ?      0.00    26.81  
1 1 1 -14 3   4  o 10 157.51  32.95  862.08    288.37   862.08   288.37   0.00      0.00     157.51  32.95  ?       ?      0.00    32.95  
1 1 1 -14 3   5  o 13 222.74  46.88  2000.27   580.42   2000.27  580.42   0.00      0.00     222.74  46.88  ?       ?      0.00    46.88  
1 1 1 -14 3   6  o 19 195.32  23.88  1223.50   262.21   1196.51  377.44   1248.68   364.53   179.92  37.75  186.54  35.33  -6.63   51.71  
1 1 1 -14 3   7  o 13 76.09   24.99  185.95    126.16   0.00     0.00     185.95    126.16   ?       ?      76.09   24.99  0.00    24.99  
1 1 1 -14 3   8  o 19 176.32  21.85  990.13    216.43   1063.79  312.68   922.38    299.88   173.07  32.67  159.80  33.75  13.27   46.97  
1 1 1 -14 3   9  o 12 76.89   21.37  192.43    97.74    166.24   162.25   207.35    122.46   74.62   28.00  79.23   24.47  -4.61   37.18  
1 1 1 -14 4   1  o 18 98.14   20.88  305.91    113.99   241.86   170.26   357.93    153.45   86.41   29.05  104.14  25.80  -17.74  38.85  
1 1 1 -14 4   2  o 1  159.65  20.75  795.30    185.69   796.67   268.50   794.04    257.08   152.13  31.77  152.99  30.34  -0.86   43.93  
1 1 1 -14 4   3  o 13 227.47  48.30  2116.26   611.19   2116.26  611.19   0.00      0.00     227.47  48.30  ?       ?      0.00    48.30  
1 1 1 -14 4   4  o 11 197.13  39.77  1457.54   434.50   1457.54  434.50   0.00      0.00     197.13  39.77  ?       ?      0.00    39.77  
1 1 1 -14 4   5  o 1  239.47  29.40  1932.33   395.66   1935.65  562.59   1929.08   556.56   217.24  46.51  217.65  45.99  -0.41   65.41  
1 1 1 -14 4   6  o 19 100.14  20.43  320.90    113.47   238.40   171.80   384.73    151.11   84.79   29.17  107.44  24.97  -22.65  38.40  
1 1 1 -14 4   7  o 1  133.97  19.93  566.80    148.63   547.40   221.82   582.62    200.23   123.85  31.21  130.76  27.55  -6.90   41.63  
1 1 1 -14 4   8  f 0  176.94  22.46  1007.56   223.04   1000.88  321.35   1013.76   309.81   164.31  35.13  167.23  33.44  -2.92   48.50  
1 1 1 -14 5   1  o 17 135.85  20.06  577.86    151.74   547.01   219.24   606.22    210.23   125.54  30.69  134.12  28.20  -8.58   41.68  
1 1 1 -14 5   2  o 11 173.18  21.86  948.24    212.51   919.17   303.90   976.06    297.29   160.59  34.02  167.43  32.10  -6.84   46.78  
1 1 1 -14 5   3  x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -14 5   4  o 15 204.35  43.21  1665.33   491.08   1665.33  491.08   0.00      0.00     204.35  43.21  ?       ?      0.00    43.21  
1 1 1 -14 5   5  o 8  213.53  47.42  1940.91   566.10   1940.91  566.10   0.00      0.00     213.53  47.42  ?       ?      0.00    47.42  
1 1 1 -14 5   6  o 10 198.73  24.61  1292.47   274.73   1301.25  392.00   1283.99   385.13   184.46  38.27  183.84  37.76  0.62    53.76  
1 1 1 -14 5   7  o 4  141.93  20.21  639.63    160.04   566.55   232.55   705.39    220.59   124.49  32.28  143.44  27.79  -18.95  42.59  
1 1 1 -14 6   1  o 12 64.14   23.02  119.24    107.81   54.37    149.99   188.58    155.06   60.93   25.52  77.50   27.63  -16.56  37.62  
1 1 1 -14 6   2  f 0  43.24   19.25  -22.41    96.37    47.54    143.31   -80.13    130.20   59.20   24.88  45.61   21.10  13.59   32.62  
1 1 1 -14 6   3  o 9  121.20  28.37  507.64    193.88   0.00     0.00     507.64    193.88   ?       ?      121.20  28.37  0.00    28.37  
1 1 1 -14 6   4  o 15 237.20  66.93  3360.46   950.74   3360.46  950.74   0.00      0.00     237.20  66.93  ?       ?      0.00    66.93  
1 1 1 -14 6   5  o 18 72.40   26.92  157.28    149.32   157.28   149.32   0.00      0.00     72.40   26.92  ?       ?      0.00    26.92  
1 1 1 -14 6   6  o 12 91.16   21.31  272.04    109.53   243.98   160.35   296.57    149.96   84.52   28.19  92.70   26.72  -8.17   38.84  
1 1 1 -14 7   1  o 13 57.89   24.93  26.13     150.09   0.00     0.00     26.13     150.09   ?       ?      57.89   24.93  0.00    24.93  
1 1 1 -14 7   2  o 1  71.38   23.38  163.24    110.48   260.16   150.17   48.93     163.10   87.28   27.12  61.79   26.28  25.49   37.77  
1 1 1 -13 -9  1  o 1  119.25  18.25  436.50    120.98   314.55   182.72   531.71    161.44   97.31   29.86  129.87  22.47  -32.56  37.37  
1 1 1 -13 -9  2  o 8  68.98   19.40  148.47    80.05    56.14    127.00   209.33    103.11   58.69   23.92  81.16   21.71  -22.48  32.30  
1 1 1 -13 -9  3  o 7  195.35  23.92  1200.84   262.70   1091.25  376.83   1304.46   366.41   174.43  38.65  195.72  33.84  -21.29  51.37  
1 1 1 -13 -8  1  o 8  114.03  16.98  394.97    107.75   429.29   162.13   367.82    144.21   115.61  25.15  107.29  24.02  8.32    34.77  
1 1 1 -13 -8  2  o 2  252.49  29.24  2060.07   415.95   2056.00  591.88   2064.04   584.68   235.00  45.52  236.43  44.72  -1.43   63.81  
1 1 1 -13 -8  3  o 13 71.86   23.34  157.59    110.19   159.46   182.97   156.52    138.03   77.71   29.60  73.55   26.09  4.16    39.46  
1 1 1 -13 -8  4  o 4  191.40  23.22  1144.62   249.92   1085.04  359.62   1200.26   347.56   176.17  36.75  188.48  33.34  -12.31  49.62  
1 1 1 -13 -8  5  o 5  159.97  20.63  789.93    185.07   785.37   265.26   794.26    258.35   153.00  31.26  154.62  30.19  -1.62   43.46  
1 1 1 -13 -8  6  o 12 208.02  24.57  1364.99   287.77   1388.96  411.11   1341.96   402.94   198.96  37.37  195.60  37.24  3.36    52.76  
1 1 1 -13 -7  1  o 17 245.39  27.82  1907.27   384.96   1921.24  547.13   1893.57   541.74   232.83  42.50  231.25  42.37  1.58    60.01  
1 1 1 -13 -7  2  o 8  118.52  19.24  430.72    126.40   332.70   175.17   537.22    182.58   101.01  28.80  129.94  25.39  -28.93  38.40  
1 1 1 -13 -7  3  o 10 57.38   22.30  69.90     105.27   32.86    213.65   81.78     120.98   69.54   29.84  61.42   23.89  8.12    38.23  
1 1 1 -13 -7  4  o 14 163.58  22.09  828.21    202.11   899.72   313.30   777.24    264.51   162.68  34.61  153.19  31.14  9.50    46.56  
1 1 1 -13 -7  5  o 2  133.14  27.75  577.47    205.19   0.00     0.00     577.47    205.19   ?       ?      133.14  27.75  0.00    27.75  
1 1 1 -13 -7  6  o 14 265.92  31.85  2337.29   476.56   2255.55  677.57   2417.31   670.40   238.28  51.07  250.75  48.33  -12.47  70.31  
1 1 1 -13 -7  7  o 14 73.21   25.56  158.06    132.16   0.00     0.00     158.06    132.16   ?       ?      73.21   25.56  0.00    25.56  
1 1 1 -13 -7  8  o 6  286.40  75.29  4467.66   1253.85  0.00     0.00     4467.66   1253.85  ?       ?      286.40  75.29  0.00    75.29  
1 1 1 -13 -6  1  o 5  201.28  22.92  1244.45   260.13   1207.92  372.26   1279.31   363.66   190.17  35.40  197.40  33.27  -7.23   48.58  
1 1 1 -13 -6  2  o 17 232.85  42.39  1902.11   545.80   0.00     0.00     1902.11   545.80   ?       ?      232.85  42.39  0.00    42.39  
1 1 1 -13 -6  3  o 14 72.31   25.31  149.25    129.54   0.00     0.00     149.25    129.54   ?       ?      72.31   25.31  0.00    25.31  
1 1 1 -13 -6  4  o 14 120.33  26.51  465.12    178.18   0.00     0.00     465.12    178.18   ?       ?      120.33  26.51  0.00    26.51  
1 1 1 -13 -6  5  o 5  164.29  30.29  881.20    275.16   0.00     0.00     881.20    275.16   ?       ?      164.29  30.29  0.00    30.29  
1 1 1 -13 -6  6  o 5  66.33   24.47  115.23    122.96   0.00     0.00     115.23    122.96   ?       ?      66.33   24.47  0.00    24.47  
1 1 1 -13 -6  7  o 16 68.23   24.72  127.86    124.64   0.00     0.00     127.86    124.64   ?       ?      68.23   24.72  0.00    24.72  
1 1 1 -13 -6  8  o 3  132.58  27.25  573.61    200.44   0.00     0.00     573.61    200.44   ?       ?      132.58  27.25  0.00    27.25  
1 1 1 -13 -6  9  o 7  294.95  36.12  3001.13   598.83   3052.03  849.82   2950.94   843.95   266.17  57.31  260.43  57.94  5.73    81.50  
1 1 1 -13 -5  1  o 19 220.67  39.21  1651.95   478.46   0.00     0.00     1651.95   478.46   ?       ?      220.67  39.21  0.00    39.21  
1 1 1 -13 -5  2  o 13 333.73  84.72  5810.34   1625.80  0.00     0.00     5810.34   1625.80  ?       ?      333.73  84.72  0.00    84.72  
1 1 1 -13 -5  3  o 13 308.07  67.23  4114.87   1155.56  0.00     0.00     4114.87   1155.56  ?       ?      308.07  67.23  0.00    67.23  
1 1 1 -13 -5  4  o 17 155.54  19.84  735.30    173.10   680.23   248.64   787.10    241.12   144.12  30.98  157.12  27.75  -13.00  41.59  
1 1 1 -13 -5  5  o 15 122.70  18.62  458.40    127.06   523.36   186.23   401.84    173.78   128.06  26.22  111.49  27.36  16.57   37.89  
1 1 1 -13 -5  6  o 19 77.05   21.57  185.50    99.17    155.86   159.95   204.01    126.39   75.79   27.92  80.83   24.84  -5.04   37.37  
1 1 1 -13 -5  7  o 8  317.25  38.53  3455.18   687.31   3589.85  979.14   3324.37   965.03   291.31  60.53  277.11  62.19  14.21   86.79  
1 1 1 -13 -5  8  o 17 90.14   22.51  258.29    116.09   384.17   218.34   208.67    137.08   106.86  32.61  81.55   25.99  25.31   41.70  
1 1 1 -13 -5  9  o 13 256.03  55.70  2749.57   795.33   2749.57  795.33   0.00      0.00     256.03  55.70  ?       ?      0.00    55.70  
1 1 1 -13 -5  10 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -13 -5  11 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -13 -4  1  o 9  105.63  20.14  343.29    117.65   318.93   182.04   360.77    154.18   99.82   29.63  106.65  25.52  -6.82   39.11  
1 1 1 -13 -4  2  o 4  213.86  24.20  1406.40   291.90   1512.93  418.69   1305.64   407.17   214.45  35.23  197.46  37.29  17.00   51.30  
1 1 1 -13 -4  3  f 0  113.68  19.44  395.18    122.29   393.87   187.75   396.14    161.16   110.27  29.20  111.65  25.68  -1.38   38.89  
1 1 1 -13 -4  4  o 16 116.99  19.05  417.48    123.53   447.24   188.57   395.10    163.50   117.69  28.27  111.28  26.05  6.41    38.44  
1 1 1 -13 -4  5  o 8  130.79  18.57  518.76    135.52   549.29   199.46   492.59    184.68   130.90  27.42  124.11  26.71  6.79    38.28  
1 1 1 -13 -4  6  o 9  254.86  48.87  2409.89   688.92   2409.89  688.92   0.00      0.00     254.86  48.87  ?       ?      0.00    48.87  
1 1 1 -13 -4  7  o 3  259.89  51.09  2579.41   735.01   2579.41  735.01   0.00      0.00     259.89  51.09  ?       ?      0.00    51.09  
1 1 1 -13 -4  8  o 6  179.75  33.68  1083.12   334.77   1083.12  334.77   0.00      0.00     179.75  33.68  ?       ?      0.00    33.68  
1 1 1 -13 -4  9  o 3  229.05  44.00  1927.54   557.57   1927.54  557.57   0.00      0.00     229.05  44.00  ?       ?      0.00    44.00  
1 1 1 -13 -4  10 o 12 94.78   31.61  294.64    201.68   294.64   201.68   0.00      0.00     94.78   31.61  ?       ?      0.00    31.61  
1 1 1 -13 -4  11 o 9  51.70   20.67  48.34     92.77    62.76    192.68   43.99     105.85   68.41   28.81  53.47   21.82  14.93   36.14  
1 1 1 -13 -4  12 o 15 107.97  21.25  369.34    127.00   510.00   228.24   306.26    152.85   121.12  32.25  96.14   26.73  24.98   41.89  
1 1 1 -13 -3  1  o 11 154.85  18.96  721.94    165.03   741.97   232.72   701.69    234.07   153.34  27.45  148.53  28.49  4.81    39.56  
1 1 1 -13 -3  2  o 13 278.59  31.30  2467.57   491.85   2554.04  695.64   2381.14   695.53   268.55  46.82  256.89  48.95  11.66   67.74  
1 1 1 -13 -3  3  o 13 111.14  28.10  397.17    179.34   397.17   179.34   0.00      0.00     111.14  28.10  ?       ?      0.00    28.10  
1 1 1 -13 -3  4  o 12 101.88  29.18  334.26    179.38   334.26   179.38   0.00      0.00     101.88  29.18  ?       ?      0.00    29.18  
1 1 1 -13 -3  5  o 3  217.08  39.70  1610.82   476.51   1610.82  476.51   0.00      0.00     217.08  39.70  ?       ?      0.00    39.70  
1 1 1 -13 -3  6  o 7  166.96  32.39  916.25    299.20   916.25   299.20   0.00      0.00     166.96  32.39  ?       ?      0.00    32.39  
1 1 1 -13 -3  7  o 12 131.55  29.63  565.92    218.38   565.92   218.38   0.00      0.00     131.55  29.63  ?       ?      0.00    29.63  
1 1 1 -13 -3  8  f 0  99.90   19.81  309.67    109.60   292.69   172.77   321.10    141.78   95.14   29.01  100.13  24.80  -4.99   38.16  
1 1 1 -13 -3  9  o 4  203.93  23.61  1294.66   271.34   1299.23  386.46   1290.22   381.05   195.07  35.83  194.75  35.39  0.31    50.36  
1 1 1 -13 -3  10 o 12 292.38  35.02  2899.75   576.10   2989.89  817.55   2810.85   811.95   269.62  54.69  258.62  56.29  11.00   78.49  
1 1 1 -13 -3  11 o 16 111.60  19.02  386.04    117.47   340.52   174.71   423.60    158.70   100.95  28.76  114.32  24.89  -13.36  38.03  
1 1 1 -13 -3  12 f 0  60.02   20.95  102.81    88.71    160.74   140.43   64.34     114.44   73.72   26.30  57.48   22.96  16.24   34.91  
1 1 1 -13 -3  13 o 17 187.24  22.09  1101.32   232.87   1219.29  337.27   993.86    321.91   188.55  32.32  167.90  34.55  20.66   47.31  
1 1 1 -13 -2  1  o 5  135.17  26.83  576.62    200.82   0.00     0.00     576.62    200.82   ?       ?      135.17  26.83  0.00    26.83  
1 1 1 -13 -2  2  o 4  166.87  29.63  887.26    273.42   887.26   273.42   0.00      0.00     166.87  29.63  ?       ?      0.00    29.63  
1 1 1 -13 -2  3  o 16 273.00  51.23  2735.44   773.35   2735.44  773.35   0.00      0.00     273.00  51.23  ?       ?      0.00    51.23  
1 1 1 -13 -2  4  o 19 163.28  29.46  853.04    266.01   853.04   266.01   0.00      0.00     163.28  29.46  ?       ?      0.00    29.46  
1 1 1 -13 -2  5  o 15 242.51  27.28  1839.93   373.16   1837.30  527.93   1842.55   527.52   230.82  41.36  231.26  41.25  -0.44   58.41  
1 1 1 -13 -2  6  o 10 167.17  19.54  846.10    183.97   902.41   260.15   789.77    260.19   168.48  27.87  156.16  30.12  12.32   41.03  
1 1 1 -13 -2  7  o 16 174.08  20.68  924.02    202.58   965.06   293.92   886.89    279.60   172.16  30.87  165.03  30.64  7.13    43.50  
1 1 1 -13 -2  8  o 8  215.76  24.71  1450.99   300.57   1518.51  432.29   1387.79   418.19   211.15  37.01  201.18  37.59  9.97    52.75  
1 1 1 -13 -2  9  o 9  139.40  18.90  592.63    147.33   631.36   219.74   561.01    198.57   139.18  28.46  131.68  27.17  7.50    39.35  
1 1 1 -13 -2  10 o 18 268.12  31.18  2361.12   470.98   2530.56  671.53   2197.07   660.74   258.79  46.93  236.44  50.23  22.34   68.74  
1 1 1 -13 -2  11 o 6  146.82  19.31  662.60    158.80   777.25   237.80   570.33    213.33   154.10  27.91  130.77  29.16  23.33   40.36  
1 1 1 -13 -2  12 o 2  116.41  19.20  421.28    123.83   404.82   194.02   432.59    160.85   108.91  30.05  115.15  25.05  -6.23   39.12  
1 1 1 -13 -2  13 o 7  246.09  29.74  2022.70   411.70   2004.68  585.82   2040.29   578.71   222.88  47.25  226.67  46.05  -3.79   65.98  
1 1 1 -13 -1  1  f 0  262.47  48.06  2439.25   697.50   2439.25  697.50   0.00      0.00     262.47  48.06  ?       ?      0.00    48.06  
1 1 1 -13 -1  2  o 3  136.98  28.26  597.50    214.83   597.50   214.83   0.00      0.00     136.98  28.26  ?       ?      0.00    28.26  
1 1 1 -13 -1  3  o 5  151.47  29.07  732.57    243.57   732.57   243.57   0.00      0.00     151.47  29.07  ?       ?      0.00    29.07  
1 1 1 -13 -1  4  o 4  267.48  30.55  2272.17   460.68   2197.18  654.04   2346.00   648.99   246.95  47.86  257.85  45.51  -10.91  66.04  
1 1 1 -13 -1  5  o 9  82.61   20.38  212.34    96.05    232.34   149.39   198.24    125.41   86.37   27.08  80.14   24.76  6.22    36.70  
1 1 1 -13 -1  6  o 9  90.06   18.68  250.01    93.40    190.70   131.87   309.71    132.31   79.06   25.52  98.99   23.61  -19.93  34.77  
1 1 1 -13 -1  7  o 15 91.36   17.99  256.43    90.99    352.09   126.08   152.48    131.43   106.27  21.41  72.95   25.49  33.32   33.29  
1 1 1 -13 -1  8  o 4  116.10  17.38  409.10    112.31   445.60   161.16   374.63    156.60   118.44  24.51  107.98  25.65  10.46   35.48  
1 1 1 -13 -1  9  o 5  154.36  18.69  723.98    162.24   780.23   229.87   668.14    229.02   156.20  26.59  143.01  28.89  13.19   39.26  
1 1 1 -13 -1  10 o 5  199.37  22.91  1236.64   257.46   1247.01  364.75   1226.34   363.46   191.51  34.44  189.71  34.65  1.80    48.86  
1 1 1 -13 -1  11 o 10 130.15  17.85  517.45    129.83   622.28   189.23   424.20    178.46   139.52  24.52  113.17  27.70  26.35   36.99  
1 1 1 -13 -1  12 o 2  219.04  25.96  1543.78   320.06   1555.47  459.37   1532.74   446.18   205.29  40.42  204.95  39.35  0.34    56.41  
1 1 1 -13 -1  13 o 8  153.37  20.26  734.18    174.06   695.07   259.50   766.17    234.68   140.57  32.76  151.55  28.01  -10.98  43.10  
1 1 1 -13 -1  14 f 0  164.42  20.38  846.02    188.25   986.79   279.36   728.93    254.78   170.52  29.61  144.46  31.60  26.06   43.31  
1 1 1 -13 0   1  o 10 83.36   26.43  212.21    141.88   212.21   141.88   0.00      0.00     83.36   26.43  ?       ?      0.00    26.43  
1 1 1 -13 0   2  o 1  131.05  28.17  547.84    205.59   547.84   205.59   0.00      0.00     131.05  28.17  ?       ?      0.00    28.17  
1 1 1 -13 0   3  o 14 153.41  18.73  708.50    161.51   825.79   240.33   611.90    218.10   162.20  26.74  138.41  28.40  23.79   39.01  
1 1 1 -13 0   4  o 16 106.03  17.91  341.68    105.13   569.43   166.00   189.15    135.85   135.97  22.02  79.19   25.93  56.78   34.02  
1 1 1 -13 0   5  o 11 158.40  19.33  759.03    172.15   807.45   250.38   715.61    237.08   159.01  28.47  149.38  28.69  9.63    40.42  
1 1 1 -13 0   6  o 5  252.16  28.49  2010.89   405.20   2089.26  575.66   1933.93   570.44   244.17  42.62  233.12  44.24  11.05   61.43  
1 1 1 -13 0   7  o 5  95.77   18.91  282.94    100.29   293.18   153.48   275.31    132.48   95.51   26.87  92.98   24.49  2.52    36.35  
1 1 1 -13 0   8  o 14 102.78  19.15  326.04    108.84   332.33   164.65   321.15    145.06   101.09  27.60  99.98   25.27  1.11    37.42  
1 1 1 -13 0   9  o 5  302.17  36.10  3095.67   613.81   3208.40  870.66   2984.27   865.47   279.83  56.15  266.26  58.25  13.57   80.91  
1 1 1 -13 0   10 o 10 150.54  19.49  694.76    164.46   680.92   238.99   707.20    226.65   143.14  30.04  147.34  27.82  -4.20   40.94  
1 1 1 -13 0   11 o 17 255.17  29.19  2128.14   419.88   2366.52  596.03   1893.29   591.60   253.40  42.47  218.70  48.40  34.70   64.40  
1 1 1 -13 0   12 o 4  150.43  18.75  696.20    158.43   688.77   225.06   703.51    223.08   143.89  28.26  145.87  27.65  -1.98   39.53  
1 1 1 -13 0   13 o 3  51.74   19.78  62.44     81.85    32.61    118.70   89.49     113.03   54.01   22.67  60.46   23.21  -6.45   32.44  
1 1 1 -13 0   14 o 9  215.70  44.70  1872.09   535.34   0.00     0.00     1872.09   535.34   ?       ?      215.70  44.70  0.00    44.70  
1 1 1 -13 1   1  o 8  140.12  27.34  621.15    212.05   621.15   212.05   0.00      0.00     140.12  27.34  ?       ?      0.00    27.34  
1 1 1 -13 1   2  o 15 274.53  30.63  2385.81   474.44   2652.07  672.74   2122.34   669.19   277.15  43.73  241.27  49.96  35.88   66.40  
1 1 1 -13 1   3  o 3  174.90  20.40  926.28    200.97   1036.86  291.93   826.67    277.08   180.61  29.15  159.70  31.34  20.91   42.80  
1 1 1 -13 1   4  o 14 126.70  18.12  485.48    128.02   639.47   198.32   375.48    167.62   142.80  25.11  108.18  27.06  34.62   36.92  
1 1 1 -13 1   5  o 19 225.48  25.09  1576.74   319.28   1814.01  457.67   1351.81   445.62   234.23  35.12  197.24  40.71  36.98   53.76  
1 1 1 -13 1   6  o 4  184.21  21.09  1035.56   218.97   1183.75  318.66   903.01    301.39   191.73  29.93  165.13  32.95  26.60   44.51  
1 1 1 -13 1   7  o 19 195.70  22.42  1178.93   247.31   1216.12  356.52   1144.44   343.35   191.22  33.71  185.56  33.46  5.65    47.50  
1 1 1 -13 1   8  o 19 213.57  24.50  1424.40   294.95   1429.63  420.30   1419.33   414.02   203.87  37.29  203.57  36.78  0.31    52.37  
1 1 1 -13 1   9  o 13 171.74  20.38  904.87    196.97   1015.68  282.44   799.96    274.83   176.78  28.82  154.38  32.06  22.40   43.11  
1 1 1 -13 1   10 o 7  201.09  23.03  1262.65   261.03   1389.11  373.13   1141.44   365.30   202.84  33.19  180.73  36.47  22.10   49.31  
1 1 1 -13 1   11 o 4  193.01  22.82  1168.62   247.96   1159.12  355.36   1177.64   346.15   182.22  35.25  184.98  33.84  -2.76   48.86  
1 1 1 -13 1   12 o 19 207.47  40.01  1593.68   459.26   0.00     0.00     1593.68   459.26   ?       ?      207.47  40.01  0.00    40.01  
1 1 1 -13 1   13 o 7  205.14  40.71  1603.08   462.44   0.00     0.00     1603.08   462.44   ?       ?      205.14  40.71  0.00    40.71  
1 1 1 -13 1   14 o 12 120.38  26.01  485.86    174.50   0.00     0.00     485.86    174.50   ?       ?      120.38  26.01  0.00    26.01  
1 1 1 -13 2   1  o 2  197.70  35.43  1288.96   387.34   1288.96  387.34   0.00      0.00     197.70  35.43  ?       ?      0.00    35.43  
1 1 1 -13 2   2  o 12 166.67  19.91  840.47    186.78   874.58   270.44   809.36    258.27   165.29  29.59  158.98  29.38  6.31    41.70  
1 1 1 -13 2   3  o 4  281.14  31.83  2537.56   504.70   2785.81  716.22   2292.70   711.31   279.55  46.25  246.93  51.83  32.62   69.46  
1 1 1 -13 2   4  o 18 77.19   19.53  184.99    86.59    241.29   130.35   140.51    115.86   87.41   24.82  69.87   23.96  17.53   34.50  
1 1 1 -13 2   5  o 4  133.12  17.72  535.35    132.03   605.93   192.77   472.98    181.21   138.55  25.16  121.39  26.73  17.16   36.71  
1 1 1 -13 2   6  o 11 185.37  21.34  1052.04   222.91   1119.35  320.30   988.82    310.40   185.11  31.25  172.96  32.45  12.15   45.06  
1 1 1 -13 2   7  o 10 162.29  19.07  800.14    174.26   1032.69  254.77   595.71    238.88   181.21  25.17  133.51  31.65  47.70   40.44  
1 1 1 -13 2   8  o 17 297.47  34.82  2974.63   583.34   3387.80  827.53   2566.54   822.43   295.85  50.54  243.60  59.36  52.25   77.96  
1 1 1 -13 2   9  o 1  75.57   25.59  173.28    132.14   173.28   132.14   0.00      0.00     75.57   25.59  ?       ?      0.00    25.59  
1 1 1 -13 2   10 o 13 159.54  29.75  846.02    262.47   0.00     0.00     846.02    262.47   ?       ?      159.54  29.75  0.00    29.75  
1 1 1 -13 2   11 o 11 80.55   24.45  208.57    122.97   0.00     0.00     208.57    122.97   ?       ?      80.55   24.45  0.00    24.45  
1 1 1 -13 2   12 o 9  151.45  28.93  772.68    242.32   0.00     0.00     772.68    242.32   ?       ?      151.45  28.93  0.00    28.93  
1 1 1 -13 2   13 o 2  174.35  33.67  1084.47   324.82   0.00     0.00     1084.47   324.82   ?       ?      174.35  33.67  0.00    33.67  
1 1 1 -13 2   14 o 12 88.56   27.89  268.05    158.30   268.05   158.30   0.00      0.00     88.56   27.89  ?       ?      0.00    27.89  
1 1 1 -13 3   1  o 19 246.24  45.46  2157.95   619.01   2157.95  619.01   0.00      0.00     246.24  45.46  ?       ?      0.00    45.46  
1 1 1 -13 3   2  o 1  196.25  22.51  1180.02   249.01   1193.68  356.68   1167.04   347.80   190.27  33.90  188.46  33.37  1.81    47.57  
1 1 1 -13 3   3  o 12 166.73  20.07  844.81    188.23   1098.59  273.46   616.31    259.48   187.07  26.18  135.65  33.52  51.42   42.53  
1 1 1 -13 3   4  f 0  296.16  34.67  2896.89   578.22   2920.95  819.74   2873.07   815.72   273.82  54.07  271.20  54.29  2.62    76.62  
1 1 1 -13 3   5  o 6  197.65  22.75  1204.85   253.38   1217.14  363.31   1193.21   353.56   190.67  34.46  189.27  33.78  1.41    48.26  
1 1 1 -13 3   6  o 17 190.27  33.79  1211.65   355.56   0.00     0.00     1211.65   355.56   ?       ?      190.27  33.79  0.00    33.79  
1 1 1 -13 3   7  o 13 167.97  19.95  862.99    188.58   942.73   272.20   789.38    261.52   170.31  28.87  154.47  30.58  15.84   42.05  
1 1 1 -13 3   8  o 4  161.03  19.58  794.28    177.26   850.74   256.48   742.65    245.27   161.26  28.76  149.94  29.55  11.33   41.23  
1 1 1 -13 3   9  f 0  89.25   19.10  249.35    94.92    328.29   152.25   199.15    121.41   100.03  26.20  79.21   24.35  20.82   35.77  
1 1 1 -13 3   10 o 1  221.23  42.82  1840.67   524.11   0.00     0.00     1840.67   524.11   ?       ?      221.23  42.82  0.00    42.82  
1 1 1 -13 3   11 o 2  135.95  25.53  604.07    191.90   0.00     0.00     604.07    191.90   ?       ?      135.95  25.53  0.00    25.53  
1 1 1 -13 3   12 o 19 98.58   25.50  324.78    145.39   0.00     0.00     324.78    145.39   ?       ?      98.58   25.50  0.00    25.50  
1 1 1 -13 3   13 o 3  153.28  19.00  733.67    163.59   940.27   237.04   545.77    226.05   168.96  25.21  123.21  31.76  45.74   40.55  
1 1 1 -13 3   14 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -13 4   1  o 7  200.14  36.32  1349.54   401.95   1349.54  401.95   0.00      0.00     200.14  36.32  ?       ?      0.00    36.32  
1 1 1 -13 4   2  o 16 222.52  25.32  1544.29   317.63   1491.26  452.14   1595.96   446.31   207.67  39.37  216.95  37.17  -9.28   54.14  
1 1 1 -13 4   3  o 18 277.79  32.28  2516.88   505.15   2652.25  716.49   2383.08   712.30   266.65  48.60  248.73  51.58  17.92   70.87  
1 1 1 -13 4   4  o 9  95.35   18.61  280.63    98.20    355.16   149.10   223.53    130.51   105.23  25.05  84.06   25.12  21.17   35.47  
1 1 1 -13 4   5  o 9  170.07  20.36  885.48    194.80   857.23   280.63   911.76    270.62   160.70  31.55  167.42  29.22  -6.71   43.00  
1 1 1 -13 4   6  o 4  190.59  22.18  1124.65   238.18   1229.91  341.37   1024.81   332.48   192.34  32.04  173.27  34.64  19.07   47.19  
1 1 1 -13 4   7  o 1  171.15  20.61  902.56    198.44   1092.84  287.53   729.49    274.22   183.48  28.20  145.81  33.47  37.66   43.77  
1 1 1 -13 4   8  o 11 208.94  24.37  1379.76   286.87   1383.09  410.37   1376.58   401.16   197.66  37.54  198.08  36.63  -0.42   52.45  
1 1 1 -13 4   9  o 9  111.39  18.15  383.16    112.05   457.23   168.43   324.36    150.08   118.27  25.55  99.16   26.04  19.11   36.48  
1 1 1 -13 4   10 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -13 4   11 o 18 124.49  25.41  511.89    175.45   0.00     0.00     511.89    175.45   ?       ?      124.49  25.41  0.00    25.41  
1 1 1 -13 4   12 o 10 183.79  22.19  1078.82   229.40   1082.90  332.29   1075.10   317.08   172.34  34.79  173.54  33.03  -1.21   47.97  
1 1 1 -13 4   13 o 4  153.89  19.48  746.05    168.25   1047.57  249.96   496.26    227.51   177.78  25.20  115.83  32.76  61.94   41.33  
1 1 1 -13 4   14 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -13 5   1  o 6  145.56  29.04  689.95    234.15   689.95   234.15   0.00      0.00     145.56  29.04  ?       ?      0.00    29.04  
1 1 1 -13 5   2  o 4  200.17  23.21  1242.35   261.73   1328.20  373.42   1159.45   366.93   199.30  33.85  184.28  35.98  15.02   49.40  
1 1 1 -13 5   3  o 18 149.90  19.15  685.38    161.07   721.48   234.77   653.28    221.39   148.92  28.50  141.70  28.21  7.22    40.10  
1 1 1 -13 5   4  o 16 100.01  18.50  308.76    102.29   295.98   154.49   318.75    136.50   95.35   27.00  99.66   24.12  -4.31   36.21  
1 1 1 -13 5   5  o 7  146.60  19.01  657.55    156.22   707.64   225.78   611.55    216.38   147.43  27.70  136.30  28.57  11.12   39.79  
1 1 1 -13 5   6  o 7  66.75   20.62  137.12    86.93    166.00   134.73   116.52    113.78   74.49   25.82  65.17   23.62  9.32    35.00  
1 1 1 -13 5   7  o 6  209.78  39.56  1592.70   458.95   0.00     0.00     1592.70   458.95   ?       ?      209.78  39.56  0.00    39.56  
1 1 1 -13 5   8  o 1  80.01   20.19  203.34    92.70    243.04   143.26   174.74    121.58   86.26   26.43  74.78   24.53  11.47   36.06  
1 1 1 -13 5   9  o 7  162.47  20.13  821.39    183.72   777.42   264.16   862.59    255.69   149.92  31.69  160.46  28.82  -10.54  42.83  
1 1 1 -13 5   10 o 7  62.78   22.91  110.02    107.36   0.00     0.00     110.02    107.36   ?       ?      62.78   22.91  0.00    22.91  
1 1 1 -13 5   11 o 12 185.68  36.44  1278.62   374.51   0.00     0.00     1278.62   374.51   ?       ?      185.68  36.44  0.00    36.44  
1 1 1 -13 5   12 o 14 95.03   19.36  289.23    102.04   363.96   154.56   231.49    135.86   103.09  26.10  82.82   25.81  20.26   36.70  
1 1 1 -13 5   13 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -13 6   1  o 13 90.20   26.16  262.74    143.33   262.74   143.33   0.00      0.00     90.20   26.16  ?       ?      0.00    26.16  
1 1 1 -13 6   2  o 2  270.15  58.95  3147.08   888.46   3147.08  888.46   0.00      0.00     270.15  58.95  ?       ?      0.00    58.95  
1 1 1 -13 6   3  o 7  61.22   21.23  106.68    91.07    136.48   128.16   76.28     129.44   69.66   25.09  61.58   24.48  8.08    35.05  
1 1 1 -13 6   4  o 7  105.62  18.86  345.83    110.17   409.88   157.03   283.74    154.60   112.49  24.97  93.01   27.22  19.48   36.94  
1 1 1 -13 6   5  o 12 246.70  29.23  1996.23   405.96   2141.10  576.40   1853.63   571.87   238.77  43.66  217.26  47.20  21.52   64.30  
1 1 1 -13 6   6  o 15 79.31   20.20  199.66    92.21    244.83   137.57   162.80    124.26   86.62   25.77  73.02   24.82  13.60   35.77  
1 1 1 -13 6   7  o 17 262.98  67.73  3652.02   1028.61  3652.02  1028.61  0.00      0.00     262.98  67.73  ?       ?      0.00    67.73  
1 1 1 -13 6   8  o 8  143.25  18.88  635.90    151.48   723.30   217.04   552.90    211.51   148.01  26.52  126.96  29.57  21.05   39.72  
1 1 1 -13 6   9  o 14 177.13  21.66  993.83    215.66   1120.95  307.23   870.36    302.80   180.27  30.79  154.55  34.95  25.71   46.58  
1 1 1 -13 6   10 o 3  106.20  25.25  379.57    151.64   0.00     0.00     379.57    151.64   ?       ?      106.20  25.25  0.00    25.25  
1 1 1 -13 6   11 o 5  86.15   25.52  252.45    135.15   0.00     0.00     252.45    135.15   ?       ?      86.15   25.52  0.00    25.52  
1 1 1 -13 6   12 o 15 216.77  27.05  1601.32   329.26   1710.12  467.42   1494.16   463.90   204.48  41.24  186.12  44.10  18.36   60.38  
1 1 1 -13 7   1  o 2  100.57  26.34  332.52    153.82   332.52   153.82   0.00      0.00     100.57  26.34  ?       ?      0.00    26.34  
1 1 1 -13 7   2  o 4  211.20  40.79  1633.98   476.60   1633.98  476.60   0.00      0.00     211.20  40.79  ?       ?      0.00    40.79  
1 1 1 -13 7   3  o 11 187.77  22.92  1109.34   241.94   1335.88  341.41   880.83    342.89   199.76  30.76  154.87  38.68  44.88   49.42  
1 1 1 -13 7   4  o 12 151.74  19.88  713.80    168.99   805.94   238.40   620.74    239.59   156.43  27.55  134.11  31.64  22.31   41.95  
1 1 1 -13 7   5  o 11 77.34   21.19  191.34    96.84    183.48   131.82   200.55    142.75   76.41   25.56  79.43   26.60  -3.03   36.89  
1 1 1 -13 7   6  o 14 177.07  22.13  991.25    220.01   1176.47  310.69   804.95    311.60   186.37  30.06  147.59  36.88  38.78   47.58  
1 1 1 -13 7   7  o 10 277.28  35.72  2765.64   555.33   2833.47  785.75   2697.95   784.95   244.68  57.00  235.45  58.37  9.23    81.59  
1 1 1 -13 7   8  o 9  218.90  26.73  1591.83   328.97   1733.78  466.08   1450.92   464.38   212.68  39.63  188.44  43.77  24.24   59.04  
1 1 1 -13 7   9  o 5  220.87  26.93  1638.47   334.41   1606.72  473.07   1670.17   472.79   198.23  42.82  203.76  41.82  -5.53   59.86  
1 1 1 -13 7   10 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -13 7   11 o 19 106.47  26.30  394.34    159.78   0.00     0.00     394.34    159.78   ?       ?      106.47  26.30  0.00    26.30  
1 1 1 -13 8   1  o 7  180.96  22.12  1030.34   225.06   969.58   318.58   1090.88   317.99   165.58  34.63  178.07  32.30  -12.49  47.35  
1 1 1 -13 8   2  o 15 229.76  48.83  2176.11   624.17   2176.11  624.17   0.00      0.00     229.76  48.83  ?       ?      0.00    48.83  
1 1 1 -13 8   3  o 12 130.53  28.90  579.51    210.84   579.51   210.84   0.00      0.00     130.53  28.90  ?       ?      0.00    28.90  
1 1 1 -13 8   4  o 3  57.91   21.26  90.24     92.62    160.23   130.23   18.63     131.74   72.38   25.37  54.65   23.44  17.73   34.54  
1 1 1 -13 8   5  o 3  151.74  19.96  722.47    169.68   763.23   241.43   682.68    238.53   149.25  29.23  139.87  30.56  9.38    42.29  
1 1 1 -13 8   6  o 2  91.98   26.96  289.00    151.52   289.00   151.52   0.00      0.00     91.98   26.96  ?       ?      0.00    26.96  
1 1 1 -13 8   7  o 3  108.43  20.12  376.68    120.63   400.45   166.44   350.38    175.09   107.78  26.97  99.68   28.91  8.09    39.54  
1 1 1 -13 8   8  o 19 246.98  32.34  2192.77   447.49   2313.55  631.12   2070.67   634.60   223.73  50.36  204.32  53.49  19.41   73.46  
1 1 1 -13 8   9  o 9  170.05  21.99  938.80    209.63   1002.25  294.15   873.30    298.83   165.72  32.08  150.94  35.15  14.78   47.59  
1 1 1 -13 8   10 o 13 109.27  19.60  384.85    118.45   360.81   163.86   411.17    171.42   100.71  27.55  107.59  27.62  -6.88   39.01  
1 1 1 -13 9   1  o 10 78.25   22.90  199.68    109.39   190.25   144.12   212.51    168.03   77.24   26.71  81.23   28.79  -3.98   39.27  
1 1 1 -13 9   2  o 1  142.05  29.75  700.35    234.81   700.35   234.81   0.00      0.00     142.05  29.75  ?       ?      0.00    29.75  
1 1 1 -13 9   3  o 10 52.11   22.53  11.01     123.53   11.01    123.53   0.00      0.00     52.11   22.53  ?       ?      0.00    22.53  
1 1 1 -13 9   4  o 15 123.25  28.32  527.77    196.18   527.77   196.18   0.00      0.00     123.25  28.32  ?       ?      0.00    28.32  
1 1 1 -13 9   5  o 9  142.71  20.09  647.40    160.08   586.45   221.13   714.50    232.03   127.91  30.54  142.79  29.29  -14.87  42.31  
1 1 1 -13 9   6  o 8  140.80  19.88  631.05    156.23   651.51   218.58   609.68    223.40   136.13  28.87  130.16  30.44  5.97    41.95  
1 1 1 -13 9   7  o 11 80.27   21.08  212.60    98.36    201.01   132.40   226.89    146.95   77.41   25.61  81.43   26.98  -4.02   37.20  
1 1 1 -13 10  1  o 19 113.63  28.93  454.77    189.19   0.00     0.00     454.77    189.19   ?       ?      113.63  28.93  0.00    28.93  
1 1 1 -13 10  2  o 2  61.25   22.37  107.21    102.35   67.36    138.21   155.60    152.30   60.18   24.79  72.22   27.12  -12.04  36.74  
1 1 1 -13 10  3  o 6  150.61  21.56  731.43    181.11   683.08   247.97   786.71    265.16   136.62  32.16  146.81  32.34  -10.19  45.60  
1 1 1 -12 -11 1  o 4  41.25   18.15  -15.73    83.15    -91.98   143.29   22.97     102.09   48.18   22.23  50.29   21.06  -2.12   30.62  
1 1 1 -12 -11 2  o 19 105.51  19.50  345.51    113.76   293.31   181.72   379.15    145.89   94.70   29.89  108.81  24.00  -14.11  38.34  
1 1 1 -12 -11 3  o 15 135.80  18.77  564.12    142.43   493.19   215.65   618.99    189.68   121.03  30.93  139.51  24.58  -18.47  39.51  
1 1 1 -12 -11 4  o 4  179.33  21.65  994.36    218.36   908.47   313.73   1075.07   304.12   162.72  34.65  180.70  30.40  -17.98  46.09  
1 1 1 -12 -10 1  o 5  153.15  19.50  713.55    167.58   607.87   243.30   808.95    231.16   135.21  31.87  159.91  26.08  -24.70  41.18  
1 1 1 -12 -10 2  o 16 207.30  23.83  1332.25   278.48   1339.33  399.05   1325.53   388.80   198.80  36.30  198.47  35.43  0.34    50.72  
1 1 1 -12 -10 3  o 6  46.34   19.15  23.25     82.83    -43.93   134.86   63.94     104.95   50.38   22.58  56.48   22.17  -6.10   31.64  
1 1 1 -12 -10 4  o 6  184.32  21.64  1045.05   224.66   1065.89  327.41   1026.50   308.84   178.69  33.14  176.33  31.67  2.35    45.84  
1 1 1 -12 -10 5  o 13 168.39  21.00  871.96    198.59   851.30   290.25   890.14    272.30   159.18  32.85  164.90  29.86  -5.73   44.40  
1 1 1 -12 -10 6  o 1  202.95  24.05  1287.44   274.75   1235.16  396.34   1335.80   381.22   187.96  38.04  198.60  34.70  -10.64  51.49  
1 1 1 -12 -10 7  o 1  94.31   21.76  281.39    115.41   189.14   193.85   332.03    143.64   82.11   30.64  101.51  24.85  -19.40  39.45  
1 1 1 -12 -9  1  o 9  162.44  18.88  795.45    172.80   792.38   248.22   798.33    240.70   157.60  28.48  158.78  27.40  -1.18   39.52  
1 1 1 -12 -9  2  o 7  71.84   19.06  159.39    79.88    153.98   112.00   164.98    113.96   71.93   23.54  73.95   23.71  -2.02   33.41  
1 1 1 -12 -9  3  o 4  78.76   19.70  192.60    88.85    216.64   136.40   174.88    117.11   83.47   25.83  75.79   24.01  7.68    35.27  
1 1 1 -12 -9  4  o 12 144.19  18.91  629.87    152.75   520.13   226.45   721.50    206.92   125.50  31.49  151.94  24.56  -26.43  39.93  
1 1 1 -12 -9  5  o 9  183.09  21.75  1026.51   224.12   986.99   323.23   1063.09   311.02   172.24  33.90  180.83  31.08  -8.59   45.99  
1 1 1 -12 -9  6  f 0  52.55   20.35  57.56     87.52    31.72    141.23   73.67     111.52   58.77   24.70  58.96   22.94  -0.19   33.71  
1 1 1 -12 -9  7  o 9  108.70  19.18  364.01    115.31   462.81   173.10   285.18    154.62   120.03  25.88  93.98   27.15  26.06   37.51  
1 1 1 -12 -9  8  o 1  78.62   21.50  194.56    99.83    174.08   160.61   207.45    127.44   77.88   28.08  81.16   24.94  -3.28   37.56  
1 1 1 -12 -9  9  f 0  184.85  22.71  1061.55   235.91   1045.11  342.09   1076.46   325.75   174.56  35.35  179.17  32.88  -4.62   48.28  
1 1 1 -12 -8  1  o 1  198.43  22.17  1196.26   248.25   1162.10  353.61   1229.46   348.60   189.02  33.83  195.60  32.16  -6.58   46.68  
1 1 1 -12 -8  2  o 18 109.91  16.07  362.33    98.39    357.60   144.21   366.46    134.59   106.71  24.11  108.60  22.33  -1.89   32.87  
1 1 1 -12 -8  3  o 18 42.31   18.25  -4.26     80.73    0.00     0.00     -4.26     80.73    ?       ?      42.31   18.25  0.00    18.25  
1 1 1 -12 -8  4  o 15 241.68  43.31  2025.07   578.86   0.00     0.00     2025.07   578.86   ?       ?      241.68  43.31  0.00    43.31  
1 1 1 -12 -8  5  o 5  188.17  33.04  1154.42   343.92   0.00     0.00     1154.42   343.92   ?       ?      188.17  33.04  0.00    33.04  
1 1 1 -12 -8  6  o 18 225.25  40.14  1736.61   500.06   0.00     0.00     1736.61   500.06   ?       ?      225.25  40.14  0.00    40.14  
1 1 1 -12 -8  7  o 12 126.58  26.04  509.93    182.91   0.00     0.00     509.93    182.91   ?       ?      126.58  26.04  0.00    26.04  
1 1 1 -12 -8  8  o 19 171.30  30.43  954.25    288.30   0.00     0.00     954.25    288.30   ?       ?      171.30  30.43  0.00    30.43  
1 1 1 -12 -8  9  o 6  98.27   24.87  309.90    140.39   0.00     0.00     309.90    140.39   ?       ?      98.27   24.87  0.00    24.87  
1 1 1 -12 -8  10 o 18 78.04   25.40  188.13    130.47   0.00     0.00     188.13    130.47   ?       ?      78.04   25.40  0.00    25.40  
1 1 1 -12 -8  11 o 2  65.49   23.97  114.80    117.60   0.00     0.00     114.80    117.60   ?       ?      65.49   23.97  0.00    23.97  
1 1 1 -12 -7  1  o 17 49.70   19.46  46.07     80.67    0.00     0.00     46.07     80.67    ?       ?      49.70   19.46  0.00    19.46  
1 1 1 -12 -7  2  o 7  126.45  23.29  494.31    162.85   0.00     0.00     494.31    162.85   ?       ?      126.45  23.29  0.00    23.29  
1 1 1 -12 -7  3  o 1  119.22  22.68  439.45    149.56   0.00     0.00     439.45    149.56   ?       ?      119.22  22.68  0.00    22.68  
1 1 1 -12 -7  4  o 4  265.99  48.20  2504.23   708.93   0.00     0.00     2504.23   708.93   ?       ?      265.99  48.20  0.00    48.20  
1 1 1 -12 -7  5  o 5  154.88  19.12  722.28    166.38   657.59   239.24   782.88    231.56   143.04  30.09  158.20  26.43  -15.16  40.05  
1 1 1 -12 -7  6  o 7  117.11  18.07  414.93    117.57   296.53   172.41   517.86    160.74   96.63   28.87  129.51  22.43  -32.88  36.56  
1 1 1 -12 -7  7  o 10 243.04  44.04  2066.13   591.84   2066.13  591.84   0.00      0.00     243.04  44.04  ?       ?      0.00    44.04  
1 1 1 -12 -7  8  f 0  188.40  21.86  1083.63   232.03   1066.50  333.27   1099.74   323.24   180.09  33.47  184.08  31.73  -3.99   46.12  
1 1 1 -12 -7  9  o 2  95.25   18.60  279.10    98.04    310.65   148.12   254.50    130.78   98.50   25.87  89.57   24.66  8.93    35.74  
1 1 1 -12 -7  10 o 8  44.10   18.63  10.06     81.07    8.54     130.36   11.02     103.52   54.40   23.33  49.31   20.96  5.08    31.36  
1 1 1 -12 -7  11 o 16 64.83   20.66  126.66    86.60    123.68   137.33   128.62    111.59   69.01   25.78  67.16   23.49  1.85    34.88  
1 1 1 -12 -7  12 o 15 60.05   23.37  79.01     115.83   0.00     0.00     79.01     115.83   ?       ?      60.05   23.37  0.00    23.37  
1 1 1 -12 -6  1  o 11 193.87  21.31  1128.76   233.22   1113.81  332.41   1143.25   327.31   187.62  32.01  190.68  30.96  -3.06   44.54  
1 1 1 -12 -6  2  o 16 401.37  48.47  5525.92   1094.30  5457.04  1548.61  5594.61   1546.56  356.27  77.90  363.10  76.61  -6.83   109.25 
1 1 1 -12 -6  3  o 2  75.96   18.95  177.05    82.34    163.80   111.08   193.20    122.66   74.07   23.37  79.75   24.46  -5.69   33.83  
1 1 1 -12 -6  4  o 4  228.76  25.67  1603.52   331.33   1716.09  479.62   1500.76   458.25   228.84  37.83  212.97  38.92  15.87   54.27  
1 1 1 -12 -6  5  o 5  181.04  31.18  1044.13   312.36   0.00     0.00     1044.13   312.36   ?       ?      181.04  31.18  0.00    31.18  
1 1 1 -12 -6  6  o 7  116.95  26.36  432.57    172.76   432.57   172.76   0.00      0.00     116.95  26.36  ?       ?      0.00    26.36  
1 1 1 -12 -6  7  o 11 125.68  26.38  499.29    184.23   499.29   184.23   0.00      0.00     125.68  26.38  ?       ?      0.00    26.38  
1 1 1 -12 -6  8  o 6  80.79   25.28  200.31    130.21   200.31   130.21   0.00      0.00     80.79   25.28  ?       ?      0.00    25.28  
1 1 1 -12 -6  9  o 6  149.70  28.63  717.68    237.10   717.68   237.10   0.00      0.00     149.70  28.63  ?       ?      0.00    28.63  
1 1 1 -12 -6  10 o 18 106.53  26.19  363.91    159.01   363.91   159.01   0.00      0.00     106.53  26.19  ?       ?      0.00    26.19  
1 1 1 -12 -6  11 o 7  52.56   22.80  -4.11     127.37   -4.11    127.37   0.00      0.00     52.56   22.80  ?       ?      0.00    22.80  
1 1 1 -12 -6  12 o 16 71.95   25.60  147.40    133.05   147.40   133.05   0.00      0.00     71.95   25.60  ?       ?      0.00    25.60  
1 1 1 -12 -6  13 o 12 75.24   25.80  170.35    134.35   170.35   134.35   0.00      0.00     75.24   25.80  ?       ?      0.00    25.80  
1 1 1 -12 -6  14 o 14 130.21  28.16  559.80    204.36   559.80   204.36   0.00      0.00     130.21  28.16  ?       ?      0.00    28.16  
1 1 1 -12 -5  1  o 6  79.99   16.39  193.65    72.73    171.18   108.88   211.74    97.73    75.52   23.03  83.07   20.60  -7.55   30.89  
1 1 1 -12 -5  2  x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -12 -5  3  o 14 203.10  34.65  1315.65   389.48   1315.65  389.48   0.00      0.00     203.10  34.65  ?       ?      0.00    34.65  
1 1 1 -12 -5  4  o 11 134.41  30.12  574.19    226.61   574.19   226.61   0.00      0.00     134.41  30.12  ?       ?      0.00    30.12  
1 1 1 -12 -5  5  o 17 345.19  72.24  4925.23   1385.46  4925.23  1385.46  0.00      0.00     345.19  72.24  ?       ?      0.00    72.24  
1 1 1 -12 -5  6  o 11 98.52   30.29  304.76    187.94   304.76   187.94   0.00      0.00     98.52   30.29  ?       ?      0.00    30.29  
1 1 1 -12 -5  7  o 12 69.57   28.12  81.42     173.79   81.42    173.79   0.00      0.00     69.57   28.12  ?       ?      0.00    28.12  
1 1 1 -12 -5  8  o 14 211.83  36.33  1477.45   425.93   0.00     0.00     1477.45   425.93   ?       ?      211.83  36.33  0.00    36.33  
1 1 1 -12 -5  9  o 12 94.63   18.09  273.67    94.71    229.87   144.02   307.03    125.72   86.00   26.53  99.06   22.61  -13.06  34.86  
1 1 1 -12 -5  10 o 9  60.63   19.97  106.56    80.54    146.31   122.26   76.07     107.06   71.42   24.61  58.81   22.58  12.61   33.40  
1 1 1 -12 -5  11 o 9  282.68  32.50  2593.97   517.80   2630.30  734.62   2558.10   729.96   265.27  50.08  260.93  50.56  4.34    71.16  
1 1 1 -12 -5  12 o 16 106.27  17.01  343.24    100.28   371.85   150.85   320.58    134.24   107.81  24.88  100.39  23.68  7.42    34.35  
1 1 1 -12 -5  13 o 6  101.77  17.43  317.24    98.19    323.58   146.79   312.09    132.10   99.96   25.50  98.76   23.62  1.21    34.76  
1 1 1 -12 -5  14 o 4  139.87  18.02  596.79    141.33   686.41   205.54   516.41    194.65   146.23  25.41  125.12  27.82  21.10   37.68  
1 1 1 -12 -5  15 o 17 53.36   20.19  67.57     84.74    20.12    129.42   103.18    112.11   54.93   23.39  62.81   23.33  -7.88   33.04  
1 1 1 -12 -4  1  o 5  164.28  27.73  831.88    252.23   831.88   252.23   0.00      0.00     164.28  27.73  ?       ?      0.00    27.73  
1 1 1 -12 -4  2  o 19 261.95  44.03  2258.72   638.71   2258.72  638.71   0.00      0.00     261.95  44.03  ?       ?      0.00    44.03  
1 1 1 -12 -4  3  f 0  177.81  30.49  987.03    300.06   987.03   300.06   0.00      0.00     177.81  30.49  ?       ?      0.00    30.49  
1 1 1 -12 -4  4  o 18 248.10  27.09  1877.85   379.63   1883.68  538.92   1872.10   534.85   240.25  40.51  239.64  40.31  0.61    57.15  
1 1 1 -12 -4  5  o 3  89.11   18.23  241.64    90.09    365.35   135.80   144.42    120.39   108.93  22.46  71.63   24.43  37.30   33.19  
1 1 1 -12 -4  6  o 8  51.02   19.30  57.03     77.50    17.86    113.64   91.08     105.98   52.74   22.16  61.35   22.70  -8.61   31.72  
1 1 1 -12 -4  7  o 9  79.40   19.75  194.16    89.65    124.04   153.52   230.45    110.44   72.01   27.19  86.18   22.19  -14.17  35.09  
1 1 1 -12 -4  8  o 16 110.56  19.42  372.59    118.74   481.12   200.47   313.94    147.36   122.57  28.96  99.74   25.61  22.83   38.65  
1 1 1 -12 -4  9  o 16 197.54  22.71  1189.64   252.85   1329.99  373.10   1070.43   343.86   202.75  33.20  180.76  34.39  21.99   47.81  
1 1 1 -12 -4  10 o 3  118.47  24.38  441.04    160.25   0.00     0.00     441.04    160.25   ?       ?      118.47  24.38  0.00    24.38  
1 1 1 -12 -4  11 o 19 255.57  47.39  2370.65   669.73   0.00     0.00     2370.65   669.73   ?       ?      255.57  47.39  0.00    47.39  
1 1 1 -12 -4  12 o 6  61.27   19.94  110.39    80.42    144.35   133.11   90.87     100.92   71.83   25.60  60.03   22.16  11.79   33.87  
1 1 1 -12 -4  13 o 16 181.47  21.08  1010.63   215.56   968.43   308.41   1050.94   301.40   170.29  32.74  179.26  30.37  -8.97   44.66  
1 1 1 -12 -4  14 o 14 132.00  17.62  530.22    130.17   531.04   190.81   529.51    178.03   127.65  26.89  128.43  25.05  -0.78   36.75  
1 1 1 -12 -4  15 o 1  251.93  29.63  2088.67   420.31   2099.88  596.10   2077.59   592.74   233.02  46.19  231.78  46.17  1.24    65.31  
1 1 1 -12 -3  1  o 12 255.03  42.24  2107.91   596.76   2107.91  596.76   0.00      0.00     255.03  42.24  ?       ?      0.00    42.24  
1 1 1 -12 -3  2  o 19 136.62  16.88  553.13    129.59   576.70   181.16   528.42    185.47   137.55  23.80  130.99  25.58  6.56    34.94  
1 1 1 -12 -3  3  o 19 158.14  18.83  743.84    167.62   788.49   244.36   704.17    230.36   159.88  27.62  150.90  27.61  8.98    39.05  
1 1 1 -12 -3  4  o 15 275.28  29.67  2325.54   461.53   2490.63  655.05   2162.79   650.40   276.03  42.72  254.31  46.25  21.72   62.96  
1 1 1 -12 -3  5  o 17 333.97  37.32  3547.60   703.34   3606.75  997.09   3489.01   992.27   318.05  56.69  311.79  57.56  6.26    80.79  
1 1 1 -12 -3  6  o 6  144.99  17.59  625.84    143.39   756.03   208.67   509.36    197.37   157.41  23.84  127.35  27.78  30.07   36.61  
1 1 1 -12 -3  7  o 7  167.30  19.67  838.91    185.31   758.85   264.08   916.56    260.09   154.46  30.86  171.83  27.28  -17.37  41.19  
1 1 1 -12 -3  8  o 14 214.64  36.39  1502.59   432.41   0.00     0.00     1502.59   432.41   ?       ?      214.64  36.39  0.00    36.39  
1 1 1 -12 -3  9  o 10 100.01  17.79  303.82    98.42    177.70   148.59   402.40    131.37   78.55   27.13  114.51  20.75  -35.96  34.15  
1 1 1 -12 -3  10 o 17 236.86  26.29  1739.79   351.51   1787.07  499.67   1693.47   494.58   230.35  39.19  223.42  40.03  6.93    56.02  
1 1 1 -12 -3  11 o 5  94.52   19.98  276.65    105.00   329.05   186.81   252.45    126.96   100.97  30.02  89.43   24.16  11.54   38.54  
1 1 1 -12 -3  12 o 3  92.32   19.63  264.39    100.83   280.14   175.45   256.62    123.21   93.67   29.35  90.03   23.57  3.64    37.64  
1 1 1 -12 -3  13 o 15 58.08   20.60  91.35     86.02    121.51   165.39   80.17     100.71   71.99   27.95  58.21   22.01  13.78   35.58  
1 1 1 -12 -3  14 o 15 60.40   20.49  105.27    84.66    54.32    173.42   121.21    97.00    65.59   27.45  64.50   21.93  1.08    35.14  
1 1 1 -12 -3  15 o 7  203.68  23.32  1302.90   267.82   1416.08  388.15   1200.06   370.01   202.78  34.58  184.95  36.15  17.83   50.03  
1 1 1 -12 -3  16 o 16 132.92  17.79  541.73    132.31   602.20   195.25   490.38    179.91   135.71  26.01  121.89  26.47  13.82   37.11  
1 1 1 -12 -2  1  o 4  377.49  42.35  4568.21   901.91   4626.17  1276.43  4510.41   1274.56  357.00  64.66  351.35  65.60  5.65    92.12  
1 1 1 -12 -2  2  o 1  265.93  28.84  2154.02   433.29   2120.90  612.53   2187.19   612.98   255.12  43.37  259.69  42.59  -4.56   60.79  
1 1 1 -12 -2  3  o 6  363.90  41.09  4239.35   843.45   4113.23  1192.61  4365.56   1193.02  335.18  64.32  348.23  61.95  -13.05  89.30  
1 1 1 -12 -2  4  o 12 161.62  18.61  776.04    169.52   784.84   238.64   767.07    240.87   159.72  26.99  157.63  27.63  2.10    38.62  
1 1 1 -12 -2  5  o 12 72.79   19.79  161.30    84.86    233.21   133.00   111.94    110.20   87.19   25.17  65.43   23.30  21.75   34.30  
1 1 1 -12 -2  6  o 13 103.86  17.64  324.76    101.44   334.32   155.18   317.63    134.04   103.44  26.13  101.27  23.51  2.17    35.15  
1 1 1 -12 -2  7  o 10 207.67  22.95  1302.18   269.08   1329.27  384.98   1276.30   376.25   204.15  34.05  200.00  33.99  4.15    48.11  
1 1 1 -12 -2  8  o 12 146.92  18.40  646.31    151.83   671.90   223.34   624.32    207.02   146.35  27.60  141.40  26.48  4.95    38.24  
1 1 1 -12 -2  9  o 4  164.24  19.51  811.31    180.36   827.17   262.30   797.08    248.40   161.48  29.38  159.00  28.25  2.48    40.76  
1 1 1 -12 -2  10 o 18 311.79  35.99  3177.56   632.40   3168.23  895.66   3186.83   893.04   288.18  56.16  289.59  55.74  -1.41   79.13  
1 1 1 -12 -2  11 f 0  366.04  45.43  4723.43   934.14   4746.51  1322.42  4700.45   1319.74  322.57  73.11  320.50  73.32  2.08    103.54 
1 1 1 -12 -2  12 o 12 206.23  36.11  1427.97   411.90   0.00     0.00     1427.97   411.90   ?       ?      206.23  36.11  0.00    36.11  
1 1 1 -12 -2  13 f 0  77.20   19.23  185.73    84.92    139.10   131.75   218.87    111.06   70.80   25.45  83.25   22.64  -12.45  34.06  
1 1 1 -12 -2  14 f 0  192.97  34.27  1260.41   365.74   0.00     0.00     1260.41   365.74   ?       ?      192.97  34.27  0.00    34.27  
1 1 1 -12 -2  15 o 7  128.74  25.10  534.43    178.83   0.00     0.00     534.43    178.83   ?       ?      128.74  25.10  0.00    25.10  
1 1 1 -12 -2  16 o 3  110.19  22.84  390.30    139.75   0.00     0.00     390.30    139.75   ?       ?      110.19  22.84  0.00    22.84  
1 1 1 -12 -2  17 o 13 129.22  25.34  547.87    181.26   0.00     0.00     547.87    181.26   ?       ?      129.22  25.34  0.00    25.34  
1 1 1 -12 -1  1  o 8  212.61  22.93  1351.73   275.40   1331.05  390.15   1372.26   388.81   206.16  34.16  209.75  33.41  -3.59   47.78  
1 1 1 -12 -1  2  o 5  201.17  33.61  1267.37   374.44   1267.37  374.44   0.00      0.00     201.17  33.61  ?       ?      0.00    33.61  
1 1 1 -12 -1  3  o 16 539.85  72.46  11122.36  2188.91  11278.76 3096.24  10966.08  3094.93  451.39  118.14 440.57  119.41 10.82   167.97 
1 1 1 -12 -1  4  o 13 232.51  25.13  1631.06   330.05   1668.89  467.20   1593.37   466.34   229.23  36.74  223.33  37.72  5.90    52.66  
1 1 1 -12 -1  5  o 17 160.33  18.59  764.33    167.95   721.86   236.70   807.39    238.33   152.52  28.07  162.11  26.53  -9.59   38.62  
1 1 1 -12 -1  6  o 8  326.09  36.34  3368.09   668.69   3362.83  946.25   3373.34   945.10   307.96  55.57  308.65  55.37  -0.69   78.45  
1 1 1 -12 -1  7  o 3  287.64  31.44  2577.09   510.72   2658.93  722.53   2495.37   722.01   279.99  46.59  269.44  48.46  10.55   67.22  
1 1 1 -12 -1  8  o 18 287.18  31.78  2587.91   515.15   2603.03  728.93   2572.83   728.13   274.05  48.09  272.15  48.38  1.90    68.21  
1 1 1 -12 -1  9  o 19 260.31  28.86  2111.03   424.08   2111.55  601.51   2110.51   597.99   248.54  43.76  248.74  43.46  -0.20   61.67  
1 1 1 -12 -1  10 o 16 89.29   18.83  245.12    93.48    188.77   144.81   285.38    122.41   79.79   26.79  95.50   22.67  -15.71  35.10  
1 1 1 -12 -1  11 o 14 285.95  56.40  3180.07   892.88   0.00     0.00     3180.07   892.88   ?       ?      285.95  56.40  0.00    56.40  
1 1 1 -12 -1  12 o 17 205.19  35.84  1411.39   406.85   0.00     0.00     1411.39   406.85   ?       ?      205.19  35.84  0.00    35.84  
1 1 1 -12 -1  13 o 15 147.33  26.55  693.57    216.31   0.00     0.00     693.57    216.31   ?       ?      147.33  26.55  0.00    26.55  
1 1 1 -12 -1  14 o 5  201.78  36.14  1398.61   403.26   0.00     0.00     1398.61   403.26   ?       ?      201.78  36.14  0.00    36.14  
1 1 1 -12 -1  15 o 11 118.74  23.79  451.46    156.50   0.00     0.00     451.46    156.50   ?       ?      118.74  23.79  0.00    23.79  
1 1 1 -12 -1  16 o 4  195.65  22.56  1204.85   248.74   1255.58  357.24   1157.11   346.56   189.92  34.02  181.73  34.48  8.19    48.43  
1 1 1 -12 -1  17 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -12 0   1  o 8  276.72  29.91  2336.79   467.66   2342.98  663.26   2330.68   659.48   267.88  44.70  267.27  44.55  0.61    63.11  
1 1 1 -12 0   2  o 19 406.52  46.62  5412.62   1068.29  5506.35  1512.32  5319.27   1509.27  380.36  71.89  371.84  73.31  8.52    102.68 
1 1 1 -12 0   3  o 4  325.62  35.60  3314.92   654.62   3504.23  928.09   3127.50   923.48   320.86  52.18  299.58  55.75  21.28   76.36  
1 1 1 -12 0   4  o 1  194.69  33.03  1190.18   356.03   1190.18  356.03   0.00      0.00     194.69  33.03  ?       ?      0.00    33.03  
1 1 1 -12 0   5  o 11 352.91  39.44  3984.45   785.45   4149.21  1112.32  3820.59   1109.28  340.15  59.11  322.81  62.11  17.34   85.74  
1 1 1 -12 0   6  o 17 127.42  23.86  498.93    168.14   0.00     0.00     498.93    168.14   ?       ?      127.42  23.86  0.00    23.86  
1 1 1 -12 0   7  o 8  155.35  18.57  720.25    162.29   642.66   233.67   792.56    225.59   142.69  29.50  160.61  25.30  -17.93  38.87  
1 1 1 -12 0   8  o 9  84.34   18.19  217.39    85.48    245.87   132.41   197.04    111.92   88.93   24.94  80.09   23.08  8.84    33.98  
1 1 1 -12 0   9  o 15 147.15  26.38  677.08    214.64   0.00     0.00     677.08    214.64   ?       ?      147.15  26.38  0.00    26.38  
1 1 1 -12 0   10 o 3  120.97  24.14  457.83    161.75   0.00     0.00     457.83    161.75   ?       ?      120.97  24.14  0.00    24.14  
1 1 1 -12 0   11 o 1  120.39  24.02  455.37    160.20   0.00     0.00     455.37    160.20   ?       ?      120.39  24.02  0.00    24.02  
1 1 1 -12 0   12 o 13 182.03  31.56  1082.67   317.86   0.00     0.00     1082.67   317.86   ?       ?      182.03  31.56  0.00    31.56  
1 1 1 -12 0   13 o 4  94.66   16.98  273.90    88.87    255.16   127.29   291.71    124.13   89.41   24.21  95.87   22.88  -6.46   33.31  
1 1 1 -12 0   14 o 13 325.29  40.23  3742.72   735.26   3899.11  1041.65  3587.43   1037.98  293.93  63.59  275.94  66.35  17.99   91.90  
1 1 1 -12 0   15 o 14 100.86  17.52  313.29    97.74    292.23   148.08   329.55    130.12   94.37   26.34  101.39  22.90  -7.01   34.90  
1 1 1 -12 0   16 o 1  66.20   19.36  137.08    78.19    159.54   124.11   122.30    100.68   72.31   24.80  64.50   22.33  7.81    33.37  
1 1 1 -12 0   17 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -12 0   18 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -12 1   1  o 18 290.70  31.51  2596.18   517.52   2601.92  733.12   2590.47   730.64   280.28  47.24  279.70  47.18  0.58    66.77  
1 1 1 -12 1   2  o 14 315.91  34.49  3104.95   615.37   3230.10  872.02   2980.79   868.53   309.16  50.90  294.69  53.30  14.47   73.70  
1 1 1 -12 1   3  o 16 241.64  26.20  1767.50   357.57   1749.74  508.58   1784.86   502.82   233.22  39.39  236.20  38.40  -2.98   55.01  
1 1 1 -12 1   4  o 4  100.07  16.84  300.40    93.32    357.17   142.46   257.73    123.52   107.59  23.71  91.39   23.43  16.21   33.33  
1 1 1 -12 1   5  o 9  172.18  19.48  883.52    189.17   857.64   274.41   906.96    261.13   165.65  29.96  171.52  27.45  -5.87   40.63  
1 1 1 -12 1   6  o 11 159.44  18.41  756.92    165.40   762.29   242.30   752.24    226.33   156.53  27.99  156.20  26.16  0.33    38.32  
1 1 1 -12 1   7  x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -12 1   8  o 3  162.05  27.95  821.97    250.64   0.00     0.00     821.97    250.64   ?       ?      162.05  27.95  0.00    27.95  
1 1 1 -12 1   9  o 4  212.42  36.06  1477.84   424.03   0.00     0.00     1477.84   424.03   ?       ?      212.42  36.06  0.00    36.06  
1 1 1 -12 1   10 o 3  224.24  39.01  1694.98   483.99   0.00     0.00     1694.98   483.99   ?       ?      224.24  39.01  0.00    39.01  
1 1 1 -12 1   11 o 17 133.90  17.80  541.23    133.43   517.09   196.72   561.80    181.59   126.72  27.81  133.70  24.56  -6.98   37.10  
1 1 1 -12 1   12 o 1  219.74  24.48  1501.11   303.61   1539.90  430.22   1462.61   428.52   213.34  36.44  206.95  37.45  6.39    52.25  
1 1 1 -12 1   13 o 10 189.68  21.66  1108.10   231.63   1068.54  328.74   1147.11   326.43   178.46  33.31  186.31  31.65  -7.85   45.95  
1 1 1 -12 1   14 o 5  187.24  33.61  1189.53   347.96   1189.53  347.96   0.00      0.00     187.24  33.61  ?       ?      0.00    33.61  
1 1 1 -12 1   15 o 17 150.40  28.33  747.51    235.60   747.51   235.60   0.00      0.00     150.40  28.33  ?       ?      0.00    28.33  
1 1 1 -12 1   16 o 14 178.28  33.30  1108.59   328.29   1108.59  328.29   0.00      0.00     178.28  33.30  ?       ?      0.00    33.30  
1 1 1 -12 1   17 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -12 1   18 o 14 90.74   17.23  258.18    86.46    243.83   127.75   270.31    117.45   85.36   24.68  90.53   22.66  -5.18   33.50  
1 1 1 -12 2   1  o 14 113.62  23.13  395.86    145.75   0.00     0.00     395.86    145.75   ?       ?      113.62  23.13  0.00    23.13  
1 1 1 -12 2   2  o 15 330.54  36.77  3442.44   685.93   3277.62  971.13   3606.55   968.99   304.00  57.76  322.79  54.21  -18.79  79.22  
1 1 1 -12 2   3  o 3  267.37  29.04  2188.49   438.53   2182.61  621.76   2194.31   618.61   257.54  43.61  258.54  43.20  -1.00   61.39  
1 1 1 -12 2   4  o 18 250.30  27.13  1908.36   383.56   1946.54  544.77   1870.82   540.14   244.93  40.13  239.64  40.72  5.29    57.17  
1 1 1 -12 2   5  o 10 78.60   17.93  188.40    79.12    212.43   120.80   170.34    104.70   83.26   23.98  75.13   22.51  8.13    32.89  
1 1 1 -12 2   6  o 19 153.98  18.08  706.37    156.80   711.58   225.71   701.52    217.98   151.36  26.96  150.58  26.17  0.78    37.57  
1 1 1 -12 2   7  o 8  193.46  31.94  1186.95   342.38   0.00     0.00     1186.95   342.38   ?       ?      193.46  31.94  0.00    31.94  
1 1 1 -12 2   8  o 13 123.15  22.51  467.30    153.30   0.00     0.00     467.30    153.30   ?       ?      123.15  22.51  0.00    22.51  
1 1 1 -12 2   9  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -12 2   10 o 15 148.71  18.25  666.11    152.54   637.22   220.47   692.65    211.28   141.07  28.21  148.45  25.72  -7.38   38.18  
1 1 1 -12 2   11 o 8  230.13  25.94  1655.89   336.74   1589.47  476.48   1722.16   475.96   213.87  40.29  224.66  38.27  -10.79  55.57  
1 1 1 -12 2   12 o 17 115.95  16.42  406.14    106.23   380.48   150.53   431.59    149.95   109.10  24.62  116.98  23.15  -7.88   33.80  
1 1 1 -12 2   13 o 7  90.75   23.71  263.88    124.87   263.88   124.87   0.00      0.00     90.75   23.71  ?       ?      0.00    23.71  
1 1 1 -12 2   14 o 14 129.39  25.04  539.40    179.30   539.40   179.30   0.00      0.00     129.39  25.04  ?       ?      0.00    25.04  
1 1 1 -12 2   15 o 5  101.34  23.67  333.21    135.20   333.21   135.20   0.00      0.00     101.34  23.67  ?       ?      0.00    23.67  
1 1 1 -12 2   16 o 10 48.82   20.52  22.81     97.43    22.81    97.43    0.00      0.00     48.82   20.52  ?       ?      0.00    20.52  
1 1 1 -12 2   17 o 7  137.62  26.57  636.82    202.28   0.00     0.00     636.82    202.28   ?       ?      137.62  26.57  0.00    26.57  
1 1 1 -12 2   18 o 4  128.44  17.68  514.17    126.89   449.92   182.76   573.98    176.32   113.46  28.18  131.58  24.24  -18.12  37.17  
1 1 1 -12 3   1  o 11 230.50  25.08  1605.64   326.55   1672.88  464.53   1539.95   459.14   229.26  36.52  218.99  37.89  10.27   52.63  
1 1 1 -12 3   2  o 9  182.72  20.53  997.32    211.61   972.94   303.92   1020.25   294.81   176.17  31.19  181.35  29.32  -5.17   42.81  
1 1 1 -12 3   3  o 15 319.85  35.57  3227.57   642.09   3185.58  909.34   3269.32   906.77   300.59  54.71  305.69  53.63  -5.10   76.61  
1 1 1 -12 3   4  o 5  124.94  17.04  465.44    119.04   551.36   178.88   397.14    159.49   133.94  24.15  112.96  25.23  20.98   34.93  
1 1 1 -12 3   5  o 8  363.72  41.95  4346.09   859.88   4420.34  1217.50  4272.19   1214.60  339.60  64.82  332.09  66.04  7.50    92.53  
1 1 1 -12 3   6  o 1  181.41  30.24  1036.13   303.88   0.00     0.00     1036.13   303.88   ?       ?      181.41  30.24  0.00    30.24  
1 1 1 -12 3   7  f 0  207.42  34.76  1391.25   399.26   0.00     0.00     1391.25   399.26   ?       ?      207.42  34.76  0.00    34.76  
1 1 1 -12 3   8  o 16 203.85  34.45  1351.73   388.83   0.00     0.00     1351.73   388.83   ?       ?      203.85  34.45  0.00    34.45  
1 1 1 -12 3   9  o 19 270.34  30.24  2317.69   461.25   2463.45  654.77   2174.10   649.87   265.14  44.60  245.49  47.83  19.65   65.40  
1 1 1 -12 3   10 o 14 201.98  22.39  1250.52   255.30   1295.12  363.98   1207.33   358.19   198.59  33.09  191.04  33.90  7.56    47.37  
1 1 1 -12 3   11 o 16 309.48  36.88  3237.77   642.31   3243.43  909.62   3232.14   907.10   280.43  58.40  280.05  58.32  0.38    82.54  
1 1 1 -12 3   12 o 18 108.03  23.66  372.08    142.69   372.08   142.69   0.00      0.00     108.03  23.66  ?       ?      0.00    23.66  
1 1 1 -12 3   13 f 0  111.76  23.84  400.42    148.29   400.42   148.29   0.00      0.00     111.76  23.84  ?       ?      0.00    23.84  
1 1 1 -12 3   14 o 9  70.71   22.92  154.32    106.29   154.32   106.29   0.00      0.00     70.71   22.92  ?       ?      0.00    22.92  
1 1 1 -12 3   15 f 0  65.09   18.42  132.66    71.92    215.55   105.11   59.68     98.63    81.78   21.94  54.14   21.42  27.64   30.66  
1 1 1 -12 3   16 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -12 3   17 o 15 149.89  27.77  768.17    230.13   0.00     0.00     768.17    230.13   ?       ?      149.89  27.77  0.00    27.77  
1 1 1 -12 3   18 o 3  148.68  19.05  697.37    158.87   587.04   228.93   799.85    220.64   126.58  31.60  153.91  25.89  -27.33  40.85  
1 1 1 -12 4   1  o 12 238.98  26.09  1737.12   352.12   1718.49  500.81   1755.35   495.19   229.92  39.36  233.09  38.34  -3.17   54.95  
1 1 1 -12 4   2  f 0  339.13  38.28  3689.74   732.26   3651.43  1036.57  3727.90   1034.58  315.82  59.35  320.25  58.43  -4.42   83.29  
1 1 1 -12 4   3  o 17 163.62  18.93  799.07    174.52   837.74   251.20   762.99    242.65   164.25  27.62  156.41  28.06  7.84    39.37  
1 1 1 -12 4   4  o 18 119.00  16.86  423.29    111.95   434.67   167.49   414.10    150.52   117.99  25.47  115.71  23.46  2.28    34.63  
1 1 1 -12 4   5  o 5  180.01  20.36  973.38    206.75   996.16   296.65   951.86    288.30   177.69  30.16  173.69  30.00  4.00    42.54  
1 1 1 -12 4   6  o 19 204.62  34.35  1353.28   389.24   0.00     0.00     1353.28   389.24   ?       ?      204.62  34.35  0.00    34.35  
1 1 1 -12 4   7  o 15 142.29  25.44  632.40    200.14   0.00     0.00     632.40    200.14   ?       ?      142.29  25.44  0.00    25.44  
1 1 1 -12 4   8  f 0  102.43  22.61  328.33    129.36   0.00     0.00     328.33    129.36   ?       ?      102.43  22.61  0.00    22.61  
1 1 1 -12 4   9  o 16 204.82  36.35  1408.86   411.76   1408.86  411.76   0.00      0.00     204.82  36.35  ?       ?      0.00    36.35  
1 1 1 -12 4   10 o 1  92.83   15.50  260.91    79.70    251.31   109.53   271.72    116.18   89.33   21.60  92.78   22.13  -3.45   30.92  
1 1 1 -12 4   11 o 12 173.13  30.35  984.40    290.61   984.40   290.61   0.00      0.00     173.13  30.35  ?       ?      0.00    30.35  
1 1 1 -12 4   12 o 10 85.22   23.17  232.31    116.32   232.31   116.32   0.00      0.00     85.22   23.17  ?       ?      0.00    23.17  
1 1 1 -12 4   13 o 2  210.46  39.30  1600.20   457.35   1600.20  457.35   0.00      0.00     210.46  39.30  ?       ?      0.00    39.30  
1 1 1 -12 4   14 o 12 131.56  17.09  529.01    126.04   532.51   178.45   525.53    178.04   127.72  25.23  126.79  25.35  0.93    35.77  
1 1 1 -12 4   15 o 16 209.77  41.93  1702.81   487.27   1702.81  487.27   0.00      0.00     209.77  41.93  ?       ?      0.00    41.93  
1 1 1 -12 4   16 o 16 126.32  25.64  535.02    179.54   0.00     0.00     535.02    179.54   ?       ?      126.32  25.64  0.00    25.64  
1 1 1 -12 4   17 o 15 152.53  19.18  734.29    164.23   667.18   233.54   799.93    230.98   136.24  30.61  152.65  27.36  -16.41  41.06  
1 1 1 -12 5   1  o 13 191.50  21.67  1104.33   234.07   1151.48  331.72   1057.58   330.32   191.01  31.34  182.13  32.80  8.87    45.36  
1 1 1 -12 5   2  o 10 144.57  18.20  625.04    147.69   684.39   209.61   566.53    208.13   148.73  25.47  134.09  27.95  14.64   37.81  
1 1 1 -12 5   3  o 11 54.31   19.48  75.44     77.18    75.50    119.62   75.40     101.02   61.06   23.75  58.09   22.02  2.97    32.39  
1 1 1 -12 5   4  o 17 269.27  29.89  2267.20   454.20   2233.35  643.70   2300.76   640.97   254.15  45.80  259.04  44.72  -4.89   64.01  
1 1 1 -12 5   5  o 13 62.87   19.25  118.15    76.01    112.62   117.52   122.13    99.65    65.97   23.99  65.58   22.23  0.38    32.70  
1 1 1 -12 5   6  o 1  90.09   17.67  247.88    88.12    248.34   134.47   247.54    116.65   88.90   25.20  88.92   22.76  -0.02   33.96  
1 1 1 -12 5   7  o 12 253.98  46.44  2309.39   652.10   0.00     0.00     2309.39   652.10   ?       ?      253.98  46.44  0.00    46.44  
1 1 1 -12 5   8  o 11 119.83  23.81  452.21    158.05   0.00     0.00     452.21    158.05   ?       ?      119.83  23.81  0.00    23.81  
1 1 1 -12 5   9  f 0  343.27  43.15  4196.82   831.51   4151.11  1176.84  4242.39   1175.03  296.56  70.22  301.96  69.26  -5.40   98.63  
1 1 1 -12 5   10 o 15 80.04   22.46  202.51    107.39   0.00     0.00     202.51    107.39   ?       ?      80.04   22.46  0.00    22.46  
1 1 1 -12 5   11 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -12 5   12 o 14 171.50  30.28  982.90    287.25   982.90   287.25   0.00      0.00     171.50  30.28  ?       ?      0.00    30.28  
1 1 1 -12 5   13 f 0  145.94  26.30  697.65    212.22   697.65   212.22   0.00      0.00     145.94  26.30  ?       ?      0.00    26.30  
1 1 1 -12 5   14 o 10 171.49  19.75  915.17    190.90   898.52   270.07   931.80    269.89   162.11  30.13  165.74  29.45  -3.62   42.13  
1 1 1 -12 5   15 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -12 5   16 o 3  69.51   21.06  156.38    91.28    156.38   91.28    0.00      0.00     69.51   21.06  ?       ?      0.00    21.06  
1 1 1 -12 5   17 o 14 123.53  16.33  474.11    112.94   479.48   156.81   468.31    162.80   119.53  23.69  117.17  24.97  2.36    34.42  
1 1 1 -12 6   1  o 18 87.82   18.64  236.41    91.04    294.05   130.49   181.75    127.07   96.93   23.66  77.85   25.05  19.08   34.45  
1 1 1 -12 6   2  o 1  213.47  23.81  1391.53   286.80   1397.18  404.81   1385.84   406.38   206.89  35.35  205.80  35.69  1.09    50.24  
1 1 1 -12 6   3  o 15 191.71  21.85  1116.06   236.17   1242.28  334.13   990.04    333.86   197.64  30.42  173.53  34.73  24.11   46.17  
1 1 1 -12 6   4  o 15 178.47  31.42  1027.09   310.15   0.00     0.00     1027.09   310.15   ?       ?      178.47  31.42  0.00    31.42  
1 1 1 -12 6   5  o 11 120.70  25.52  461.60    171.30   0.00     0.00     461.60    171.30   ?       ?      120.70  25.52  0.00    25.52  
1 1 1 -12 6   6  o 18 163.97  29.04  864.02    263.34   0.00     0.00     864.02    263.34   ?       ?      163.97  29.04  0.00    29.04  
1 1 1 -12 6   7  o 2  186.31  32.43  1144.70   334.29   0.00     0.00     1144.70   334.29   ?       ?      186.31  32.43  0.00    32.43  
1 1 1 -12 6   8  o 3  166.74  29.48  906.15    271.83   0.00     0.00     906.15    271.83   ?       ?      166.74  29.48  0.00    29.48  
1 1 1 -12 6   9  o 6  62.46   19.02  118.91    74.31    99.90    112.12   133.80    99.24    62.59   23.31  66.95   22.17  -4.36   32.17  
1 1 1 -12 6   10 f 0  95.24   15.82  276.41    83.46    298.73   113.92   250.55    122.61   97.22   21.02  88.23   23.70  9.00    31.68  
1 1 1 -12 6   11 o 13 125.77  16.06  479.43    113.29   518.03   157.12   437.64    163.49   127.94  22.20  115.83  25.30  12.11   33.65  
1 1 1 -12 6   12 o 19 101.30  21.50  328.09    121.18   328.09   121.18   0.00      0.00     101.30  21.50  ?       ?      0.00    21.50  
1 1 1 -12 6   13 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -12 6   14 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -12 6   15 o 3  68.71   22.64  150.87    103.50   0.00     0.00     150.87    103.50   ?       ?      68.71   22.64  0.00    22.64  
1 1 1 -12 6   16 o 2  200.71  24.33  1342.98   274.67   1221.48  384.67   1469.36   392.33   172.52  39.67  194.67  36.45  -22.14  53.87  
1 1 1 -12 7   1  o 19 180.22  20.94  986.92    212.60   1015.78  301.74   958.47    299.61   177.57  30.71  171.89  31.52  5.67    44.01  
1 1 1 -12 7   2  o 7  196.53  22.32  1181.33   247.32   1135.59  350.66   1226.61   348.86   185.39  34.21  194.06  32.46  -8.67   47.16  
1 1 1 -12 7   3  o 5  193.18  21.88  1141.12   238.35   1047.01  337.39   1234.86   336.75   177.40  34.37  195.36  31.07  -17.95  46.33  
1 1 1 -12 7   4  o 12 93.24   18.13  267.15    93.52    252.25   137.23   280.06    127.79   89.06   25.53  93.94   23.70  -4.88   34.83  
1 1 1 -12 7   5  o 12 103.43  17.78  327.02    101.74   323.89   145.30   330.02    142.50   100.45  25.23  101.56  24.68  -1.11   35.30  
1 1 1 -12 7   6  o 5  208.84  23.78  1357.52   279.98   1299.20  394.98   1416.41   396.93   194.45  36.73  204.70  35.04  -10.24  50.76  
1 1 1 -12 7   7  o 6  155.74  19.10  740.28    167.16   759.13   234.54   720.82    238.29   153.02  27.72  148.22  29.05  4.81    40.15  
1 1 1 -12 7   8  o 5  186.82  34.16  1191.73   352.83   0.00     0.00     1191.73   352.83   ?       ?      186.82  34.16  0.00    34.16  
1 1 1 -12 7   9  o 11 143.27  27.36  672.70    216.79   0.00     0.00     672.70    216.79   ?       ?      143.27  27.36  0.00    27.36  
1 1 1 -12 7   10 o 11 114.82  16.81  403.24    107.49   345.13   155.42   456.54    148.83   102.03  26.35  119.64  22.50  -17.61  34.65  
1 1 1 -12 7   11 o 7  73.83   16.24  169.64    66.96    123.95   84.63    246.09    109.47   63.58   20.44  87.29   21.89  -23.71  29.95  
1 1 1 -12 7   12 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -12 7   13 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -12 7   14 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -12 7   15 o 8  107.69  15.48  359.42    92.93    382.37   122.65   328.48    142.38   108.33  20.47  97.35   25.26  10.98   32.52  
1 1 1 -12 7   16 o 6  72.73   16.34  168.69    66.57    101.42   84.09    281.64    108.96   57.96   20.38  91.99   21.08  -34.04  29.32  
1 1 1 -12 8   1  o 9  85.64   25.47  232.43    134.46   232.43   134.46   0.00      0.00     85.64   25.47  ?       ?      0.00    25.47  
1 1 1 -12 8   2  o 5  171.23  20.62  897.42    198.64   740.33   277.45   1062.60   284.52   148.15  33.42  181.99  28.14  -33.84  43.69  
1 1 1 -12 8   3  o 13 62.00   21.15  110.31    90.23    135.90   118.36   74.81     139.43   68.99   24.19  63.11   25.30  5.88    35.00  
1 1 1 -12 8   4  o 9  107.38  18.90  355.64    112.26   314.26   150.13   408.12    169.06   98.40   26.14  111.97  26.68  -13.58  37.35  
1 1 1 -12 8   5  o 10 250.07  29.08  2025.36   409.66   2062.90  579.38   1987.84   579.31   235.95  44.40  230.28  45.44  5.67    63.53  
1 1 1 -12 8   6  o 7  254.76  29.53  2118.86   423.93   2012.04  599.29   2225.85   599.76   228.20  47.30  244.08  44.44  -15.89  64.90  
1 1 1 -12 8   7  o 18 122.26  17.62  457.46    120.07   437.66   170.07   477.13    169.54   115.52  26.24  121.30  25.17  -5.78   36.37  
1 1 1 -12 8   8  o 19 59.33   22.98  81.08     111.49   0.00     0.00     81.08     111.49   ?       ?      59.33   22.98  0.00    22.98  
1 1 1 -12 8   9  o 17 175.64  33.14  1073.58   321.85   0.00     0.00     1073.58   321.85   ?       ?      175.64  33.14  0.00    33.14  
1 1 1 -12 8   10 o 7  126.14  27.22  534.54    191.29   0.00     0.00     534.54    191.29   ?       ?      126.14  27.22  0.00    27.22  
1 1 1 -12 8   11 o 5  91.62   18.40  265.16    93.43    144.22   128.75   399.69    135.78   69.60   25.14  111.10  22.07  -41.51  33.45  
1 1 1 -12 8   12 o 9  149.00  18.07  691.24    151.38   621.66   205.38   773.98    223.98   134.65  27.50  151.25  26.78  -16.60  38.38  
1 1 1 -12 8   13 o 11 100.77  21.01  332.11    117.57   332.11   117.57   0.00      0.00     100.77  21.01  ?       ?      0.00    21.01  
1 1 1 -12 8   14 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -12 8   15 o 12 72.65   16.91  169.54    69.21    173.47   87.44    162.96    113.24   72.35   20.25  70.16   23.69  2.20    31.17  
1 1 1 -12 9   1  x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -12 9   2  x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -12 9   3  o 5  54.03   20.96  63.02     92.91    17.68    121.51   126.83    144.15   53.33   22.68  69.78   26.34  -16.45  34.76  
1 1 1 -12 9   4  o 9  242.76  28.49  1918.95   389.44   1826.29  547.83   2013.61   553.71   218.57  45.16  232.45  43.08  -13.88  62.41  
1 1 1 -12 9   5  o 4  142.58  30.14  685.92    239.01   0.00     0.00     685.92    239.01   ?       ?      142.58  30.14  0.00    30.14  
1 1 1 -12 9   6  o 5  70.96   21.79  158.20    97.31    160.39   130.45   155.45    146.12   72.90   25.40  73.29   26.73  -0.39   36.88  
1 1 1 -12 9   7  o 7  239.93  28.27  1901.70   381.97   1742.16  536.83   2065.29   543.61   208.33  46.11  233.01  42.19  -24.68  62.50  
1 1 1 -12 9   8  o 14 97.60   19.24  300.83    103.97   311.47   136.90   286.33    159.82   97.00   24.56  92.03   27.86  4.97    37.15  
1 1 1 -12 9   9  o 14 112.37  25.81  423.90    162.99   0.00     0.00     423.90    162.99   ?       ?      112.37  25.81  0.00    25.81  
1 1 1 -12 9   10 o 18 64.81   24.13  118.38    120.09   0.00     0.00     118.38    120.09   ?       ?      64.81   24.13  0.00    24.13  
1 1 1 -12 9   11 o 5  62.13   20.22  120.84    82.66    121.16   113.95   120.49    120.10   64.33   23.59  64.75   24.13  -0.42   33.74  
1 1 1 -12 9   12 o 2  178.42  21.49  1032.42   215.64   1003.50  298.61   1063.93   311.73   164.18  32.83  168.48  33.41  -4.30   46.84  
1 1 1 -12 9   13 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -12 10  1  o 11 175.78  21.49  964.10    212.34   989.71   301.02   938.74    299.56   170.45  31.94  165.24  32.74  5.21    45.74  
1 1 1 -12 10  2  o 17 176.22  33.59  1077.28   327.42   1077.28  327.42   0.00      0.00     176.22  33.59  ?       ?      0.00    33.59  
1 1 1 -12 10  3  o 15 132.45  28.54  589.66    210.59   589.66   210.59   0.00      0.00     132.45  28.54  ?       ?      0.00    28.54  
1 1 1 -12 10  4  f 0  278.31  35.42  2736.54   553.05   2899.28  782.43   2574.04   781.84   255.34  55.00  233.05  58.53  22.29   80.32  
1 1 1 -12 10  5  o 7  67.50   20.32  143.53    85.16    53.36    121.39   230.90    119.50   56.84   23.30  83.98   23.74  -27.14  33.26  
1 1 1 -12 10  6  o 8  76.94   19.34  189.05    85.31    176.17   112.34   206.61    131.12   74.11   23.52  79.54   25.43  -5.43   34.64  
1 1 1 -12 10  7  f 0  154.81  19.13  748.75    166.36   680.07   226.62   829.03    245.00   140.37  29.08  155.93  28.42  -15.57  40.66  
1 1 1 -12 10  8  o 19 65.47   19.67  136.39    79.89    106.43   94.96    208.92    147.76   60.50   21.62  79.48   27.06  -18.97  34.64  
1 1 1 -12 10  9  o 11 114.51  18.07  413.17    114.84   301.40   146.42   591.85    185.13   93.30   26.24  132.41  25.28  -39.10  36.44  
1 1 1 -12 10  10 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -12 10  11 o 4  146.77  33.24  821.56    273.49   0.00     0.00     821.56    273.49   ?       ?      146.77  33.24  0.00    33.24  
1 1 1 -12 10  12 o 4  108.29  23.49  400.11    141.82   400.11   141.82   0.00      0.00     108.29  23.49  ?       ?      0.00    23.49  
1 1 1 -12 11  1  o 2  38.94   17.09  -10.57    73.31    -24.03   92.82    11.74     119.54   42.33   18.87  51.72   22.26  -9.39   29.18  
1 1 1 -12 11  2  f 0  55.22   19.72  84.96     79.02    91.82    100.98   74.14     126.90   59.06   22.10  59.99   24.11  -0.92   32.70  
1 1 1 -12 11  3  o 19 244.99  70.14  3695.14   1036.75  3695.14  1036.75  0.00      0.00     244.99  70.14  ?       ?      0.00    70.14  
1 1 1 -12 11  4  o 3  150.28  28.49  774.67    236.76   774.67   236.76   0.00      0.00     150.28  28.49  ?       ?      0.00    28.49  
1 1 1 -12 11  5  o 6  73.59   19.03  174.11    81.00    155.28   104.97   201.81    127.33   69.71   22.79  78.07   25.07  -8.35   33.88  
1 1 1 -12 11  6  o 19 77.78   25.80  201.31    134.32   0.00     0.00     201.31    134.32   ?       ?      77.78   25.80  0.00    25.80  
1 1 1 -12 11  7  o 9  96.19   17.50  292.63    93.10    289.71   123.48   296.47    141.72   92.76   23.24  92.56   25.74  0.20    34.68  
1 1 1 -12 11  8  o 14 125.22  18.10  495.63    126.36   468.20   174.66   525.76    183.05   115.58  26.84  122.79  26.73  -7.21   37.88  
1 1 1 -12 11  9  o 11 53.34   19.88  77.15     81.55    40.79    115.37   113.45    115.29   53.16   22.33  62.70   23.58  -9.53   32.48  
1 1 1 -12 12  1  o 14 94.64   26.17  307.13    146.96   0.00     0.00     307.13    146.96   ?       ?      94.64   26.17  0.00    26.17  
1 1 1 -12 12  2  o 18 197.33  24.56  1284.21   272.17   1290.02  387.83   1278.57   382.05   182.01  38.33  181.82  37.84  0.19    53.86  
1 1 1 -12 12  3  o 8  51.66   20.39  58.00     89.24    58.10    131.53   57.91     121.47   58.07   24.08  56.61   23.27  1.46    33.49  
1 1 1 -12 12  4  o 4  108.63  28.30  419.11    178.24   419.11   178.24   0.00      0.00     108.63  28.30  ?       ?      0.00    28.30  
1 1 1 -11 -13 1  f 0  147.03  29.59  713.44    241.07   713.44   241.07   0.00      0.00     147.03  29.59  ?       ?      0.00    29.59  
1 1 1 -11 -13 2  x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 -12 1  x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 -12 2  o 15 135.02  17.80  551.40    134.64   535.94   197.66   564.78    183.90   128.86  27.56  133.65  24.88  -4.79   37.13  
1 1 1 -11 -12 3  o 6  119.62  17.29  433.50    115.26   405.69   172.49   455.93    154.93   111.88  27.14  120.38  23.26  -8.50   35.74  
1 1 1 -11 -12 4  o 19 99.40   17.62  302.40    96.86    331.97   150.40   281.44    126.61   101.49  25.77  94.04   23.52  7.46    34.89  
1 1 1 -11 -12 5  o 16 45.49   18.66  25.28     77.94    -27.61   132.71   53.13     96.30    51.31   22.73  53.37   21.15  -2.06   31.05  
1 1 1 -11 -12 6  f 0  118.82  17.87  430.08    118.10   402.98   181.47   449.99    155.55   110.79  28.40  119.26  23.56  -8.47   36.90  
1 1 1 -11 -11 1  o 16 143.18  26.39  646.12    208.88   0.00     0.00     646.12    208.88   ?       ?      143.18  26.39  0.00    26.39  
1 1 1 -11 -11 2  o 7  159.78  19.03  769.53    171.08   723.97   246.40   811.94    237.72   150.08  29.65  160.69  26.71  -10.61  39.91  
1 1 1 -11 -11 3  o 18 73.48   18.81  166.71    79.65    151.51   123.22   177.63    104.40   72.40   24.71  75.91   22.41  -3.50   33.36  
1 1 1 -11 -11 4  o 10 190.25  22.36  1106.86   239.58   885.68   341.14   1322.14   336.55   161.31  37.54  203.74  29.64  -42.42  47.84  
1 1 1 -11 -11 5  o 5  235.83  26.71  1738.05   355.26   1665.83  504.49   1809.09   500.37   218.89  41.67  230.57  39.21  -11.67  57.21  
1 1 1 -11 -11 6  o 11 68.28   19.37  143.45    79.44    130.02   125.89   152.34    102.40   69.11   24.87  70.94   22.45  -1.82   33.50  
1 1 1 -11 -11 7  o 15 99.29   29.93  320.57    184.69   320.57   184.69   0.00      0.00     99.29   29.93  ?       ?      0.00    29.93  
1 1 1 -11 -11 8  o 12 65.84   22.00  127.15    97.62    182.72   159.78   94.05     123.32   79.20   28.07  63.44   24.27  15.77   37.11  
1 1 1 -11 -11 9  o 7  202.04  23.85  1269.93   271.35   1282.68  393.92   1258.42   374.31   193.45  36.82  193.01  35.07  0.45    50.85  
1 1 1 -11 -10 1  o 11 125.10  17.49  469.67    122.17   449.95   181.04   486.16    165.56   119.20  27.08  125.14  23.92  -5.94   36.13  
1 1 1 -11 -10 2  o 8  196.89  22.13  1174.62   245.78   1149.95  352.40   1197.99   342.96   188.54  33.80  193.63  31.97  -5.09   46.52  
1 1 1 -11 -10 3  o 7  252.92  28.13  1988.34   401.54   1952.54  569.31   2023.79   566.42   239.15  43.05  244.61  41.84  -5.46   60.03  
1 1 1 -11 -10 4  o 16 175.73  20.38  931.81    201.79   790.64   288.13   1067.73   282.71   155.68  33.25  184.83  27.48  -29.15  43.14  
1 1 1 -11 -10 5  o 11 230.48  25.98  1640.47   337.83   1478.68  479.55   1799.86   475.99   207.86  41.64  233.93  36.65  -26.07  55.47  
1 1 1 -11 -10 6  o 2  54.25   18.80  80.03     71.43    63.52    108.78   92.54     94.71    57.41   22.56  59.75   21.56  -2.34   31.21  
1 1 1 -11 -10 7  o 7  123.11  19.31  461.33    131.96   383.57   198.27   523.17    176.81   108.65  30.53  129.14  24.75  -20.48  39.30  
1 1 1 -11 -10 8  o 17 192.04  22.58  1129.92   244.14   1106.57  351.81   1151.60   339.07   182.55  34.84  187.84  32.63  -5.29   47.73  
1 1 1 -11 -10 9  f 0  161.74  20.23  796.88    183.70   864.46   271.71   739.98    249.31   163.27  30.10  150.93  29.83  12.34   42.38  
1 1 1 -11 -10 10 o 5  284.56  33.45  2665.79   536.05   2666.23  762.99   2665.37   753.28   261.89  52.58  262.96  51.74  -1.08   73.77  
1 1 1 -11 -10 11 o 6  122.59  19.32  461.14    131.44   523.00   201.68   415.46    173.31   126.50  28.46  113.10  27.06  13.40   39.27  
1 1 1 -11 -9  1  o 19 321.57  60.62  3847.10   1078.00  0.00     0.00     3847.10   1078.00  ?       ?      321.57  60.62  0.00    60.62  
1 1 1 -11 -9  2  f 0  103.55  23.06  332.27    133.55   0.00     0.00     332.27    133.55   ?       ?      103.55  23.06  0.00    23.06  
1 1 1 -11 -9  3  o 11 122.39  23.25  461.90    157.40   0.00     0.00     461.90    157.40   ?       ?      122.39  23.25  0.00    23.25  
1 1 1 -11 -9  4  o 18 180.81  30.37  1031.95   304.04   0.00     0.00     1031.95   304.04   ?       ?      180.81  30.37  0.00    30.37  
1 1 1 -11 -9  5  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 -9  6  o 14 245.11  42.70  2035.98   578.96   0.00     0.00     2035.98   578.96   ?       ?      245.11  42.70  0.00    42.70  
1 1 1 -11 -9  7  o 6  155.43  27.55  759.78    236.81   0.00     0.00     759.78    236.81   ?       ?      155.43  27.55  0.00    27.55  
1 1 1 -11 -9  8  x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 -9  9  o 19 185.18  32.35  1110.93   331.35   0.00     0.00     1110.93   331.35   ?       ?      185.18  32.35  0.00    32.35  
1 1 1 -11 -9  10 o 19 286.20  56.92  3206.25   902.26   0.00     0.00     3206.25   902.26   ?       ?      286.20  56.92  0.00    56.92  
1 1 1 -11 -9  11 o 8  175.15  31.00  999.27    300.35   0.00     0.00     999.27    300.35   ?       ?      175.15  31.00  0.00    31.00  
1 1 1 -11 -9  12 o 12 175.89  31.44  1017.86   305.85   0.00     0.00     1017.86   305.85   ?       ?      175.89  31.44  0.00    31.44  
1 1 1 -11 -9  13 o 15 118.62  24.64  449.06    162.33   0.00     0.00     449.06    162.33   ?       ?      118.62  24.64  0.00    24.64  
1 1 1 -11 -8  1  o 10 329.18  36.83  3414.16   684.14   3153.02  968.52   3674.23   966.53   297.04  58.88  326.82  53.36  -29.78  79.46  
1 1 1 -11 -8  2  o 10 421.03  50.14  5980.03   1188.21  5712.82  1680.82  6246.97   1679.96  369.46  81.44  393.90  77.05  -24.44  112.12 
1 1 1 -11 -8  3  o 15 201.40  22.49  1218.07   255.64   1083.74  363.64   1349.33   359.46   183.92  35.73  208.22  31.02  -24.30  47.31  
1 1 1 -11 -8  4  o 16 290.71  32.04  2629.56   525.86   2594.30  745.61   2664.47   741.77   275.47  48.94  280.23  47.82  -4.76   68.43  
1 1 1 -11 -8  5  o 13 348.92  39.97  3949.78   786.18   3831.95  1113.05  4067.09   1110.61  318.31  63.14  331.31  60.63  -13.00  87.54  
1 1 1 -11 -8  6  o 14 44.69   18.44  19.44     76.66    33.79    119.06   9.28      100.19   55.70   22.98  48.85   20.68  6.85    30.92  
1 1 1 -11 -8  7  o 17 177.56  20.56  948.25    205.70   922.73   297.62   971.60    284.64   170.11  31.64  175.90  29.21  -5.79   43.06  
1 1 1 -11 -8  8  o 7  192.15  22.02  1117.57   238.47   1099.23  343.83   1134.57   331.04   184.53  33.70  188.71  31.68  -4.18   46.25  
1 1 1 -11 -8  9  o 13 267.29  29.84  2240.68   450.03   2297.45  639.79   2185.09   633.13   257.94  44.83  250.64  45.69  7.30    64.01  
1 1 1 -11 -8  10 o 13 376.23  46.13  4942.15   975.51   5034.11  1381.63  4850.74   1377.52  337.28  73.44  328.37  74.76  8.91    104.80 
1 1 1 -11 -8  11 o 3  240.31  27.09  1801.90   367.24   1844.70  524.76   1760.82   514.12   232.17  40.86  226.57  41.04  5.59    57.91  
1 1 1 -11 -8  12 o 4  133.84  18.45  542.69    137.99   640.68   209.30   467.35    183.52   141.96  26.66  120.59  27.16  21.37   38.06  
1 1 1 -11 -8  13 o 4  75.46   20.68  177.73    92.23    147.60   153.64   194.70    115.32   74.07   27.35  78.91   23.62  -4.84   36.14  
1 1 1 -11 -8  14 o 8  99.55   23.97  317.09    135.34   0.00     0.00     317.09    135.34   ?       ?      99.55   23.97  0.00    23.97  
1 1 1 -11 -7  1  o 13 167.49  18.74  830.84    177.10   738.16   252.61   920.41    248.36   154.30  29.60  174.21  25.60  -19.92  39.13  
1 1 1 -11 -7  2  o 18 113.82  22.32  394.81    140.61   394.81   140.61   0.00      0.00     113.82  22.32  ?       ?      0.00    22.32  
1 1 1 -11 -7  3  o 14 274.48  45.89  2474.14   697.54   2474.14  697.54   0.00      0.00     274.48  45.89  ?       ?      0.00    45.89  
1 1 1 -11 -7  4  o 3  363.99  69.10  4976.00   1391.15  4976.00  1391.15  0.00      0.00     363.99  69.10  ?       ?      0.00    69.10  
1 1 1 -11 -7  5  o 11 271.12  46.00  2440.08   690.41   2440.08  690.41   0.00      0.00     271.12  46.00  ?       ?      0.00    46.00  
1 1 1 -11 -7  6  o 8  243.23  41.00  1929.53   552.15   1929.53  552.15   0.00      0.00     243.23  41.00  ?       ?      0.00    41.00  
1 1 1 -11 -7  7  o 3  273.43  47.66  2546.40   720.90   2546.40  720.90   0.00      0.00     273.43  47.66  ?       ?      0.00    47.66  
1 1 1 -11 -7  8  o 7  316.29  60.07  3741.38   1050.90  3741.38  1050.90  0.00      0.00     316.29  60.07  ?       ?      0.00    60.07  
1 1 1 -11 -7  9  o 10 214.72  36.82  1504.18   437.49   1504.18  437.49   0.00      0.00     214.72  36.82  ?       ?      0.00    36.82  
1 1 1 -11 -7  10 o 7  202.39  35.49  1335.46   397.36   1335.46  397.36   0.00      0.00     202.39  35.49  ?       ?      0.00    35.49  
1 1 1 -11 -7  11 o 10 323.62  69.16  4432.61   1245.91  4432.61  1245.91  0.00      0.00     323.62  69.16  ?       ?      0.00    69.16  
1 1 1 -11 -7  12 o 13 261.37  48.88  2476.39   706.41   2476.39  706.41   0.00      0.00     261.37  48.88  ?       ?      0.00    48.88  
1 1 1 -11 -7  13 o 18 186.37  33.83  1146.95   348.64   1146.95  348.64   0.00      0.00     186.37  33.83  ?       ?      0.00    33.83  
1 1 1 -11 -7  14 o 16 160.05  30.94  841.24    274.02   841.24   274.02   0.00      0.00     160.05  30.94  ?       ?      0.00    30.94  
1 1 1 -11 -7  15 o 9  134.19  29.68  595.67    222.60   595.67   222.60   0.00      0.00     134.19  29.68  ?       ?      0.00    29.68  
1 1 1 -11 -7  16 o 16 160.14  31.86  860.47    282.56   860.47   282.56   0.00      0.00     160.14  31.86  ?       ?      0.00    31.86  
1 1 1 -11 -6  1  o 6  331.87  56.96  3734.13   1046.11  3734.13  1046.11  0.00      0.00     331.87  56.96  ?       ?      0.00    56.96  
1 1 1 -11 -6  2  x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 -6  3  o 13 86.51   21.72  228.74    107.73   228.74   107.73   0.00      0.00     86.51   21.72  ?       ?      0.00    21.72  
1 1 1 -11 -6  4  o 14 220.85  23.71  1458.71   295.86   1402.05  419.67   1514.70   417.16   211.22  35.89  220.63  34.03  -9.41   49.46  
1 1 1 -11 -6  5  o 11 313.98  34.22  3049.59   606.85   3042.69  859.02   3056.46   857.41   300.72  51.62  301.63  51.36  -0.91   72.81  
1 1 1 -11 -6  6  o 5  107.17  16.65  342.75    99.10    310.16   142.74   373.09    137.69   100.15  24.93  110.45  22.48  -10.30  33.57  
1 1 1 -11 -6  7  o 4  271.46  29.64  2258.43   454.44   2180.59  643.92   2335.68   641.44   256.41  45.41  267.11  43.31  -10.70  62.75  
1 1 1 -11 -6  8  o 5  87.74   17.69  233.51    86.02    185.11   127.57   273.86    116.47   78.90   25.06  94.28   21.93  -15.38  33.31  
1 1 1 -11 -6  9  o 19 374.57  43.07  4639.04   909.22   4937.81  1286.97  4341.33   1284.69  359.25  64.79  329.00  70.16  30.25   95.50  
1 1 1 -11 -6  10 o 4  212.03  23.22  1362.89   277.96   1424.18  396.03   1303.40   390.22   210.85  33.86  200.77  35.14  10.08   48.80  
1 1 1 -11 -6  11 o 6  203.05  22.57  1250.89   258.62   1239.71  368.84   1261.71   362.71   195.78  34.05  198.17  33.05  -2.39   47.45  
1 1 1 -11 -6  12 o 14 348.08  41.03  4073.64   804.06   4181.38  1138.62  3966.47   1135.62  322.10  63.84  310.57  65.75  11.53   91.64  
1 1 1 -11 -6  13 o 14 112.92  18.27  387.37    114.40   403.94   175.49   375.12    150.85   112.19  27.47  108.94  24.69  3.25    36.94  
1 1 1 -11 -6  14 o 3  259.61  29.97  2151.29   438.47   2054.89  624.12   2245.24   616.15   236.84  47.56  251.41  44.31  -14.57  65.00  
1 1 1 -11 -6  15 o 12 116.22  17.85  411.34    115.31   376.26   177.06   437.16    151.95   107.24  28.34  117.72  23.31  -10.49  36.69  
1 1 1 -11 -6  16 o 8  61.86   20.06  114.05    81.45    117.98   143.23   112.17    99.01    68.76   26.19  63.08   22.12  5.68    34.28  
1 1 1 -11 -6  17 o 15 260.23  30.32  2224.45   444.42   2276.13  634.08   2174.55   623.08   243.39  47.08  237.36  47.39  6.04    66.80  
1 1 1 -11 -5  1  o 15 346.21  37.11  3677.74   726.07   3751.29  1027.44  3604.38   1026.20  337.56  54.91  329.77  56.22  7.78    78.58  
1 1 1 -11 -5  2  o 4  129.08  15.67  490.35    113.73   469.37   163.82   509.88    158.01   124.35  23.82  130.22  21.92  -5.87   32.36  
1 1 1 -11 -5  3  o 18 318.29  34.16  3098.57   614.38   3092.53  869.78   3104.58   867.94   306.95  51.16  307.74  50.91  -0.79   72.17  
1 1 1 -11 -5  4  o 9  72.79   19.53  160.35    83.32    0.00     0.00     160.35    83.32    ?       ?      72.79   19.53  0.00    19.53  
1 1 1 -11 -5  5  o 16 433.60  49.49  6152.51   1209.79  6379.16  1713.11  5927.02   1708.71  411.08  75.37  391.54  78.75  19.54   109.01 
1 1 1 -11 -5  6  o 5  243.38  26.25  1783.91   360.94   1749.79  512.01   1817.61   508.91   234.46  39.44  239.71  38.27  -5.25   54.95  
1 1 1 -11 -5  7  o 9  50.90   18.34  64.16     68.49    114.74   101.09   21.24     93.12    64.97   22.38  49.00   20.28  15.97   30.20  
1 1 1 -11 -5  8  o 11 147.31  25.79  665.77    210.19   0.00     0.00     665.77    210.19   ?       ?      147.31  25.79  0.00    25.79  
1 1 1 -11 -5  9  o 15 200.13  21.70  1199.59   245.27   1265.21  348.75   1135.36   345.01   201.38  31.17  189.74  32.86  11.63   45.30  
1 1 1 -11 -5  10 o 11 272.79  29.99  2304.72   461.95   2269.34  654.34   2339.87   652.24   258.99  45.68  263.93  44.64  -4.95   63.87  
1 1 1 -11 -5  11 o 10 221.39  24.21  1491.50   302.68   1516.78  431.14   1466.93   425.05   216.31  35.98  212.57  36.12  3.74    50.99  
1 1 1 -11 -5  12 o 19 95.32   16.70  274.73    88.05    303.62   130.98   250.90    118.95   98.51   23.49  89.65   23.00  8.86    32.88  
1 1 1 -11 -5  13 o 1  257.05  46.64  2336.85   662.91   2336.85  662.91   0.00      0.00     257.05  46.64  ?       ?      0.00    46.64  
1 1 1 -11 -5  14 o 3  235.38  26.14  1723.73   347.27   1769.77  493.26   1678.48   488.99   228.45  39.01  221.60  39.91  6.85    55.81  
1 1 1 -11 -5  15 o 12 98.55   18.07  297.60    98.48    318.79   152.25   282.35    129.14   99.59   26.26  94.30   23.85  5.29    35.47  
1 1 1 -11 -5  16 o 17 101.15  17.88  313.91    100.03   311.36   156.97   315.66    129.81   97.87   27.04  99.62   23.14  -1.75   35.59  
1 1 1 -11 -5  17 o 2  188.95  21.74  1106.92   231.52   1170.16  336.63   1050.15   318.93   186.25  32.68  176.20  32.74  10.05   46.25  
1 1 1 -11 -5  18 o 18 146.47  18.39  656.48    151.21   682.44   227.58   635.96    202.34   143.50  28.63  139.94  26.15  3.56    38.77  
1 1 1 -11 -4  1  o 1  321.69  34.30  3129.58   623.69   3045.90  882.53   3213.08   881.53   307.84  51.78  317.41  50.03  -9.57   72.00  
1 1 1 -11 -4  2  o 9  227.62  24.04  1536.21   309.42   1526.47  438.32   1545.89   436.84   222.89  35.44  224.49  35.04  -1.60   49.84  
1 1 1 -11 -4  3  o 11 269.14  42.95  2279.27   641.33   0.00     0.00     2279.27   641.33   ?       ?      269.14  42.95  0.00    42.95  
1 1 1 -11 -4  4  o 13 298.01  32.15  2692.58   541.34   2473.93  764.60   2912.35   766.56   275.52  50.19  302.44  45.57  -26.92  67.79  
1 1 1 -11 -4  5  o 15 66.24   20.02  129.49    82.53    89.90    149.51   146.84    98.98    68.19   26.55  70.80   22.02  -2.61   34.49  
1 1 1 -11 -4  6  o 16 267.37  28.68  2161.19   433.39   2248.77  617.95   2076.41   608.00   265.61  41.92  254.28  43.20  11.33   60.19  
1 1 1 -11 -4  7  o 2  211.70  23.25  1339.69   277.86   1357.91  400.49   1322.78   385.83   208.34  34.71  205.99  33.80  2.34    48.44  
1 1 1 -11 -4  8  o 17 105.74  17.89  335.51    104.73   351.37   172.07   326.17    131.98   106.28  27.87  103.09  22.90  3.19    36.07  
1 1 1 -11 -4  9  o 8  68.27   18.39  141.33    73.67    126.40   111.05   153.06    98.44    67.98   23.45  71.70   21.90  -3.72   32.09  
1 1 1 -11 -4  10 f 0  340.08  38.27  3693.23   734.18   3624.40  1038.90  3761.91   1037.66  316.01  59.45  323.73  57.96  -7.72   83.03  
1 1 1 -11 -4  11 o 3  129.89  16.54  502.04    120.52   526.05   174.68   480.22    166.50   130.58  24.19  124.64  24.14  5.94    34.18  
1 1 1 -11 -4  12 o 6  131.44  16.70  515.44    123.18   482.46   177.79   545.89    170.83   124.07  25.80  133.14  23.19  -9.08   34.70  
1 1 1 -11 -4  13 o 15 316.76  36.40  3271.78   649.83   3264.13  919.99   3279.40   917.99   293.38  56.68  294.50  56.35  -1.12   79.92  
1 1 1 -11 -4  14 o 15 325.24  38.23  3523.41   700.25   3499.76  990.96   3547.00   989.65   296.07  60.35  299.00  59.75  -2.93   84.93  
1 1 1 -11 -4  15 o 8  113.81  16.15  389.68    102.57   460.78   149.45   326.36    141.04   121.71  22.21  101.33  24.51  20.39   33.08  
1 1 1 -11 -4  16 o 2  200.30  22.02  1233.33   248.99   1348.27  355.19   1122.29   349.12   202.94  31.51  182.61  34.57  20.33   46.77  
1 1 1 -11 -4  17 o 18 61.54   19.26  114.46    75.56    134.71   119.60   101.00    97.49    68.71   24.29  60.98   21.89  7.73    32.70  
1 1 1 -11 -4  18 o 15 268.50  29.78  2373.80   451.33   2746.58  643.57   2013.03   633.11   272.29  42.57  221.42  50.88  50.86   66.33  
1 1 1 -11 -3  1  o 10 345.90  36.88  3623.21   721.11   3507.57  1020.15  3738.70   1019.45  329.74  55.89  342.03  53.69  -12.29  77.50  
1 1 1 -11 -3  2  o 5  343.96  36.41  3583.63   707.98   3638.65  1001.29  3528.62   1001.18  336.93  53.56  331.07  54.58  5.87    76.47  
1 1 1 -11 -3  3  o 7  251.68  26.67  1884.47   379.49   1820.82  536.96   1947.99   536.41   242.22  40.01  251.42  38.38  -9.20   55.44  
1 1 1 -11 -3  4  o 9  391.94  42.41  4764.88   939.14   4866.69  1329.01  4663.34   1327.30  380.10  63.12  370.54  64.75  9.56    90.43  
1 1 1 -11 -3  5  o 13 200.06  21.61  1184.65   244.29   1189.05  347.30   1180.34   343.69   197.12  31.77  196.47  31.54  0.65    44.77  
1 1 1 -11 -3  6  o 4  232.80  25.04  1618.55   329.34   1566.70  466.98   1669.86   464.56   223.72  37.70  231.89  36.07  -8.17   52.17  
1 1 1 -11 -3  7  o 3  174.42  19.28  900.32    189.86   932.13   271.03   869.67    266.04   174.76  27.96  168.48  28.52  6.28    39.94  
1 1 1 -11 -3  8  o 9  254.47  27.40  1957.45   393.97   2015.88  562.70   1901.27   551.77   251.28  40.38  243.58  40.91  7.70    57.48  
1 1 1 -11 -3  9  o 8  182.84  20.77  996.26    214.14   993.95   313.77   998.28    292.97   178.45  31.80  179.85  29.39  -1.41   43.30  
1 1 1 -11 -3  10 o 18 426.58  50.01  6128.22   1201.48  6414.75  1701.40  5843.19   1696.92  399.80  76.92  374.43  81.28  25.37   111.91 
1 1 1 -11 -3  11 o 19 162.59  27.19  817.82    244.81   0.00     0.00     817.82    244.81   ?       ?      162.59  27.19  0.00    27.19  
1 1 1 -11 -3  12 o 12 225.47  37.91  1660.46   473.25   0.00     0.00     1660.46   473.25   ?       ?      225.47  37.91  0.00    37.91  
1 1 1 -11 -3  13 o 17 218.30  36.95  1567.14   446.60   0.00     0.00     1567.14   446.60   ?       ?      218.30  36.95  0.00    36.95  
1 1 1 -11 -3  14 o 2  175.35  29.60  980.34    287.36   0.00     0.00     980.34    287.36   ?       ?      175.35  29.60  0.00    29.60  
1 1 1 -11 -3  15 o 5  239.27  43.02  2008.31   569.12   0.00     0.00     2008.31   569.12   ?       ?      239.27  43.02  0.00    43.02  
1 1 1 -11 -3  16 o 3  125.46  23.90  496.36    165.86   0.00     0.00     496.36    165.86   ?       ?      125.46  23.90  0.00    23.90  
1 1 1 -11 -3  17 o 4  68.49   22.41  141.15    101.49   0.00     0.00     141.15    101.49   ?       ?      68.49   22.41  0.00    22.41  
1 1 1 -11 -3  18 o 16 146.09  26.27  691.97    212.19   0.00     0.00     691.97    212.19   ?       ?      146.09  26.27  0.00    26.27  
1 1 1 -11 -3  19 o 2  122.70  23.37  483.88    158.61   724.59   1043.65  478.19    160.47   129.00  59.69  121.71  23.82  7.29    64.27  
1 1 1 -11 -2  1  o 15 514.07  57.53  8451.45   1668.76  8367.97  2360.23  8534.89   2359.75  479.98  88.93  486.14  87.79  -6.15   124.96 
1 1 1 -11 -2  2  o 15 85.28   15.30  216.59    72.17    294.22   102.41   140.00    101.72   99.11   18.68  70.00   22.40  29.11   29.17  
1 1 1 -11 -2  3  o 10 347.63  37.26  3666.10   731.95   3458.55  1034.73  3873.98   1035.53  326.15  57.36  348.06  53.54  -21.92  78.46  
1 1 1 -11 -2  4  o 5  640.07  79.28  14491.23  2850.91  14652.75 4032.43  14329.81  4031.16  565.58  127.28 555.91  128.84 9.67    181.11 
1 1 1 -11 -2  5  o 3  175.24  19.61  905.46    193.90   934.89   278.53   877.78    270.10   175.60  28.61  170.01  28.70  5.59    40.52  
1 1 1 -11 -2  6  o 15 381.73  41.69  4541.23   898.76   4536.23  1272.24  4546.22   1269.82  364.22  63.14  364.84  62.90  -0.62   89.12  
1 1 1 -11 -2  7  o 10 357.97  62.83  4447.71   1244.13  0.00     0.00     4447.71   1244.13  ?       ?      357.97  62.83  0.00    62.83  
1 1 1 -11 -2  8  o 9  365.39  66.54  4810.67   1344.40  0.00     0.00     4810.67   1344.40  ?       ?      365.39  66.54  0.00    66.54  
1 1 1 -11 -2  9  o 8  191.85  31.21  1141.17   331.98   0.00     0.00     1141.17   331.98   ?       ?      191.85  31.21  0.00    31.21  
1 1 1 -11 -2  10 o 5  139.78  24.40  597.08    188.67   0.00     0.00     597.08    188.67   ?       ?      139.78  24.40  0.00    24.40  
1 1 1 -11 -2  11 o 17 261.91  44.22  2275.97   641.24   0.00     0.00     2275.97   641.24   ?       ?      261.91  44.22  0.00    44.22  
1 1 1 -11 -2  12 o 2  304.61  55.81  3355.50   940.00   0.00     0.00     3355.50   940.00   ?       ?      304.61  55.81  0.00    55.81  
1 1 1 -11 -2  13 o 8  198.31  22.34  1191.82   249.89   1233.08  365.04   1155.44   342.81   195.57  33.73  189.84  32.63  5.73    46.93  
1 1 1 -11 -2  14 o 16 62.61   21.46  109.90    92.95    0.00     0.00     109.90    92.95    ?       ?      62.61   21.46  0.00    21.46  
1 1 1 -11 -2  15 o 19 54.77   20.18  73.98     83.54    0.00     0.00     73.98     83.54    ?       ?      54.77   20.18  0.00    20.18  
1 1 1 -11 -2  16 o 12 104.74  16.33  331.97    95.00    415.05   145.43   270.12    125.48   114.94  22.85  92.22   23.61  22.72   32.85  
1 1 1 -11 -2  17 o 12 154.11  18.32  720.96    158.95   739.01   231.23   704.80    218.85   151.13  27.67  148.06  26.73  3.08    38.47  
1 1 1 -11 -2  18 o 3  125.13  17.04  476.51    119.23   454.16   181.07   493.62    158.42   117.30  27.39  124.69  22.98  -7.39   35.75  
1 1 1 -11 -2  19 o 1  162.29  31.24  899.74    280.51   899.74   280.51   0.00      0.00     162.29  31.24  ?       ?      0.00    31.24  
1 1 1 -11 -2  20 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 -1  1  o 18 180.31  19.87  955.85    202.32   897.69   284.70   1015.20   287.57   172.16  29.89  183.83  28.14  -11.67  41.06  
1 1 1 -11 -1  2  o 10 561.83  117.54 13164.47  3668.89  0.00     0.00     13164.47  3668.89  ?       ?      561.83  117.54 0.00    117.54 
1 1 1 -11 -1  3  o 8  222.90  23.67  1467.74   298.24   1460.08  420.96   1475.45   422.59   218.90  34.65  220.10  34.58  -1.20   48.96  
1 1 1 -11 -1  4  o 2  699.81  92.15  18231.57  3612.31  17454.67 5108.61  19008.44  5108.54  568.58  153.12 610.95  147.37 -42.36  212.52 
1 1 1 -11 -1  5  o 13 460.59  86.09  7860.35   2192.72  0.00     0.00     7860.35   2192.72  ?       ?      460.59  86.09  0.00    86.09  
1 1 1 -11 -1  6  o 18 390.57  68.64  5307.09   1482.80  0.00     0.00     5307.09   1482.80  ?       ?      390.57  68.64  0.00    68.64  
1 1 1 -11 -1  7  o 8  239.92  38.41  1800.06   511.21   0.00     0.00     1800.06   511.21   ?       ?      239.92  38.41  0.00    38.41  
1 1 1 -11 -1  8  o 12 234.92  37.84  1735.85   492.94   0.00     0.00     1735.85   492.94   ?       ?      234.92  37.84  0.00    37.84  
1 1 1 -11 -1  9  o 7  255.67  27.43  1978.31   396.33   2004.81  562.90   1952.26   558.11   250.17  40.59  246.65  40.85  3.52    57.58  
1 1 1 -11 -1  10 o 16 235.74  25.65  1678.87   341.51   1621.74  485.71   1734.73   480.28   224.65  39.08  233.72  37.03  -9.07   53.84  
1 1 1 -11 -1  11 o 1  132.44  23.73  537.08    173.76   0.00     0.00     537.08    173.76   ?       ?      132.44  23.73  0.00    23.73  
1 1 1 -11 -1  12 o 5  328.59  36.85  3453.16   683.13   3492.35  967.47   3414.20   964.72   310.90  56.28  306.64  56.90  4.26    80.03  
1 1 1 -11 -1  13 o 12 227.35  24.98  1580.26   320.64   1545.56  455.51   1614.33   451.43   216.62  38.02  222.48  36.62  -5.86   52.78  
1 1 1 -11 -1  14 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 -1  15 o 17 212.61  37.36  1522.71   439.33   1522.71  439.33   0.00      0.00     212.61  37.36  ?       ?      0.00    37.36  
1 1 1 -11 -1  16 o 3  224.76  41.08  1773.15   510.50   1773.15  510.50   0.00      0.00     224.76  41.08  ?       ?      0.00    41.08  
1 1 1 -11 -1  17 o 2  136.23  27.98  605.16    211.47   605.16   211.47   0.00      0.00     136.23  27.98  ?       ?      0.00    27.98  
1 1 1 -11 -1  18 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 -1  19 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 -1  20 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 0   1  o 16 157.68  17.96  730.01    159.69   751.91   228.84   709.22    222.95   158.19  26.11  153.50  26.24  4.69    37.02  
1 1 1 -11 0   2  o 9  505.53  56.65  8164.41   1615.66  7867.75  2284.82  8461.12   2284.97  464.20  88.98  486.33  84.93  -22.13  123.01 
1 1 1 -11 0   3  o 18 186.04  20.36  1018.60   213.89   1006.19  308.87   1030.04   296.49   182.17  30.62  184.88  28.88  -2.71   42.09  
1 1 1 -11 0   4  o 11 153.12  25.12  704.35    213.15   0.00     0.00     704.35    213.15   ?       ?      153.12  25.12  0.00    25.12  
1 1 1 -11 0   5  o 10 154.60  25.43  719.41    217.83   0.00     0.00     719.41    217.83   ?       ?      154.60  25.43  0.00    25.43  
1 1 1 -11 0   6  o 18 282.05  45.38  2522.25   709.87   0.00     0.00     2522.25   709.87   ?       ?      282.05  45.38  0.00    45.38  
1 1 1 -11 0   7  o 2  123.31  15.96  448.63    110.36   445.51   157.14   451.67    155.01   121.14  23.45  122.11  22.96  -0.97   32.81  
1 1 1 -11 0   8  o 1  394.63  44.16  4964.02   983.36   4886.74  1390.74  5041.30   1390.62  367.90  68.37  375.29  67.01  -7.39   95.73  
1 1 1 -11 0   9  o 3  182.72  20.24  992.27    208.75   922.72   295.12   1061.92   295.31   172.31  30.97  186.13  28.55  -13.82  42.12  
1 1 1 -11 0   10 o 14 375.31  42.46  4548.99   898.81   4559.16  1271.39  4538.84   1270.83  350.96  65.51  349.98  65.66  0.98    92.76  
1 1 1 -11 0   11 o 13 179.65  29.64  1003.92   294.99   1003.92  294.99   0.00      0.00     179.65  29.64  ?       ?      0.00    29.64  
1 1 1 -11 0   12 o 11 362.64  76.78  5540.58   1548.47  5540.58  1548.47  0.00      0.00     362.64  76.78  ?       ?      0.00    76.78  
1 1 1 -11 0   13 f 0  336.41  70.08  4681.38   1309.50  4681.38  1309.50  0.00      0.00     336.41  70.08  ?       ?      0.00    70.08  
1 1 1 -11 0   14 o 9  223.46  38.78  1675.52   479.43   1675.52  479.43   0.00      0.00     223.46  38.78  ?       ?      0.00    38.78  
1 1 1 -11 0   15 o 8  94.25   15.62  268.32    81.56    304.59   120.63   237.76    110.71   98.63   21.88  87.01   22.12  11.62   31.11  
1 1 1 -11 0   16 o 15 230.11  25.38  1656.29   329.73   1738.72  468.89   1575.64   463.78   225.61  37.52  212.87  39.40  12.74   54.41  
1 1 1 -11 0   17 o 13 172.45  19.81  909.52    192.56   879.09   276.65   938.12    268.19   162.91  30.71  169.93  28.50  -7.02   41.89  
1 1 1 -11 0   18 o 6  60.53   18.81  111.39    72.24    0.00     0.00     111.39    72.24    ?       ?      60.53   18.81  0.00    18.81  
1 1 1 -11 0   19 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 0   20 f 0  205.01  21.90  1331.74   253.78   1568.47  367.24   1115.36   351.10   213.44  30.87  174.01  36.32  39.43   47.67  
1 1 1 -11 1   1  o 5  242.35  25.66  1739.96   351.60   1624.30  497.63   1855.24   496.85   229.46  39.18  246.77  36.14  -17.30  53.31  
1 1 1 -11 1   2  o 11 534.43  60.85  9273.68   1833.70  8951.42  2593.83  9595.65   2592.65  485.73  96.42  508.69  92.18  -22.96  133.40 
1 1 1 -11 1   3  o 9  207.46  32.67  1307.33   376.23   0.00     0.00     1307.33   376.23   ?       ?      207.46  32.67  0.00    32.67  
1 1 1 -11 1   4  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 1   5  o 1  337.94  55.59  3720.93   1040.93  0.00     0.00     3720.93   1040.93  ?       ?      337.94  55.59  0.00    55.59  
1 1 1 -11 1   6  o 9  184.18  19.96  1000.90   207.69   1029.96  297.74   973.36    289.87   184.16  29.13  178.89  29.23  5.27    41.27  
1 1 1 -11 1   7  o 2  350.10  37.80  3787.63   747.66   3885.55  1058.86  3690.28   1055.84  341.09  56.02  330.91  57.68  10.18   80.40  
1 1 1 -11 1   8  o 10 181.73  19.95  978.76    204.73   943.65   289.00   1014.12   290.06   175.14  29.81  182.12  28.69  -6.98   41.38  
1 1 1 -11 1   9  o 8  289.89  49.01  2800.37   786.62   2800.37  786.62   0.00      0.00     289.89  49.01  ?       ?      0.00    49.01  
1 1 1 -11 1   10 o 4  309.03  54.49  3323.32   931.42   3323.32  931.42   0.00      0.00     309.03  54.49  ?       ?      0.00    54.49  
1 1 1 -11 1   11 o 16 137.42  24.20  579.31    183.95   579.31   183.95   0.00      0.00     137.42  24.20  ?       ?      0.00    24.20  
1 1 1 -11 1   12 o 8  252.59  43.09  2134.26   602.48   2134.26  602.48   0.00      0.00     252.59  43.09  ?       ?      0.00    43.09  
1 1 1 -11 1   13 o 15 124.26  15.65  459.56    109.19   448.31   153.70   471.03    155.15   120.35  23.09  123.57  22.71  -3.22   32.38  
1 1 1 -11 1   14 o 16 174.08  19.80  914.83    194.34   832.55   275.89   995.86    273.79   160.47  31.07  177.77  27.73  -17.30  41.65  
1 1 1 -11 1   15 o 14 180.04  20.20  984.82    205.14   958.54   290.47   1010.97   289.77   171.81  30.57  177.21  29.52  -5.40   42.50  
1 1 1 -11 1   16 o 1  212.12  23.50  1396.23   281.43   1422.77  398.53   1369.82   397.47   205.37  35.06  200.83  35.79  4.54    50.10  
1 1 1 -11 1   17 o 9  117.22  15.45  414.05    101.46   433.34   148.26   397.05    139.16   116.91  22.91  112.00  22.43  4.91    32.06  
1 1 1 -11 1   18 o 12 110.99  24.59  399.90    152.57   399.90   152.57   0.00      0.00     110.99  24.59  ?       ?      0.00    24.59  
1 1 1 -11 1   19 o 13 152.93  26.63  770.91    225.28   0.00     0.00     770.91    225.28   ?       ?      152.93  26.63  0.00    26.63  
1 1 1 -11 1   20 o 8  161.26  17.61  801.76    160.40   958.43   236.59   668.49    218.21   171.06  24.82  139.97  28.13  31.09   37.51  
1 1 1 -11 2   1  o 11 93.24   16.25  258.89    83.84    228.53   117.38   290.51    119.79   86.93   23.12  97.95   21.86  -11.02  31.82  
1 1 1 -11 2   2  o 18 282.04  29.67  2375.43   473.17   2441.99  670.23   2309.28   668.09   280.32  43.02  271.83  44.34  8.49    61.78  
1 1 1 -11 2   3  o 8  303.94  48.70  2925.57   821.08   0.00     0.00     2925.57   821.08   ?       ?      303.94  48.70  0.00    48.70  
1 1 1 -11 2   4  o 15 446.21  81.37  7196.39   2007.47  0.00     0.00     7196.39   2007.47  ?       ?      446.21  81.37  0.00    81.37  
1 1 1 -11 2   5  o 13 155.90  25.70  733.31    221.97   0.00     0.00     733.31    221.97   ?       ?      155.90  25.70  0.00    25.70  
1 1 1 -11 2   6  o 5  271.67  28.82  2218.15   442.65   2218.37  627.28   2217.94   624.73   264.93  42.70  265.01  42.50  -0.08   60.24  
1 1 1 -11 2   7  o 7  274.38  29.31  2274.77   454.56   2203.72  643.56   2345.50   642.12   261.99  44.37  271.52  42.60  -9.54   61.51  
1 1 1 -11 2   8  o 8  389.45  43.79  4858.80   962.13   4748.00  1361.15  4969.44   1360.17  360.13  68.34  370.93  66.31  -10.81  95.22  
1 1 1 -11 2   9  x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 2   10 o 1  305.86  54.19  3271.69   916.69   3271.69  916.69   0.00      0.00     305.86  54.19  ?       ?      0.00    54.19  
1 1 1 -11 2   11 o 18 404.89  105.92 8927.60   2489.70  8927.60  2489.70  0.00      0.00     404.89  105.92 ?       ?      0.00    105.92 
1 1 1 -11 2   12 o 4  356.88  41.45  4208.22   833.36   4172.20  1178.67  4244.22   1178.43  326.31  65.20  330.19  64.48  -3.88   91.70  
1 1 1 -11 2   13 o 7  125.00  15.77  465.64    110.66   435.32   155.50   496.75    157.53   118.21  23.74  126.96  22.43  -8.74   32.66  
1 1 1 -11 2   14 o 17 187.16  20.82  1063.14   219.92   1037.04  311.23   1089.18   310.80   178.96  31.44  184.10  30.47  -5.14   43.79  
1 1 1 -11 2   15 o 14 174.57  19.57  925.13    192.70   901.10   274.78   948.38    270.31   166.59  29.83  171.91  28.38  -5.31   41.17  
1 1 1 -11 2   16 f 0  106.95  14.42  343.05    86.31    396.24   126.20   296.30    118.31   112.98  20.20  96.83   21.81  16.15   29.73  
1 1 1 -11 2   17 o 6  155.59  18.16  737.35    159.15   715.52   226.52   758.64    223.65   147.92  27.69  153.25  26.37  -5.33   38.24  
1 1 1 -11 2   18 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 2   19 o 6  142.45  15.93  616.85    128.05   732.23   188.27   517.53    174.67   151.57  22.30  125.33  25.15  26.24   33.62  
1 1 1 -11 2   20 o 8  131.48  16.17  530.76    119.51   504.63   177.24   552.54    161.84   122.20  26.06  130.52  22.41  -8.32   34.37  
1 1 1 -11 2   21 o 4  168.54  17.62  882.05    167.92   1073.82  244.60   711.09    230.95   180.42  24.23  142.18  29.27  38.24   38.00  
1 1 1 -11 3   1  o 3  167.03  19.03  821.14    179.23   886.67   258.00   760.03    249.16   171.62  27.08  158.24  28.47  13.38   39.30  
1 1 1 -11 3   2  o 4  182.17  20.09  977.67    206.59   818.07   295.73   1129.82   288.74   163.02  32.74  194.25  26.59  -31.23  42.18  
1 1 1 -11 3   3  o 8  252.29  39.87  1974.95   558.26   0.00     0.00     1974.95   558.26   ?       ?      252.29  39.87  0.00    39.87  
1 1 1 -11 3   4  o 17 239.73  37.88  1779.62   503.98   0.00     0.00     1779.62   503.98   ?       ?      239.73  37.88  0.00    37.88  
1 1 1 -11 3   5  o 13 138.05  16.80  561.68    130.39   477.95   190.95   634.83    178.48   124.69  27.42  145.63  22.04  -20.94  35.18  
1 1 1 -11 3   6  o 8  227.67  36.27  1613.91   458.19   0.00     0.00     1613.91   458.19   ?       ?      227.67  36.27  0.00    36.27  
1 1 1 -11 3   7  o 16 375.28  41.63  4459.42   881.79   4432.50  1247.55  4486.30   1246.54  353.48  63.83  356.24  63.27  -2.76   89.87  
1 1 1 -11 3   8  o 16 302.12  51.90  3091.58   867.64   3091.58  867.64   0.00      0.00     302.12  51.90  ?       ?      0.00    51.90  
1 1 1 -11 3   9  o 1  166.76  27.70  858.05    255.87   858.05   255.87   0.00      0.00     166.76  27.70  ?       ?      0.00    27.70  
1 1 1 -11 3   10 f 0  314.83  57.49  3573.21   1000.76  3573.21  1000.76  0.00      0.00     314.83  57.49  ?       ?      0.00    57.49  
1 1 1 -11 3   11 o 14 360.73  77.09  5543.44   1548.04  5543.44  1548.04  0.00      0.00     360.73  77.09  ?       ?      0.00    77.09  
1 1 1 -11 3   12 f 0  368.03  43.47  4570.12   900.78   4649.26  1274.52  4491.14   1273.26  337.71  68.09  329.58  69.49  8.13    97.29  
1 1 1 -11 3   13 o 19 285.42  32.40  2606.74   521.45   2494.21  738.28   2718.77   736.62   260.54  51.19  275.53  48.33  -14.99  70.40  
1 1 1 -11 3   14 o 6  111.69  15.36  374.00    95.90    360.05   136.28   387.69    134.99   107.03  22.87  111.53  21.87  -4.49   31.64  
1 1 1 -11 3   15 o 14 230.59  25.55  1669.66   332.51   1734.78  470.75   1604.82   469.73   224.36  37.90  213.92  39.71  10.44   54.89  
1 1 1 -11 3   16 f 0  104.25  15.27  328.38    88.66    326.12   125.84   330.60    124.92   101.34  22.24  102.16  21.95  -0.82   31.25  
1 1 1 -11 3   17 o 19 113.67  22.95  413.23    144.60   413.23   144.60   0.00      0.00     113.67  22.95  ?       ?      0.00    22.95  
1 1 1 -11 3   18 o 18 164.37  29.33  909.00    266.56   0.00     0.00     909.00    266.56   ?       ?      164.37  29.33  0.00    29.33  
1 1 1 -11 3   19 o 19 57.76   20.03  97.18     81.04    0.00     0.00     97.18     81.04    ?       ?      57.76   20.03  0.00    20.03  
1 1 1 -11 3   20 o 11 102.07  19.77  334.49    111.69   0.00     0.00     334.49    111.69   ?       ?      102.07  19.77  0.00    19.77  
1 1 1 -11 4   1  o 5  287.71  30.64  2488.50   498.24   2174.06  705.67   2801.06   703.56   259.85  49.10  299.80  42.03  -39.95  64.64  
1 1 1 -11 4   2  o 17 210.38  22.62  1311.03   268.91   1162.09  382.69   1456.29   377.93   193.53  35.76  219.09  30.91  -25.55  47.27  
1 1 1 -11 4   3  o 9  277.31  44.71  2443.09   687.55   0.00     0.00     2443.09   687.55   ?       ?      277.31  44.71  0.00    44.71  
1 1 1 -11 4   4  x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 4   5  o 16 244.98  26.15  1799.85   362.03   1804.54  514.44   1795.25   509.57   239.48  38.74  239.01  38.44  0.47    54.58  
1 1 1 -11 4   6  o 1  346.67  38.01  3757.43   743.98   3798.74  1053.17  3716.28   1051.14  332.56  57.23  328.24  57.90  4.31    81.41  
1 1 1 -11 4   7  o 4  270.69  29.17  2233.42   446.11   2045.06  630.35   2422.44   631.43   248.82  45.82  274.43  41.36  -25.61  61.73  
1 1 1 -11 4   8  o 14 310.30  54.95  3368.25   943.04   3368.25  943.04   0.00      0.00     310.30  54.95  ?       ?      0.00    54.95  
1 1 1 -11 4   9  o 9  153.93  25.46  728.33    217.15   728.33   217.15   0.00      0.00     153.93  25.46  ?       ?      0.00    25.46  
1 1 1 -11 4   10 o 7  87.60   14.69  229.78    71.26    177.32   97.52    289.86    104.36   76.13   21.42  97.47   19.33  -21.34  28.85  
1 1 1 -11 4   11 o 8  268.40  47.31  2502.05   702.39   2502.05  702.39   0.00      0.00     268.40  47.31  ?       ?      0.00    47.31  
1 1 1 -11 4   12 o 18 238.25  26.65  1758.47   358.20   1387.87  505.62   2131.90   507.54   198.05  45.44  255.75  35.53  -57.71  57.68  
1 1 1 -11 4   13 o 14 317.74  37.49  3370.21   670.66   3220.22  948.20   3520.37   948.73   281.15  60.54  299.17  57.33  -18.03  83.38  
1 1 1 -11 4   14 o 14 154.74  17.58  721.79    153.43   713.62   218.33   729.77    215.64   149.63  26.38  151.73  25.67  -2.10   36.81  
1 1 1 -11 4   15 o 6  39.63   15.82  25.38     54.29    50.31    81.86    5.80      72.54    50.15   19.61  41.25   17.54  8.90    26.31  
1 1 1 -11 4   16 o 5  173.88  19.37  926.98    190.03   1023.23  270.19   832.76    267.32   177.49  27.40  157.54  30.66  19.94   41.12  
1 1 1 -11 4   17 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 4   18 o 14 68.06   15.96  144.63    61.27    115.73   94.68    165.47    80.37    62.55   21.65  72.13   19.11  -9.58   28.88  
1 1 1 -11 4   19 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 4   20 o 8  114.17  22.25  429.84    140.58   0.00     0.00     429.84    140.58   ?       ?      114.17  22.25  0.00    22.25  
1 1 1 -11 5   1  o 18 85.39   18.16  220.38    86.27    234.60   122.72   206.48    121.31   87.77   23.77  82.80   24.08  4.97    33.84  
1 1 1 -11 5   2  o 16 81.24   18.19  199.89    82.70    171.50   117.92   227.37    116.01   76.51   24.07  86.37   22.99  -9.86   33.29  
1 1 1 -11 5   3  o 8  178.32  29.61  975.64    292.51   0.00     0.00     975.64    292.51   ?       ?      178.32  29.61  0.00    29.61  
1 1 1 -11 5   4  o 1  173.56  28.68  924.04    275.76   0.00     0.00     924.04    275.76   ?       ?      173.56  28.68  0.00    28.68  
1 1 1 -11 5   5  o 1  186.80  30.27  1077.81   313.47   0.00     0.00     1077.81   313.47   ?       ?      186.80  30.27  0.00    30.27  
1 1 1 -11 5   6  o 18 233.88  25.18  1649.85   332.70   1553.50  472.70   1744.44   468.35   219.88  38.87  235.06  35.84  -15.18  52.87  
1 1 1 -11 5   7  o 13 276.93  30.00  2360.48   469.27   2111.47  662.76   2610.82   664.54   249.35  48.04  282.61  42.26  -33.27  63.98  
1 1 1 -11 5   8  o 6  351.63  70.14  4891.34   1366.22  4891.34  1366.22  0.00      0.00     351.63  70.14  ?       ?      0.00    70.14  
1 1 1 -11 5   9  o 2  378.38  88.32  6750.34   1883.31  6750.34  1883.31  0.00      0.00     378.38  88.32  ?       ?      0.00    88.32  
1 1 1 -11 5   10 o 11 254.87  27.88  2009.21   401.33   1779.20  566.32   2241.25   568.81   227.31  44.99  260.76  39.21  -33.45  59.68  
1 1 1 -11 5   11 o 19 343.02  40.30  3934.35   778.42   3432.70  1100.30  4437.01   1101.41  284.25  68.29  340.11  58.52  -55.87  89.93  
1 1 1 -11 5   12 o 10 273.65  30.77  2390.09   474.97   2198.01  671.11   2582.87   672.32   244.05  49.60  270.42  44.88  -26.37  66.89  
1 1 1 -11 5   13 o 19 190.59  21.02  1110.08   226.22   1021.99  318.46   1199.80   321.41   175.57  32.80  192.52  30.06  -16.95  44.50  
1 1 1 -11 5   14 o 16 164.57  18.61  823.16    172.76   723.08   242.15   926.89    246.53   148.18  29.50  170.54  26.00  -22.35  39.33  
1 1 1 -11 5   15 o 1  159.68  18.61  778.85    167.37   585.73   233.10   984.36    240.46   131.18  31.38  176.18  24.43  -44.99  39.77  
1 1 1 -11 5   16 o 9  202.60  37.22  1469.86   416.90   1469.86  416.90   0.00      0.00     202.60  37.22  ?       ?      0.00    37.22  
1 1 1 -11 5   17 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 5   18 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 5   19 o 2  87.55   20.87  251.36    103.37   0.00     0.00     251.36    103.37   ?       ?      87.55   20.87  0.00    20.87  
1 1 1 -11 5   20 o 9  41.96   17.51  20.30     70.20    0.00     0.00     20.30     70.20    ?       ?      41.96   17.51  0.00    17.51  
1 1 1 -11 6   1  o 1  455.18  53.75  6985.18   1377.35  6691.91  1947.87  7278.45   1947.87  400.38  87.22  425.16  82.79  -24.78  120.25 
1 1 1 -11 6   2  o 3  408.57  46.83  5459.15   1078.59  5367.48  1525.63  5550.76   1525.08  374.07  73.67  382.66  72.07  -8.59   103.06 
1 1 1 -11 6   3  o 10 207.96  22.59  1293.97   265.32   1189.23  375.91   1397.93   374.53   193.93  35.06  212.29  31.70  -18.36  47.26  
1 1 1 -11 6   4  x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 6   5  o 18 405.92  94.76  7768.65   2167.80  0.00     0.00     7768.65   2167.80  ?       ?      405.92  94.76  0.00    94.76  
1 1 1 -11 6   6  o 12 202.56  22.24  1233.49   254.41   1175.92  359.78   1291.07   359.80   192.29  33.83  202.67  31.98  -10.38  46.55  
1 1 1 -11 6   7  o 16 250.09  27.18  1916.45   383.96   1642.09  541.15   2194.59   544.87   220.31  44.33  260.85  37.46  -40.55  58.03  
1 1 1 -11 6   8  o 19 245.91  26.73  1856.19   371.32   1788.60  524.01   1924.36   526.24   231.92  40.85  241.97  39.23  -10.05  56.64  
1 1 1 -11 6   9  o 14 123.62  22.17  470.06    151.53   470.06   151.53   0.00      0.00     123.62  22.17  ?       ?      0.00    22.17  
1 1 1 -11 6   10 o 11 350.20  89.78  6497.47   1813.13  6497.47  1813.13  0.00      0.00     350.20  89.78  ?       ?      0.00    89.78  
1 1 1 -11 6   11 o 8  97.07   14.56  282.41    78.63    294.75   107.82   268.40    114.91   97.62   19.91  92.53   21.96  5.09    29.65  
1 1 1 -11 6   12 o 3  306.58  36.17  3155.80   624.26   2983.34  882.12   3328.82   883.54   268.06  58.93  289.51  55.18  -21.45  80.73  
1 1 1 -11 6   13 o 2  147.05  16.86  652.37    139.75   637.56   195.02   668.00    200.36   141.49  24.92  144.85  25.00  -3.37   35.30  
1 1 1 -11 6   14 o 17 193.69  21.55  1163.77   235.56   984.38   330.98   1347.90   335.32   167.81  35.47  202.20  29.78  -34.39  46.31  
1 1 1 -11 6   15 o 10 195.93  22.04  1202.39   243.58   1250.96  342.73   1152.83   346.24   191.29  32.36  181.57  34.48  9.73    47.29  
1 1 1 -11 6   16 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 6   17 o 11 168.92  31.48  1001.70   294.08   0.00     0.00     1001.70   294.08   ?       ?      168.92  31.48  0.00    31.48  
1 1 1 -11 6   18 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 6   19 o 4  117.17  23.66  463.31    153.68   0.00     0.00     463.31    153.68   ?       ?      117.17  23.66  0.00    23.66  
1 1 1 -11 6   20 o 15 53.19   15.12  89.05     48.33    75.02    58.56    119.02    85.56    50.14   17.04  61.30   20.59  -11.16  26.73  
1 1 1 -11 7   1  o 10 87.95   24.42  238.29    127.64   238.29   127.64   0.00      0.00     87.95   24.42  ?       ?      0.00    24.42  
1 1 1 -11 7   2  o 1  175.46  20.16  919.86    199.34   1023.99  279.39   811.89    284.49   182.34  27.55  160.08  32.08  22.25   42.28  
1 1 1 -11 7   3  o 5  399.16  46.90  5342.84   1054.28  5098.55  1489.99  5587.77   1491.95  351.67  76.02  375.01  71.92  -23.34  104.65 
1 1 1 -11 7   4  o 13 322.55  36.25  3310.52   659.61   3453.00  933.00   3168.13   932.66   312.27  54.00  295.69  57.01  16.59   78.52  
1 1 1 -11 7   5  o 7  123.62  24.00  472.32    164.17   0.00     0.00     472.32    164.17   ?       ?      123.62  24.00  0.00    24.00  
1 1 1 -11 7   6  o 10 327.54  64.62  4184.58   1171.82  0.00     0.00     4184.58   1171.82  ?       ?      327.54  64.62  0.00    64.62  
1 1 1 -11 7   7  o 3  70.34   23.25  143.99    109.11   143.99   109.11   0.00      0.00     70.34   23.25  ?       ?      0.00    23.25  
1 1 1 -11 7   8  o 4  186.13  20.38  1044.80   214.20   942.51   298.71   1153.09   307.33   171.16  31.56  191.29  28.89  -20.12  42.79  
1 1 1 -11 7   9  o 5  76.57   18.48  180.98    80.30    180.98   80.30    0.00      0.00     76.57   18.48  ?       ?      0.00    18.48  
1 1 1 -11 7   10 o 2  142.03  23.94  630.84    188.29   630.84   188.29   0.00      0.00     142.03  23.94  ?       ?      0.00    23.94  
1 1 1 -11 7   11 o 5  165.41  18.49  828.54    172.55   726.03   239.48   939.19    248.82   149.29  28.99  172.15  25.99  -22.86  38.93  
1 1 1 -11 7   12 o 16 190.29  21.04  1115.45   225.98   1112.22  318.64   1118.73   320.55   182.77  31.51  183.23  31.62  -0.46   44.64  
1 1 1 -11 7   13 o 7  108.44  20.24  368.48    121.39   368.48   121.39   0.00      0.00     108.44  20.24  ?       ?      0.00    20.24  
1 1 1 -11 7   14 o 15 82.89   14.18  209.06    65.06    211.42   85.11    205.74    100.92   81.99   18.52  80.14   21.50  1.85    28.37  
1 1 1 -11 7   15 o 15 209.45  40.43  1661.33   468.55   1661.33  468.55   0.00      0.00     209.45  40.43  ?       ?      0.00    40.43  
1 1 1 -11 7   16 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 7   17 o 3  123.66  15.22  468.38    105.76   459.81   143.81   478.48    156.09   118.74  21.90  120.16  23.47  -1.42   32.10  
1 1 1 -11 7   18 o 8  77.43   22.53  201.42    106.15   0.00     0.00     201.42    106.15   ?       ?      77.43   22.53  0.00    22.53  
1 1 1 -11 7   19 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 8   1  o 12 290.79  32.28  2651.54   529.81   2685.45  749.66   2617.70   748.88   278.80  48.61  274.50  49.34  4.29    69.26  
1 1 1 -11 8   2  o 10 172.94  19.74  896.02    192.49   879.50   273.15   912.32    271.32   167.21  29.53  170.77  28.69  -3.56   41.18  
1 1 1 -11 8   3  o 12 333.69  38.12  3615.68   717.22   3550.71  1013.32  3680.90   1015.27  306.87  59.67  314.10  58.46  -7.23   83.53  
1 1 1 -11 8   4  o 13 359.49  42.05  4316.17   851.48   4045.48  1203.17  4587.75   1205.17  313.69  68.72  342.40  63.66  -28.71  93.67  
1 1 1 -11 8   5  o 16 345.71  40.34  3975.91   785.58   3784.93  1109.89  4167.64   1112.07  305.93  65.19  326.90  61.52  -20.97  89.63  
1 1 1 -11 8   6  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 8   7  o 14 81.71   25.44  206.01    132.09   0.00     0.00     206.01    132.09   ?       ?      81.71   25.44  0.00    25.44  
1 1 1 -11 8   8  f 0  308.74  36.47  3177.04   634.00   3281.46  896.07   3072.38   897.14   288.82  56.07  275.74  58.49  13.08   81.02  
1 1 1 -11 8   9  o 4  70.57   22.73  150.60    104.65   0.00     0.00     150.60    104.65   ?       ?      70.57   22.73  0.00    22.73  
1 1 1 -11 8   10 o 1  149.68  25.64  715.24    212.43   715.24   212.43   0.00      0.00     149.68  25.64  ?       ?      0.00    25.64  
1 1 1 -11 8   11 o 1  270.71  60.70  3286.78   919.96   3286.78  919.96   0.00      0.00     270.71  60.70  ?       ?      0.00    60.70  
1 1 1 -11 8   12 o 5  179.26  20.17  992.58    204.00   909.08   283.25   1082.58   294.06   163.83  31.26  180.65  29.36  -16.83  42.89  
1 1 1 -11 8   13 o 16 95.74   14.30  277.83    76.20    300.46   101.39   248.46    115.51   97.96   18.71  87.51   22.78  10.44   29.48  
1 1 1 -11 8   14 o 13 145.46  16.55  646.17    135.77   568.25   189.35   728.62    194.78   130.71  26.15  150.42  23.31  -19.71  35.03  
1 1 1 -11 8   15 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 8   16 o 5  147.28  17.01  672.36    141.21   612.73   194.08   739.44    205.85   134.16  26.14  148.62  25.01  -14.46  36.18  
1 1 1 -11 8   17 o 16 107.12  14.55  353.28    87.14    379.42   115.05   318.10    133.45   108.55  19.16  96.22   24.19  12.32   30.86  
1 1 1 -11 8   18 o 3  129.15  26.12  586.84    186.98   0.00     0.00     586.84    186.98   ?       ?      129.15  26.12  0.00    26.12  
1 1 1 -11 9   1  o 5  119.91  17.53  432.96    117.12   513.98   170.71   360.90    160.99   128.52  24.02  106.60  26.44  21.91   35.72  
1 1 1 -11 9   2  o 1  156.76  18.90  739.55    166.69   793.98   238.81   687.83    232.76   158.86  27.16  146.94  28.62  11.93   39.46  
1 1 1 -11 9   3  o 16 360.36  43.90  4490.31   889.48   4503.80  1258.33  4476.85   1257.50  321.75  70.11  320.41  70.30  1.34    99.29  
1 1 1 -11 9   4  o 19 191.78  21.42  1119.26   231.81   1036.50  329.38   1200.48   326.31   177.55  33.54  193.49  30.38  -15.94  45.25  
1 1 1 -11 9   5  o 7  185.97  20.81  1052.09   218.38   928.41   309.63   1174.50   308.04   167.49  33.37  191.93  28.85  -24.44  44.12  
1 1 1 -11 9   6  o 18 274.17  31.22  2429.69   482.62   2287.81  682.58   2571.53   682.48   245.94  50.05  265.55  46.46  -19.61  68.29  
1 1 1 -11 9   7  o 9  135.78  26.17  590.51    196.59   0.00     0.00     590.51    196.59   ?       ?      135.78  26.17  0.00    26.17  
1 1 1 -11 9   8  o 11 217.80  40.64  1694.08   489.41   0.00     0.00     1694.08   489.41   ?       ?      217.80  40.64  0.00    40.64  
1 1 1 -11 9   9  o 18 226.74  26.31  1641.00   336.08   1719.16  472.30   1560.82   478.33   220.10  38.80  206.30  41.82  13.80   57.05  
1 1 1 -11 9   10 o 16 123.82  16.32  465.37    113.17   428.66   146.93   518.92    177.46   115.86  22.90  126.46  25.33  -10.60  34.15  
1 1 1 -11 9   11 o 8  140.58  24.64  638.56    191.64   638.56   191.64   0.00      0.00     140.58  24.64  ?       ?      0.00    24.64  
1 1 1 -11 9   12 o 12 209.39  40.26  1652.37   466.42   1652.37  466.42   0.00      0.00     209.39  40.26  ?       ?      0.00    40.26  
1 1 1 -11 9   13 o 6  89.85   24.07  267.91    126.61   0.00     0.00     267.91    126.61   ?       ?      89.85   24.07  0.00    24.07  
1 1 1 -11 9   14 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 9   15 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 9   16 o 1  93.74   14.80  272.84    77.02    250.40   101.27   303.62    118.61   86.89   20.61  94.98   22.16  -8.09   30.27  
1 1 1 -11 9   17 o 4  108.29  14.91  364.59    90.24    397.51   122.76   325.88    133.11   109.86  20.21  96.66   24.08  13.20   31.44  
1 1 1 -11 10  1  o 18 126.23  16.66  479.70    117.78   521.53   163.38   434.46    169.94   129.25  22.86  116.41  26.08  12.84   34.68  
1 1 1 -11 10  2  o 14 144.20  17.61  627.42    142.74   701.78   199.43   549.30    204.41   149.69  24.02  130.11  28.18  19.59   37.03  
1 1 1 -11 10  3  o 8  429.67  70.63  8549.45   1681.69  8303.98  2377.49  8795.24   2379.05  297.98  107.96 314.95  108.55 -16.97  153.10 
1 1 1 -11 10  4  o 13 91.78   16.82  257.77    85.36    225.35   114.14   298.90    128.57   84.29   22.97  96.84   23.39  -12.55  32.78  
1 1 1 -11 10  5  o 10 53.43   18.00  81.29     65.38    70.33    86.61    95.82     99.70    54.33   20.44  60.44   22.08  -6.11   30.09  
1 1 1 -11 10  6  o 3  213.34  24.12  1428.52   290.26   1414.12  407.96   1443.28   413.07   201.85  36.55  203.88  36.64  -2.03   51.75  
1 1 1 -11 10  7  o 13 124.49  25.16  500.69    173.59   0.00     0.00     500.69    173.59   ?       ?      124.49  25.16  0.00    25.16  
1 1 1 -11 10  8  o 14 97.54   23.81  308.48    132.15   0.00     0.00     308.48    132.15   ?       ?      97.54   23.81  0.00    23.81  
1 1 1 -11 10  9  o 6  210.04  40.36  1637.88   468.92   0.00     0.00     1637.88   468.92   ?       ?      210.04  40.36  0.00    40.36  
1 1 1 -11 10  10 o 18 141.12  18.24  614.57    144.30   727.26   203.10   499.70    205.05   149.83  24.46  120.36  29.83  29.48   38.57  
1 1 1 -11 10  11 o 2  151.64  18.13  710.85    154.69   685.69   212.73   739.07    225.33   143.15  26.87  148.27  27.49  -5.12   38.44  
1 1 1 -11 10  12 o 6  86.07   20.43  239.82    99.40    239.82   99.40    0.00      0.00     86.07   20.43  ?       ?      0.00    20.43  
1 1 1 -11 10  13 o 4  90.22   20.94  266.49    106.35   266.49   106.35   0.00      0.00     90.22   20.94  ?       ?      0.00    20.94  
1 1 1 -11 10  14 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 10  15 o 8  52.16   21.38  51.44     102.12   0.00     0.00     51.44     102.12   ?       ?      52.16   21.38  0.00    21.38  
1 1 1 -11 10  16 o 4  66.80   19.50  147.58    79.38    193.72   109.77   97.03     114.91   74.99   23.17  59.64   23.26  15.36   32.83  
1 1 1 -11 11  1  o 1  284.37  66.45  3798.54   1065.23  3798.54  1065.23  0.00      0.00     284.37  66.45  ?       ?      0.00    66.45  
1 1 1 -11 11  2  o 18 65.89   22.35  127.57    100.81   127.57   100.81   0.00      0.00     65.89   22.35  ?       ?      0.00    22.35  
1 1 1 -11 11  3  o 9  226.93  26.31  1644.10   336.36   1748.55  476.67   1540.50   474.70   221.93  38.83  204.93  41.77  17.00   57.03  
1 1 1 -11 11  4  o 1  61.19   19.98  111.83    80.71    108.36   124.63   114.34    105.92   65.06   24.51  63.93   22.83  1.13    33.50  
1 1 1 -11 11  5  o 9  127.55  17.64  498.00    125.71   505.21   183.28   491.59    172.74   123.98  26.55  122.93  25.32  1.05    36.69  
1 1 1 -11 11  6  o 15 99.76   18.49  310.13    101.98   446.94   152.45   199.33    137.19   117.86  23.36  79.23   26.06  38.63   35.00  
1 1 1 -11 11  7  o 1  200.53  23.98  1284.36   270.64   1438.26  384.82   1133.75   380.70   202.40  34.35  174.52  38.98  27.88   51.96  
1 1 1 -11 11  8  o 10 105.50  17.46  345.09    102.06   368.50   151.28   325.54    138.26   105.26  25.34  99.26   24.43  6.00    35.20  
1 1 1 -11 11  9  o 11 126.29  18.04  495.42    127.06   541.98   184.91   453.77    174.89   127.24  26.19  115.74  26.84  11.50   37.50  
1 1 1 -11 11  10 o 2  159.43  30.56  891.78    269.55   0.00     0.00     891.78    269.55   ?       ?      159.43  30.56  0.00    30.56  
1 1 1 -11 11  11 o 3  167.27  32.90  1022.49   304.66   0.00     0.00     1022.49   304.66   ?       ?      167.27  32.90  0.00    32.90  
1 1 1 -11 11  12 o 11 144.45  18.45  659.32    149.54   594.76   214.14   720.77    208.91   128.21  29.68  144.99  26.06  -16.78  39.50  
1 1 1 -11 11  13 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 11  14 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 12  1  o 2  73.45   20.70  170.89    91.00    187.16   146.53   160.66    116.11   77.86   26.93  72.19   23.99  5.67    36.07  
1 1 1 -11 12  2  o 7  269.63  82.04  4930.57   1382.97  4930.57  1382.97  0.00      0.00     269.63  82.04  ?       ?      0.00    82.04  
1 1 1 -11 12  3  o 2  140.87  29.47  672.65    230.67   672.65   230.67   0.00      0.00     140.87  29.47  ?       ?      0.00    29.47  
1 1 1 -11 12  4  o 9  109.18  27.01  400.95    168.38   400.95   168.38   0.00      0.00     109.18  27.01  ?       ?      0.00    27.01  
1 1 1 -11 12  5  o 19 222.76  27.07  1636.89   339.04   1812.04  482.83   1466.52   476.20   219.30  39.82  190.92  44.30  28.38   59.57  
1 1 1 -11 12  6  o 12 73.71   22.89  174.87    107.01   0.00     0.00     174.87    107.01   ?       ?      73.71   22.89  0.00    22.89  
1 1 1 -11 12  7  o 7  68.34   22.42  147.31    101.53   0.00     0.00     147.31    101.53   ?       ?      68.34   22.42  0.00    22.42  
1 1 1 -11 12  8  o 11 60.99   19.41  116.09    76.49    123.00   127.99   112.25    95.39    66.00   24.84  61.49   21.70  4.51    32.99  
1 1 1 -11 12  9  o 17 119.32  18.02  448.53    119.56   491.66   178.74   413.60    160.84   119.07  26.80  109.51  25.98  9.56    37.32  
1 1 1 -11 12  10 o 17 126.18  18.01  503.37    126.78   463.96   187.47   536.59    172.10   113.30  28.77  125.52  24.76  -12.22  37.96  
1 1 1 -11 12  11 o 16 71.68   23.51  171.81    111.63   0.00     0.00     171.81    111.63   ?       ?      71.68   23.51  0.00    23.51  
1 1 1 -11 12  12 o 6  117.25  26.40  489.46    173.43   0.00     0.00     489.46    173.43   ?       ?      117.25  26.40  0.00    26.40  
1 1 1 -11 13  1  o 5  229.81  53.29  2423.51   689.27   0.00     0.00     2423.51   689.27   ?       ?      229.81  53.29  0.00    53.29  
1 1 1 -11 13  2  f 0  68.32   21.16  148.49    91.52    126.13   140.19   165.10    120.82   67.91   25.90  72.25   24.47  -4.34   35.63  
1 1 1 -11 13  3  o 12 54.70   23.75  11.77     138.53   11.77    138.53   0.00      0.00     54.70   23.75  ?       ?      0.00    23.75  
1 1 1 -11 13  4  o 3  218.60  52.36  2254.16   648.35   2254.16  648.35   0.00      0.00     218.60  52.36  ?       ?      0.00    52.36  
1 1 1 -11 13  5  x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -11 13  6  o 12 172.62  22.23  969.20    215.21   1103.73  314.12   850.20    295.44   173.36  32.76  148.91  35.13  24.45   48.04  
1 1 1 -11 13  7  o 17 92.05   19.77  275.80    101.33   322.77   163.89   246.73    128.93   94.94   28.10  84.71   24.88  10.23   37.53  
1 1 1 -11 13  8  o 17 211.33  28.05  1565.73   331.91   2017.79  475.86   1137.46   463.17   223.98  38.39  149.76  47.78  74.22   61.29  
1 1 1 -11 13  9  o 2  121.72  20.16  482.42    135.92   702.19   209.52   322.75    178.59   141.44  26.79  93.16   29.66  48.28   39.97  
1 1 1 -10 -14 1  o 6  222.82  42.00  1775.41   517.48   1775.41  517.48   0.00      0.00     222.82  42.00  ?       ?      0.00    42.00  
1 1 1 -10 -14 2  o 1  182.35  34.19  1121.05   344.80   1121.05  344.80   0.00      0.00     182.35  34.19  ?       ?      0.00    34.19  
1 1 1 -10 -14 3  x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 -14 4  x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 -13 1  o 11 208.28  23.84  1334.43   279.90   1254.29  400.68   1410.81   391.16   192.89  37.54  207.51  34.01  -14.62  50.65  
1 1 1 -10 -13 2  o 9  64.78   20.01  126.20    81.90    72.46    134.41   157.94    103.29   62.54   24.92  72.14   22.50  -9.60   33.58  
1 1 1 -10 -13 3  x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 -13 4  o 16 230.22  26.18  1653.74   339.91   1572.42  485.48   1731.95   476.06   212.63  41.26  226.34  37.98  -13.72  56.08  
1 1 1 -10 -13 5  o 18 167.00  19.49  845.31    183.29   877.60   268.06   816.96    251.19   165.00  29.38  159.60  28.46  5.40    40.90  
1 1 1 -10 -13 6  o 3  96.71   17.57  286.05    93.94    412.26   149.70   204.07    120.65   114.29  23.60  80.74   24.16  33.54   33.77  
1 1 1 -10 -13 7  o 13 368.39  46.92  4961.23   969.76   5223.26  1374.26  4701.34   1368.64  327.86  74.69  301.37  78.38  26.49   108.27 
1 1 1 -10 -13 8  o 10 200.86  22.95  1245.58   259.88   1240.04  373.77   1250.76   361.59   191.87  35.23  193.90  33.71  -2.03   48.76  
1 1 1 -10 -12 1  o 15 54.12   18.84  78.80     71.76    120.14   113.55   51.31     92.60    66.73   23.66  52.84   20.80  13.89   31.51  
1 1 1 -10 -12 2  o 4  130.58  27.02  538.42    195.89   538.42   195.89   0.00      0.00     130.58  27.02  ?       ?      0.00    27.02  
1 1 1 -10 -12 3  o 7  85.34   22.18  226.58    109.66   0.00     0.00     226.58    109.66   ?       ?      85.34   22.18  0.00    22.18  
1 1 1 -10 -12 4  f 0  133.34  17.20  532.50    128.61   533.05   192.02   532.06    173.19   129.94  26.64  130.89  23.93  -0.95   35.81  
1 1 1 -10 -12 5  o 11 145.74  17.76  636.64    145.51   703.43   213.63   578.84    198.75   150.06  25.72  135.50  26.50  14.56   36.93  
1 1 1 -10 -12 6  o 15 107.07  16.69  345.54    99.23    398.40   152.66   306.87    130.58   112.59  24.33  98.87   23.38  13.72   33.74  
1 1 1 -10 -12 7  f 0  73.50   18.51  166.66    78.03    144.62   126.24   180.29    99.26    71.58   24.99  76.31   21.66  -4.73   33.07  
1 1 1 -10 -12 8  o 17 162.25  18.59  793.38    170.03   899.72   249.04   700.54    232.70   169.04  26.54  147.81  28.46  21.23   38.91  
1 1 1 -10 -12 9  o 19 282.42  32.85  2597.82   522.61   2397.41  688.97   2869.37   802.00   254.01  49.02  273.18  53.05  -19.18  72.24  
1 1 1 -10 -12 10 o 4  213.01  23.25  1399.87   279.65   1566.98  398.51   1237.72   392.54   218.46  32.79  190.34  37.26  28.12   49.63  
1 1 1 -10 -11 1  o 3  273.12  29.83  2308.42   460.14   2347.30  651.77   2269.78   649.69   264.47  44.51  259.34  45.29  5.12    63.50  
1 1 1 -10 -11 2  x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 -11 3  o 12 55.28   19.13  82.53     73.88    42.93    117.23   108.62    95.17    56.47   23.00  62.90   21.71  -6.43   31.62  
1 1 1 -10 -11 4  o 8  213.38  23.77  1382.13   286.21   1290.45  408.12   1470.86   401.49   198.72  37.14  214.67  33.69  -15.94  50.14  
1 1 1 -10 -11 5  o 14 246.71  27.07  1873.02   377.09   1899.15  535.95   1847.40   530.66   239.15  40.48  235.64  40.70  3.51    57.40  
1 1 1 -10 -11 6  f 0  127.62  16.68  486.31    119.31   515.61   176.54   461.67    161.86   128.74  24.79  121.94  23.98  6.80    34.49  
1 1 1 -10 -11 7  o 12 121.01  16.22  437.34    109.85   476.73   165.81   406.53    146.66   123.78  24.20  114.44  23.12  9.33    33.47  
1 1 1 -10 -11 8  o 6  172.36  19.86  894.75    192.95   859.48   279.31   926.94    266.85   163.77  30.84  171.70  28.04  -7.93   41.68  
1 1 1 -10 -11 9  f 0  181.93  21.33  1004.44   218.50   1061.29  321.85   955.84    297.60   181.29  32.10  172.36  31.23  8.93    44.78  
1 1 1 -10 -11 10 o 13 308.77  33.06  3074.63   576.89   3085.75  760.05   3059.52   886.06   294.68  46.47  280.21  57.02  14.47   73.56  
1 1 1 -10 -11 11 o 2  280.38  29.35  2496.05   465.42   2646.54  632.11   2317.86   687.83   277.00  40.99  249.37  49.79  27.64   64.49  
1 1 1 -10 -11 12 o 4  84.75   20.66  224.81    99.59    204.10   171.53   235.35    122.32   82.99   29.11  86.23   23.89  -3.24   37.66  
1 1 1 -10 -10 1  x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 -10 2  o 8  167.62  27.93  865.38    259.34   0.00     0.00     865.38    259.34   ?       ?      167.62  27.93  0.00    27.93  
1 1 1 -10 -10 3  o 17 236.15  38.87  1790.61   508.58   0.00     0.00     1790.61   508.58   ?       ?      236.15  38.87  0.00    38.87  
1 1 1 -10 -10 4  o 16 204.78  33.40  1321.01   379.16   0.00     0.00     1321.01   379.16   ?       ?      204.78  33.40  0.00    33.40  
1 1 1 -10 -10 5  o 13 226.86  37.52  1656.20   471.51   0.00     0.00     1656.20   471.51   ?       ?      226.86  37.52  0.00    37.52  
1 1 1 -10 -10 6  o 18 121.54  22.93  453.76    154.09   0.00     0.00     453.76    154.09   ?       ?      121.54  22.93  0.00    22.93  
1 1 1 -10 -10 7  x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 -10 8  o 10 294.93  54.28  3146.28   885.10   0.00     0.00     3146.28   885.10   ?       ?      294.93  54.28  0.00    54.28  
1 1 1 -10 -10 9  o 19 171.19  29.59  925.40    280.25   0.00     0.00     925.40    280.25   ?       ?      171.19  29.59  0.00    29.59  
1 1 1 -10 -10 10 o 16 239.29  41.64  1936.70   551.30   0.00     0.00     1936.70   551.30   ?       ?      239.29  41.64  0.00    41.64  
1 1 1 -10 -10 11 o 5  195.97  30.80  1225.30   335.03   1633.47  1088.36  1182.57   352.13   185.42  71.79  190.86  33.35  -5.44   79.16  
1 1 1 -10 -10 12 o 8  255.36  37.30  2171.67   530.65   3158.28  1347.63  1990.63   577.28   238.18  81.71  238.36  43.80  -0.18   92.71  
1 1 1 -10 -10 13 o 3  179.83  31.33  1053.21   311.64   0.00     0.00     1053.21   311.64   ?       ?      179.83  31.33  0.00    31.33  
1 1 1 -10 -10 14 o 3  292.67  43.48  3048.69   708.27   3679.00  1461.60  2855.26   809.69   238.57  84.87  269.14  54.28  -30.57  100.74 
1 1 1 -10 -9  1  x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 -9  2  o 9  231.16  37.18  1678.62   476.70   0.00     0.00     1678.62   476.70   ?       ?      231.16  37.18  0.00    37.18  
1 1 1 -10 -9  3  o 11 215.28  23.57  1385.33   286.50   1190.03  404.91   1581.16   405.45   193.49  37.81  226.57  32.07  -33.08  49.58  
1 1 1 -10 -9  4  o 16 179.42  19.62  954.52    198.84   953.43   282.92   955.59    279.51   176.13  28.99  176.50  28.56  -0.37   40.69  
1 1 1 -10 -9  5  o 4  183.43  20.35  1000.60   210.67   886.72   298.50   1113.64   297.38   168.34  32.06  190.87  27.97  -22.52  42.54  
1 1 1 -10 -9  6  o 3  110.25  15.40  360.58    94.83    352.08   135.86   368.66    132.42   107.12  22.79  109.92  21.76  -2.80   31.51  
1 1 1 -10 -9  7  o 3  110.32  15.97  362.26    98.17    328.88   147.27   388.96    131.70   102.89  25.15  113.05  21.07  -10.15  32.81  
1 1 1 -10 -9  8  o 10 234.98  25.94  1679.43   344.08   1632.67  489.63   1725.06   483.62   223.78  39.56  231.37  37.71  -7.59   54.65  
1 1 1 -10 -9  9  o 2  344.77  38.89  3846.29   756.26   4068.84  1071.01  3624.98   1068.01  333.46  58.06  309.30  62.31  24.16   85.16  
1 1 1 -10 -9  10 o 8  228.19  25.71  1592.84   330.90   1440.13  471.40   1741.19   464.61   207.49  41.03  232.25  36.01  -24.76  54.59  
1 1 1 -10 -9  11 o 9  223.91  25.01  1533.90   316.02   1526.95  453.53   1540.45   440.59   215.17  38.11  217.17  36.64  -2.00   52.87  
1 1 1 -10 -9  12 o 14 220.68  22.94  1480.42   286.34   1637.40  396.35   1309.06   414.12   227.09  31.23  198.43  37.73  28.66   48.98  
1 1 1 -10 -9  13 f 0  68.63   20.66  143.01    88.03    252.84   159.35   94.77     105.61   89.92   27.94  61.56   22.68  28.36   35.99  
1 1 1 -10 -9  14 o 5  275.71  31.93  2450.02   496.05   2381.78  707.67   2515.94   695.53   252.50  50.59  262.93  47.84  -10.43  69.63  
1 1 1 -10 -9  15 o 12 252.19  27.87  2015.75   396.82   1918.81  537.26   2132.11   588.62   233.40  41.62  244.13  43.60  -10.73  60.28  
1 1 1 -10 -9  16 o 9  124.72  18.03  473.31    125.33   517.80   199.38   444.25    161.14   125.93  28.27  118.08  24.57  7.85    37.46  
1 1 1 -10 -8  1  x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 -8  2  o 14 289.50  47.25  2690.13   758.19   2690.13  758.19   0.00      0.00     289.50  47.25  ?       ?      0.00    47.25  
1 1 1 -10 -8  3  o 3  515.76  137.63 14892.42  4150.46  14892.42 4150.46  0.00      0.00     515.76  137.63 ?       ?      0.00    137.63 
1 1 1 -10 -8  4  o 15 421.30  81.86  6835.94   1908.52  6835.94  1908.52  0.00      0.00     421.30  81.86  ?       ?      0.00    81.86  
1 1 1 -10 -8  5  o 18 132.33  24.03  532.21    175.85   532.21   175.85   0.00      0.00     132.33  24.03  ?       ?      0.00    24.03  
1 1 1 -10 -8  6  o 13 460.65  106.62 9910.62   2763.71  9910.62  2763.71  0.00      0.00     460.65  106.62 ?       ?      0.00    106.62 
1 1 1 -10 -8  7  o 13 378.23  71.47  5349.97   1494.97  5349.97  1494.97  0.00      0.00     378.23  71.47  ?       ?      0.00    71.47  
1 1 1 -10 -8  8  o 4  160.52  28.85  797.30    256.04   797.30   256.04   0.00      0.00     160.52  28.85  ?       ?      0.00    28.85  
1 1 1 -10 -8  9  f 0  149.72  27.90  695.47    231.01   695.47   231.01   0.00      0.00     149.72  27.90  ?       ?      0.00    27.90  
1 1 1 -10 -8  10 o 9  280.31  49.32  2697.20   764.64   2697.20  764.64   0.00      0.00     280.31  49.32  ?       ?      0.00    49.32  
1 1 1 -10 -8  11 o 16 108.37  26.08  368.69    160.26   368.69   160.26   0.00      0.00     108.37  26.08  ?       ?      0.00    26.08  
1 1 1 -10 -8  12 f 0  362.87  84.02  6136.45   1715.76  6136.45  1715.76  0.00      0.00     362.87  84.02  ?       ?      0.00    84.02  
1 1 1 -10 -8  13 o 17 237.29  42.27  1913.14   554.70   1913.14  554.70   0.00      0.00     237.29  42.27  ?       ?      0.00    42.27  
1 1 1 -10 -8  14 o 10 227.55  40.65  1759.35   511.54   1759.35  511.54   0.00      0.00     227.55  40.65  ?       ?      0.00    40.65  
1 1 1 -10 -8  15 o 12 275.09  53.99  2893.95   822.10   2893.95  822.10   0.00      0.00     275.09  53.99  ?       ?      0.00    53.99  
1 1 1 -10 -8  16 o 5  204.02  37.80  1426.77   426.38   1426.77  426.38   0.00      0.00     204.02  37.80  ?       ?      0.00    37.80  
1 1 1 -10 -8  17 o 19 226.55  43.27  1860.50   542.26   1860.50  542.26   0.00      0.00     226.55  43.27  ?       ?      0.00    43.27  
1 1 1 -10 -7  1  o 8  162.50  25.95  792.32    233.94   0.00     0.00     792.32    233.94   ?       ?      162.50  25.95  0.00    25.95  
1 1 1 -10 -7  2  o 11 164.25  18.18  792.35    168.56   751.52   241.52   831.11    235.35   157.61  27.71  166.56  25.42  -8.95   37.60  
1 1 1 -10 -7  3  o 18 232.01  36.73  1654.40   472.99   1654.40  472.99   0.00      0.00     232.01  36.73  ?       ?      0.00    36.73  
1 1 1 -10 -7  4  o 14 208.09  22.37  1281.06   263.07   1206.27  374.42   1353.96   369.69   198.04  34.17  211.07  31.47  -13.03  46.45  
1 1 1 -10 -7  5  o 3  339.42  36.51  3529.28   700.27   3490.42  991.03   3568.03   989.63   325.29  55.03  329.58  54.19  -4.29   77.23  
1 1 1 -10 -7  6  o 7  599.19  78.40  13315.98  2632.08  12962.64 3722.55  13669.23  3722.11  495.05  129.52 517.66  126.37 -22.61  180.96 
1 1 1 -10 -7  7  o 4  346.39  37.67  3724.81   737.03   3798.77  1043.90  3651.31   1040.73  335.42  56.20  327.69  57.42  7.73    80.34  
1 1 1 -10 -7  8  o 14 428.22  48.80  5980.05   1178.31  6094.56  1667.48  5865.84   1665.27  402.31  74.96  392.31  76.69  10.00   107.24 
1 1 1 -10 -7  9  o 8  249.95  27.10  1887.92   382.69   1821.71  543.60   1952.97   538.84   238.03  41.28  247.90  39.16  -9.87   56.90  
1 1 1 -10 -7  10 o 17 260.78  28.32  2071.08   417.12   2054.23  591.61   2087.73   588.19   251.16  42.55  253.72  41.84  -2.56   59.67  
1 1 1 -10 -7  11 o 13 138.71  18.05  573.69    140.34   520.70   203.46   621.79    193.84   128.85  28.28  142.40  24.60  -13.55  37.49  
1 1 1 -10 -7  12 o 6  238.00  26.01  1728.74   349.56   1755.06  497.54   1703.08   491.22   231.95  38.73  228.33  38.87  3.62    54.87  
1 1 1 -10 -7  13 o 10 330.40  38.17  3551.47   710.64   3420.76  1006.43  3681.44   1003.57  299.36  60.64  314.60  57.69  -15.24  83.70  
1 1 1 -10 -7  14 o 3  115.13  17.23  398.69    110.35   363.08   167.22   426.16    146.88   106.88  27.19  117.35  22.62  -10.48  35.37  
1 1 1 -10 -7  15 o 17 215.92  22.28  1417.48   272.16   1608.52  377.92   1211.68   392.25   225.33  29.96  190.38  37.23  34.95   47.78  
1 1 1 -10 -7  16 o 7  153.95  30.05  767.15    256.05   767.15   256.05   0.00      0.00     153.95  30.05  ?       ?      0.00    30.05  
1 1 1 -10 -7  17 o 9  226.34  23.96  1588.80   306.55   1930.44  442.87   1274.52   424.76   242.46  32.65  190.30  40.15  52.16   51.75  
1 1 1 -10 -7  18 o 12 238.10  38.54  1976.71   508.75   1834.51  1162.81  2010.38   565.77   173.82  71.78  234.52  43.63  -60.70  84.00  
1 1 1 -10 -6  1  o 19 391.03  41.89  4654.42   925.77   4398.96  1309.58  4909.61   1308.88  366.41  64.62  390.47  60.33  -24.06  88.41  
1 1 1 -10 -6  2  o 10 93.17   15.25  257.23    78.73    213.78   113.15   298.02    109.62   84.27   22.83  99.62   19.87  -15.34  30.26  
1 1 1 -10 -6  3  o 15 411.72  44.09  5193.54   1025.93  5176.63  1451.29  5210.42   1450.48  396.40  66.10  397.95  65.79  -1.55   93.26  
1 1 1 -10 -6  4  o 12 124.78  15.13  456.56    106.19   412.59   152.26   498.22    148.17   116.89  23.51  129.35  20.65  -12.46  31.29  
1 1 1 -10 -6  5  o 6  339.71  35.95  3492.66   690.42   3553.16  977.65   3432.47   975.16   333.23  52.87  326.82  53.85  6.42    75.47  
1 1 1 -10 -6  6  o 6  373.58  40.21  4292.36   848.83   4290.54  1201.00  4294.17   1199.87  359.45  60.34  359.69  60.24  -0.23   85.26  
1 1 1 -10 -6  7  o 5  530.86  63.30  9541.15   1891.09  9083.81  2674.59  9998.37   2674.22  463.41  103.19 496.56  97.29  -33.15  141.82 
1 1 1 -10 -6  8  o 14 395.71  44.33  4959.43   989.74   4551.17  1399.94  5367.41   1399.47  354.34  71.29  393.08  64.24  -38.74  95.96  
1 1 1 -10 -6  9  o 2  562.56  73.37  11677.23  2313.13  11235.47 3271.92  12118.65  3270.61  462.26  121.66 492.45  117.36 -30.19  169.05 
1 1 1 -10 -6  10 f 0  387.45  43.48  4804.74   950.43   4787.77  1345.26  4821.66   1342.97  363.00  67.02  364.81  66.58  -1.81   94.47  
1 1 1 -10 -6  11 o 15 232.62  25.67  1633.17   337.04   1450.33  478.94   1812.56   474.39   211.42  40.94  240.17  35.47  -28.76  54.17  
1 1 1 -10 -6  12 o 12 197.12  22.04  1165.44   245.15   1099.49  349.60   1229.23   343.86   186.16  33.96  198.47  31.21  -12.31  46.13  
1 1 1 -10 -6  13 o 6  207.37  23.40  1301.02   273.74   1151.45  389.79   1446.55   384.50   187.77  37.47  214.16  32.28  -26.39  49.46  
1 1 1 -10 -6  14 o 7  491.85  73.28  10138.75  2005.90  9994.01  2837.52  10283.33  2836.02  372.58  118.19 382.98  117.66 -10.40  166.77 
1 1 1 -10 -6  15 o 1  79.12   18.07  192.19    80.28    169.09   130.82   206.14    101.67   75.98   25.46  81.52   21.44  -5.53   33.29  
1 1 1 -10 -6  16 o 2  122.71  16.59  451.77    113.84   514.65   169.14   399.70    153.92   128.44  23.82  112.62  24.51  15.82   34.17  
1 1 1 -10 -6  17 o 13 145.83  17.18  638.81    141.08   840.77   209.26   470.51    191.02   165.09  22.68  120.56  28.12  44.53   36.12  
1 1 1 -10 -6  18 o 16 193.74  21.57  1153.45   235.87   1156.66  332.96   1150.21   334.18   186.94  32.19  186.22  32.44  0.72    45.70  
1 1 1 -10 -6  19 o 13 133.14  17.63  539.26    131.46   483.34   204.10   578.91    171.85   120.22  29.74  135.56  22.90  -15.34  37.53  
1 1 1 -10 -5  1  o 11 607.86  70.63  12247.40  2418.85  12012.82 3420.95  12481.92  3420.58  550.45  112.07 565.25  109.37 -14.79  156.59 
1 1 1 -10 -5  2  o 11 327.77  34.39  3219.87   637.46   3223.06  902.05   3216.69   900.96   320.36  50.74  320.04  50.73  0.32    71.75  
1 1 1 -10 -5  3  o 9  263.79  27.58  2061.20   411.51   2040.74  583.03   2081.51   580.90   257.92  40.73  260.79  40.08  -2.87   57.14  
1 1 1 -10 -5  4  o 2  240.29  25.20  1704.79   342.44   1683.55  485.12   1725.89   483.44   235.06  37.19  238.29  36.50  -3.24   52.11  
1 1 1 -10 -5  5  o 6  302.16  31.77  2725.06   542.78   2635.45  768.18   2814.40   767.05   290.40  47.74  301.22  45.80  -10.82  66.15  
1 1 1 -10 -5  6  o 11 153.99  17.88  696.39    155.16   547.29   216.47   853.92    222.51   133.88  29.01  169.50  23.50  -35.62  37.33  
1 1 1 -10 -5  7  o 12 383.30  41.56  4517.27   899.80   4227.66  1272.94  4806.49   1272.09  354.75  64.90  382.72  59.86  -27.98  88.29  
1 1 1 -10 -5  8  o 16 212.65  22.92  1339.76   275.38   1213.78  390.09   1464.92   388.80   198.04  35.62  219.50  31.78  -21.47  47.74  
1 1 1 -10 -5  9  o 6  159.86  17.98  753.42    162.18   772.89   231.68   734.71    227.10   159.70  26.18  155.56  26.37  4.14    37.16  
1 1 1 -10 -5  10 o 11 194.77  20.99  1125.73   231.04   1155.58  329.12   1096.72   324.42   193.99  30.56  188.71  31.02  5.29    43.55  
1 1 1 -10 -5  11 o 6  125.50  16.29  466.11    114.61   422.59   167.33   504.57    157.31   117.08  25.61  129.18  22.00  -12.11  33.76  
1 1 1 -10 -5  12 o 14 332.35  36.57  3463.64   686.25   3491.09  971.49   3436.30   969.54   317.66  55.28  314.71  55.70  2.95    78.48  
1 1 1 -10 -5  13 o 1  178.17  20.05  947.49    201.50   958.57   289.42   937.06    280.71   175.38  29.81  173.63  29.20  1.75    41.73  
1 1 1 -10 -5  14 o 13 436.11  55.14  6815.25   1349.76  6716.72  1909.88  6913.56   1907.82  373.96  90.05  382.91  88.56  -8.95   126.30 
1 1 1 -10 -5  15 o 19 341.05  40.23  3852.65   772.59   3668.12  1093.90  4036.31   1091.31  302.67  64.91  323.53  61.00  -20.86  89.07  
1 1 1 -10 -5  16 o 13 243.37  27.19  1840.89   373.43   1786.03  531.03   1894.56   525.25   228.33  42.06  237.08  40.02  -8.75   58.06  
1 1 1 -10 -5  17 o 19 66.16   18.54  134.15    73.22    82.26    122.93   162.68    91.15    62.06   24.10  72.62   20.80  -10.56  31.83  
1 1 1 -10 -5  18 o 12 158.10  18.27  755.00    162.80   752.63   233.84   757.23    226.80   153.26  27.59  154.30  26.56  -1.05   38.30  
1 1 1 -10 -5  19 o 17 230.39  24.01  1657.75   312.90   1770.40  426.64   1526.63   460.29   230.13  33.26  206.98  40.19  23.15   52.16  
1 1 1 -10 -5  20 o 11 73.68   17.63  169.31    73.55    167.13   149.43   170.01    84.49    75.56   27.11  73.52   19.64  2.04    33.48  
1 1 1 -10 -4  1  o 1  232.39  36.04  1647.09   465.18   0.00     0.00     1647.09   465.18   ?       ?      232.39  36.04  0.00    36.04  
1 1 1 -10 -4  2  o 2  277.66  29.05  2293.57   456.22   2264.45  645.46   2322.65   644.92   270.44  43.01  274.27  42.32  -3.83   60.34  
1 1 1 -10 -4  3  o 8  158.52  17.33  736.19    155.10   700.72   219.55   771.53    219.15   152.71  25.97  160.77  24.52  -8.06   35.72  
1 1 1 -10 -4  4  o 8  251.91  26.33  1877.17   375.15   1841.90  531.28   1912.25   529.79   245.31  39.03  250.41  38.05  -5.10   54.51  
1 1 1 -10 -4  5  o 1  254.40  26.78  1915.44   385.27   1799.84  545.44   2030.55   544.27   241.86  40.73  258.33  37.82  -16.47  55.58  
1 1 1 -10 -4  6  o 19 380.91  40.67  4406.73   875.63   4285.82  1239.63  4527.14   1237.04  363.38  61.62  375.12  59.42  -11.74  85.61  
1 1 1 -10 -4  7  o 6  432.30  74.13  6355.35   1773.53  0.00     0.00     6355.35   1773.53  ?       ?      432.30  74.13  0.00    74.13  
1 1 1 -10 -4  8  o 4  192.12  30.37  1116.65   323.78   0.00     0.00     1116.65   323.78   ?       ?      192.12  30.37  0.00    30.37  
1 1 1 -10 -4  9  o 8  448.35  83.82  7451.52   2078.11  0.00     0.00     7451.52   2078.11  ?       ?      448.35  83.82  0.00    83.82  
1 1 1 -10 -4  10 o 17 320.21  53.43  3384.10   947.60   0.00     0.00     3384.10   947.60   ?       ?      320.21  53.43  0.00    53.43  
1 1 1 -10 -4  11 o 4  330.89  57.08  3736.25   1045.09  0.00     0.00     3736.25   1045.09  ?       ?      330.89  57.08  0.00    57.08  
1 1 1 -10 -4  12 f 0  121.80  22.64  451.28    152.44   0.00     0.00     451.28    152.44   ?       ?      121.80  22.64  0.00    22.64  
1 1 1 -10 -4  13 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 -4  14 o 18 200.79  33.05  1274.03   367.73   0.00     0.00     1274.03   367.73   ?       ?      200.79  33.05  0.00    33.05  
1 1 1 -10 -4  15 o 5  351.35  75.23  5270.27   1471.70  0.00     0.00     5270.27   1471.70  ?       ?      351.35  75.23  0.00    75.23  
1 1 1 -10 -4  16 o 6  194.92  32.64  1223.11   352.29   0.00     0.00     1223.11   352.29   ?       ?      194.92  32.64  0.00    32.64  
1 1 1 -10 -4  17 o 9  196.02  28.54  1214.99   311.74   1834.54  864.16   1122.30   334.25   203.22  65.31  185.82  32.52  17.41   72.95  
1 1 1 -10 -4  18 f 0  131.27  23.49  539.27    170.52   0.00     0.00     539.27    170.52   ?       ?      131.27  23.49  0.00    23.49  
1 1 1 -10 -4  19 o 10 87.37   20.69  239.86    102.17   718.20   799.99   231.93    103.01   136.75  58.19  85.81   21.07  50.94   61.89  
1 1 1 -10 -4  20 o 4  57.03   19.03  94.70     73.07    0.00     0.00     94.70     73.07    ?       ?      57.03   19.03  0.00    19.03  
1 1 1 -10 -4  21 o 1  79.09   19.04  197.27    85.38    220.22   927.43   197.08    85.75    115.82  54.47  79.04   19.11  36.79   57.72  
1 1 1 -10 -3  1  o 12 432.56  46.72  5805.65   1141.74  5934.73  1614.69  5676.58   1614.63  419.66  69.45  408.57  71.44  11.09   99.63  
1 1 1 -10 -3  2  o 4  84.18   13.60  209.77    63.49    226.23   89.11    192.79    90.49    86.69   18.47  79.89   19.83  6.80    27.10  
1 1 1 -10 -3  3  o 12 102.12  13.83  306.56    78.99    282.28   110.42   332.01    113.04   96.73   20.52  105.30  19.42  -8.56   28.25  
1 1 1 -10 -3  4  o 2  283.42  44.44  2495.33   699.22   0.00     0.00     2495.33   699.22   ?       ?      283.42  44.44  0.00    44.44  
1 1 1 -10 -3  5  o 9  582.13  122.42 14216.77  3961.22  0.00     0.00     14216.77  3961.22  ?       ?      582.13  122.42 0.00    122.42 
1 1 1 -10 -3  6  o 18 196.48  31.05  1164.62   338.56   0.00     0.00     1164.62   338.56   ?       ?      196.48  31.05  0.00    31.05  
1 1 1 -10 -3  7  o 12 295.49  46.66  2718.80   765.22   0.00     0.00     2718.80   765.22   ?       ?      295.49  46.66  0.00    46.66  
1 1 1 -10 -3  8  o 15 533.97  103.80 11004.92  3067.18  0.00     0.00     11004.92  3067.18  ?       ?      533.97  103.80 0.00    103.80 
1 1 1 -10 -3  9  o 16 257.63  27.26  1974.06   397.12   1939.93  564.20   2007.58   559.06   250.25  40.67  255.19  39.43  -4.95   56.65  
1 1 1 -10 -3  10 o 10 148.40  17.01  647.66    142.28   680.17   202.94   616.23    199.53   150.35  24.34  142.70  25.28  7.65    35.10  
1 1 1 -10 -3  11 o 14 119.35  22.23  431.14    146.70   0.00     0.00     431.14    146.70   ?       ?      119.35  22.23  0.00    22.23  
1 1 1 -10 -3  12 o 9  90.69   15.51  245.66    77.83    225.31   113.66   263.64    106.79   85.84   22.71  93.01   20.55  -7.17   30.63  
1 1 1 -10 -3  13 o 3  290.14  31.29  2584.67   512.91   2609.39  726.42   2560.08   724.30   281.06  46.66  278.04  47.06  3.02    66.27  
1 1 1 -10 -3  14 o 15 113.33  22.78  394.19    143.04   0.00     0.00     394.19    143.04   ?       ?      113.33  22.78  0.00    22.78  
1 1 1 -10 -3  15 o 10 149.52  18.13  667.16    152.41   519.76   216.85   811.04    214.25   127.74  30.07  163.10  23.56  -35.36  38.21  
1 1 1 -10 -3  16 o 2  113.33  16.09  384.30    101.72   312.31   148.10   448.59    139.95   99.50   25.74  121.10  20.89  -21.60  33.14  
1 1 1 -10 -3  17 o 3  230.60  26.43  1652.16   343.54   1453.95  487.52   1847.68   484.19   204.10  42.97  236.03  36.95  -31.93  56.67  
1 1 1 -10 -3  18 o 11 179.46  19.82  975.85    200.83   1020.42  288.28   933.83    279.95   178.43  29.15  170.19  29.73  8.23    41.64  
1 1 1 -10 -3  19 o 10 177.64  19.87  961.23    199.16   986.26   285.84   937.61    277.66   174.20  29.64  169.83  29.55  4.38    41.86  
1 1 1 -10 -3  20 o 5  107.58  15.48  349.91    92.85    303.58   142.81   383.83    122.20   96.64   25.41  111.08  19.89  -14.44  32.27  
1 1 1 -10 -3  21 o 15 43.71   19.73  -41.89    105.20   -41.89   105.20   0.00      0.00     43.71   19.73  ?       ?      0.00    19.73  
1 1 1 -10 -2  1  o 4  331.93  53.30  3512.91   981.19   0.00     0.00     3512.91   981.19   ?       ?      331.93  53.30  0.00    53.30  
1 1 1 -10 -2  2  o 19 214.54  33.08  1396.60   394.36   0.00     0.00     1396.60   394.36   ?       ?      214.54  33.08  0.00    33.08  
1 1 1 -10 -2  3  o 13 244.57  38.04  1835.08   516.76   0.00     0.00     1835.08   516.76   ?       ?      244.57  38.04  0.00    38.04  
1 1 1 -10 -2  4  o 17 100.94  19.49  305.87    108.83   0.00     0.00     305.87    108.83   ?       ?      100.94  19.49  0.00    19.49  
1 1 1 -10 -2  5  o 3  74.68   21.24  166.53    95.34    0.00     0.00     166.53    95.34    ?       ?      74.68   21.24  0.00    21.24  
1 1 1 -10 -2  6  o 8  195.10  20.89  1119.39   230.37   1096.41  326.58   1142.15   325.00   190.42  30.94  194.70  30.04  -4.28   43.12  
1 1 1 -10 -2  7  o 11 367.93  39.02  4102.92   811.69   4107.86  1148.37  4097.99   1147.42  357.38  57.96  356.92  57.99  0.46    81.99  
1 1 1 -10 -2  8  o 13 533.97  60.33  9168.07   1817.02  8826.85  2569.88  9509.18   2569.44  487.82  95.19  512.01  90.74  -24.19  131.51 
1 1 1 -10 -2  9  o 13 397.90  42.74  4857.43   960.91   4838.13  1360.09  4876.67   1357.79  382.57  64.20  384.46  63.75  -1.89   90.48  
1 1 1 -10 -2  10 o 12 349.93  37.44  3732.60   740.43   3693.84  1048.39  3771.18   1045.87  336.47  56.26  340.65  55.38  -4.18   78.95  
1 1 1 -10 -2  11 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 -2  12 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 -2  13 o 17 142.10  25.05  617.08    196.86   617.08   196.86   0.00      0.00     142.10  25.05  ?       ?      0.00    25.05  
1 1 1 -10 -2  14 o 3  249.19  41.47  2019.57   572.47   2019.57  572.47   0.00      0.00     249.19  41.47  ?       ?      0.00    41.47  
1 1 1 -10 -2  15 o 17 319.99  59.69  3770.24   1056.18  3770.24  1056.18  0.00      0.00     319.99  59.69  ?       ?      0.00    59.69  
1 1 1 -10 -2  16 o 16 220.89  37.43  1600.05   457.73   1600.05  457.73   0.00      0.00     220.89  37.43  ?       ?      0.00    37.43  
1 1 1 -10 -2  17 o 6  210.02  36.05  1457.42   419.02   1457.42  419.02   0.00      0.00     210.02  36.05  ?       ?      0.00    36.05  
1 1 1 -10 -2  18 o 6  104.09  23.16  341.29    134.84   341.29   134.84   0.00      0.00     104.09  23.16  ?       ?      0.00    23.16  
1 1 1 -10 -2  19 o 12 103.97  23.66  343.79    138.05   343.79   138.05   0.00      0.00     103.97  23.66  ?       ?      0.00    23.66  
1 1 1 -10 -2  20 o 10 188.52  33.69  1204.91   351.25   1204.91  351.25   0.00      0.00     188.52  33.69  ?       ?      0.00    33.69  
1 1 1 -10 -2  21 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 -2  22 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 -1  1  o 16 215.51  33.29  1408.18   398.61   0.00     0.00     1408.18   398.61   ?       ?      215.51  33.29  0.00    33.29  
1 1 1 -10 -1  2  o 2  179.89  27.93  972.99    279.13   0.00     0.00     972.99    279.13   ?       ?      179.89  27.93  0.00    27.93  
1 1 1 -10 -1  3  o 1  289.94  45.72  2629.05   735.79   0.00     0.00     2629.05   735.79   ?       ?      289.94  45.72  0.00    45.72  
1 1 1 -10 -1  4  o 11 111.99  13.95  367.87    87.72    410.77   121.84   321.68    126.41   117.54  18.68  103.12  22.02  14.42   28.88  
1 1 1 -10 -1  5  o 15 559.93  64.53  10343.55  2036.37  10428.00 2880.14  10259.14  2879.59  518.37  100.41 512.64  101.44 5.73    142.74 
1 1 1 -10 -1  6  o 15 351.28  37.20  3738.26   738.72   3768.05  1044.92  3708.49   1044.49  342.62  54.99  339.53  55.50  3.09    78.13  
1 1 1 -10 -1  7  o 12 379.62  39.99  4384.91   858.34   4671.32  1214.45  4099.03   1213.31  381.28  57.25  353.58  62.04  27.70   84.42  
1 1 1 -10 -1  8  o 9  317.67  50.75  3186.43   894.31   3186.43  894.31   0.00      0.00     317.67  50.75  ?       ?      0.00    50.75  
1 1 1 -10 -1  9  o 14 298.53  47.49  2794.56   786.56   2794.56  786.56   0.00      0.00     298.53  47.49  ?       ?      0.00    47.49  
1 1 1 -10 -1  10 o 19 352.54  58.08  4054.72   1134.52  4054.72  1134.52  0.00      0.00     352.54  58.08  ?       ?      0.00    58.08  
1 1 1 -10 -1  11 o 18 154.70  25.91  723.53    222.00   723.53   222.00   0.00      0.00     154.70  25.91  ?       ?      0.00    25.91  
1 1 1 -10 -1  12 o 10 280.28  45.87  2534.38   712.52   2534.38  712.52   0.00      0.00     280.28  45.87  ?       ?      0.00    45.87  
1 1 1 -10 -1  13 o 18 124.93  16.00  461.74    112.11   441.42   166.05   478.76    151.98   119.78  24.96  125.73  21.85  -5.95   33.17  
1 1 1 -10 -1  14 o 10 294.64  31.88  2682.17   530.62   2745.47  752.31   2619.50   748.53   286.66  47.37  278.97  48.50  7.69    67.79  
1 1 1 -10 -1  15 o 6  231.94  25.15  1632.45   329.52   1597.87  469.78   1665.95   462.34   222.01  38.24  227.85  36.59  -5.84   52.92  
1 1 1 -10 -1  16 o 6  280.33  30.58  2458.14   484.23   2547.61  687.23   2369.93   682.40   272.81  45.48  261.35  47.22  11.46   65.56  
1 1 1 -10 -1  17 o 3  191.47  20.88  1109.46   225.82   1128.03  324.23   1091.96   314.70   187.47  31.22  184.67  30.77  2.80    43.84  
1 1 1 -10 -1  18 o 8  201.39  21.53  1237.17   245.09   1344.19  351.88   1136.34   341.56   203.94  31.03  185.73  33.26  18.20   45.49  
1 1 1 -10 -1  19 o 10 189.15  21.60  1099.34   230.30   1007.35  331.04   1185.62   320.59   172.55  34.62  190.84  30.27  -18.29  45.99  
1 1 1 -10 -1  20 o 13 304.26  34.69  3134.90   595.10   3458.52  844.24   2815.29   838.97   294.69  51.79  254.51  58.63  40.18   78.23  
1 1 1 -10 -1  21 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 -1  22 o 4  48.12   14.42  70.08     42.97    32.82    101.69   78.18     47.41    50.88   21.14  50.68   15.14  0.20    26.00  
1 1 1 -10 0   1  o 4  158.80  24.74  754.17    218.17   0.00     0.00     754.17    218.17   ?       ?      158.80  24.74  0.00    24.74  
1 1 1 -10 0   2  o 19 588.53  133.71 15845.82  4414.17  0.00     0.00     15845.82  4414.17  ?       ?      588.53  133.71 0.00    133.71 
1 1 1 -10 0   3  o 11 194.35  20.37  1110.73   223.86   1108.20  316.33   1113.27   316.84   191.63  29.72  192.08  29.69  -0.45   42.01  
1 1 1 -10 0   4  o 19 265.24  27.60  2092.69   414.09   2159.83  586.33   2025.88   584.91   264.74  39.81  255.62  41.27  9.12    57.34  
1 1 1 -10 0   5  o 15 211.52  22.22  1319.83   265.73   1314.40  376.84   1325.20   374.77   207.94  32.64  208.94  32.29  -0.99   45.91  
1 1 1 -10 0   6  o 14 139.00  23.33  579.37    179.54   579.37   179.54   0.00      0.00     139.00  23.33  ?       ?      0.00    23.33  
1 1 1 -10 0   7  o 4  492.79  92.23  9015.51   2513.25  9015.51  2513.25  0.00      0.00     492.79  92.23  ?       ?      0.00    92.23  
1 1 1 -10 0   8  o 9  575.80  125.05 14409.42  4014.82  14409.42 4014.82  0.00      0.00     575.80  125.05 ?       ?      0.00    125.05 
1 1 1 -10 0   9  o 14 316.78  50.71  3178.68   891.07   3178.68  891.07   0.00      0.00     316.78  50.71  ?       ?      0.00    50.71  
1 1 1 -10 0   10 o 11 280.22  29.24  2343.89   463.44   2450.13  655.99   2238.04   654.83   281.16  41.92  267.43  44.20  13.74   60.92  
1 1 1 -10 0   11 o 16 147.74  16.75  641.50    139.56   642.45   199.45   640.58    195.35   145.95  24.68  145.87  24.17  0.08    34.55  
1 1 1 -10 0   12 o 18 212.58  22.60  1343.19   271.56   1332.08  385.85   1354.09   382.27   207.61  33.52  209.64  32.84  -2.03   46.92  
1 1 1 -10 0   13 o 8  407.56  46.58  5409.67   1070.24  5349.95  1513.87  5469.33   1513.22  375.68  72.83  381.30  71.76  -5.62   102.24 
1 1 1 -10 0   14 o 10 145.86  17.02  630.34    139.84   555.02   199.44   703.18    196.12   133.75  26.91  152.29  23.16  -18.54  35.50  
1 1 1 -10 0   15 o 5  388.05  88.32  6896.51   1923.17  0.00     0.00     6896.51   1923.17  ?       ?      388.05  88.32  0.00    88.32  
1 1 1 -10 0   16 o 17 275.27  29.77  2360.95   462.89   2478.18  656.61   2245.13   652.66   270.56  43.77  255.09  46.27  15.48   63.69  
1 1 1 -10 0   17 o 14 99.00   14.49  292.94    79.94    334.05   130.73   268.38    101.03   103.42  22.65  93.33   19.49  10.09   29.88  
1 1 1 -10 0   18 o 14 343.29  41.56  4084.23   802.38   4161.22  1136.85  4007.80   1132.63  309.34  66.03  301.25  67.20  8.09    94.21  
1 1 1 -10 0   19 o 19 245.49  25.93  1896.01   359.97   2168.58  514.04   1633.70   504.26   252.58  36.51  212.71  42.78  39.86   56.24  
1 1 1 -10 0   20 o 12 111.84  24.23  402.17    151.02   402.17   151.02   0.00      0.00     111.84  24.23  ?       ?      0.00    24.23  
1 1 1 -10 0   21 o 9  177.57  31.11  1067.83   305.55   0.00     0.00     1067.83   305.55   ?       ?      177.57  31.11  0.00    31.11  
1 1 1 -10 0   22 o 8  231.26  20.82  1674.49   273.44   1998.71  370.98   1288.81   404.62   246.54  26.63  184.15  39.46  62.40   47.61  
1 1 1 -10 0   23 o 10 128.33  14.42  498.97    104.41   562.26   161.17   453.20    137.05   132.03  22.04  118.98  20.82  13.05   30.32  
1 1 1 -10 1   1  o 4  441.24  77.04  6745.01   1880.55  0.00     0.00     6745.01   1880.55  ?       ?      441.24  77.04  0.00    77.04  
1 1 1 -10 1   2  o 4  171.04  18.12  857.98    175.22   853.55   248.75   862.34    246.87   168.58  26.58  169.57  26.20  -0.98   37.33  
1 1 1 -10 1   3  o 11 232.40  24.40  1597.98   320.65   1383.69  452.46   1814.19   454.48   211.35  38.72  244.87  33.18  -33.52  50.99  
1 1 1 -10 1   4  o 6  449.43  81.00  7218.21   2012.91  7218.21  2012.91  0.00      0.00     449.43  81.00  ?       ?      0.00    81.00  
1 1 1 -10 1   5  o 15 333.59  54.30  3590.77   1004.05  3590.77  1004.05  0.00      0.00     333.59  54.30  ?       ?      0.00    54.30  
1 1 1 -10 1   6  o 13 380.78  64.07  4838.57   1350.93  4838.57  1350.93  0.00      0.00     380.78  64.07  ?       ?      0.00    64.07  
1 1 1 -10 1   7  o 1  271.96  42.82  2298.98   646.42   2298.98  646.42   0.00      0.00     271.96  42.82  ?       ?      0.00    42.82  
1 1 1 -10 1   8  o 9  218.92  23.01  1414.38   284.81   1454.09  402.46   1374.54   403.11   218.96  33.05  212.37  34.23  6.59    47.58  
1 1 1 -10 1   9  o 10 205.24  21.90  1241.81   254.07   1202.68  358.72   1281.20   359.89   198.88  32.54  205.76  31.47  -6.88   45.27  
1 1 1 -10 1   10 o 3  182.93  19.60  984.29    202.66   1009.75  286.21   958.70    286.99   183.06  28.13  178.00  29.09  5.06    40.47  
1 1 1 -10 1   11 o 9  566.52  68.07  11030.34  2169.57  11142.09 3068.35  10918.60  3068.13  510.70  108.04 503.10  109.36 7.61    153.73 
1 1 1 -10 1   12 o 4  304.47  32.48  2825.82   558.98   2858.78  790.54   2792.87   790.50   296.57  48.08  292.59  48.78  3.98    68.49  
1 1 1 -10 1   13 f 0  255.05  26.91  1965.51   388.09   2054.66  549.68   1876.91   548.00   254.30  38.89  241.61  40.97  12.69   56.49  
1 1 1 -10 1   14 o 13 240.81  39.55  1874.46   527.75   0.00     0.00     1874.46   527.75   ?       ?      240.81  39.55  0.00    39.55  
1 1 1 -10 1   15 o 17 259.51  27.83  2066.04   408.13   2138.76  578.33   1993.89   576.06   255.21  40.85  245.04  42.49  10.17   58.94  
1 1 1 -10 1   16 o 17 284.04  31.10  2534.22   498.88   2616.37  706.58   2452.56   704.47   275.20  46.37  264.58  48.16  10.62   66.85  
1 1 1 -10 1   17 o 8  71.07   14.64  153.34    57.75    171.41   96.95    143.41    71.89    74.57   21.48  68.32   18.06  6.25    28.06  
1 1 1 -10 1   18 o 12 180.73  30.94  1064.21   309.52   1064.21  309.52   0.00      0.00     180.73  30.94  ?       ?      0.00    30.94  
1 1 1 -10 1   19 o 12 32.60   13.95  -0.19     46.46    -43.66   87.63    16.81     54.79    39.46   17.89  38.20   15.66  1.26    23.78  
1 1 1 -10 1   20 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 1   21 o 1  142.07  23.94  648.74    188.35   0.00     0.00     648.74    188.35   ?       ?      142.07  23.94  0.00    23.94  
1 1 1 -10 1   22 o 2  155.97  25.33  800.52    219.04   775.04   689.79   803.37    230.99   124.73  53.58  155.01  26.94  -30.28  59.97  
1 1 1 -10 1   23 f 0  73.36   14.26  166.39    57.91    202.17   570.94   166.01    58.21    97.18   44.67  73.25   14.36  23.93   46.92  
1 1 1 -10 2   1  o 3  325.63  52.37  3384.05   945.78   0.00     0.00     3384.05   945.78   ?       ?      325.63  52.37  0.00    52.37  
1 1 1 -10 2   2  o 17 130.44  14.60  497.95    107.48   503.42   153.22   492.66    150.81   129.81  21.30  128.40  21.20  1.40    30.05  
1 1 1 -10 2   3  o 17 370.30  39.51  4191.98   826.91   4255.57  1169.70  4128.45   1169.17  360.81  58.47  354.50  59.56  6.31    83.47  
1 1 1 -10 2   4  o 5  203.66  31.86  1260.18   360.30   1260.18  360.30   0.00      0.00     203.66  31.86  ?       ?      0.00    31.86  
1 1 1 -10 2   5  o 1  454.24  83.27  7499.32   2091.26  7499.32  2091.26  0.00      0.00     454.24  83.27  ?       ?      0.00    83.27  
1 1 1 -10 2   6  o 5  155.75  25.16  728.79    217.26   728.79   217.26   0.00      0.00     155.75  25.16  ?       ?      0.00    25.16  
1 1 1 -10 2   7  o 19 115.13  21.44  398.37    136.46   398.37   136.46   0.00      0.00     115.13  21.44  ?       ?      0.00    21.44  
1 1 1 -10 2   8  o 3  431.03  46.82  5781.99   1140.01  5819.98  1612.58  5744.03   1611.87  413.56  70.45  410.31  71.00  3.25    100.02 
1 1 1 -10 2   9  o 16 198.43  21.57  1161.26   241.74   1005.39  340.52   1319.63   343.24   180.90  34.04  209.46  29.35  -28.56  44.95  
1 1 1 -10 2   10 o 6  220.04  22.90  1431.29   285.08   1557.03  404.39   1307.07   401.95   226.66  31.97  206.17  35.22  20.49   47.57  
1 1 1 -10 2   11 o 19 393.00  42.51  4821.54   943.76   5107.01  1335.08  4536.41   1334.28  388.20  61.99  361.15  66.82  27.05   91.15  
1 1 1 -10 2   12 o 5  417.12  46.43  5596.23   1092.98  5934.49  1545.92  5258.15   1545.50  405.60  68.85  374.93  74.43  30.67   101.39 
1 1 1 -10 2   13 o 17 143.06  15.80  603.38    127.60   682.85   180.39   523.79    180.52   150.74  21.45  130.62  24.98  20.12   32.93  
1 1 1 -10 2   14 o 9  199.89  21.44  1196.58   242.22   1194.25  342.67   1198.91   342.44   195.13  31.68  195.57  31.58  -0.44   44.73  
1 1 1 -10 2   15 o 11 143.08  15.49  605.36    125.23   715.95   179.85   501.28    174.47   154.03  20.88  127.15  24.79  26.88   32.41  
1 1 1 -10 2   16 o 8  195.87  21.00  1157.21   232.49   1193.16  329.22   1121.46   328.35   193.97  30.58  187.32  31.66  6.65    44.02  
1 1 1 -10 2   17 o 9  261.50  29.04  2159.48   428.54   2169.96  606.82   2149.04   605.29   248.38  44.18  247.02  44.31  1.36    62.57  
1 1 1 -10 2   18 o 3  164.33  27.11  862.29    246.84   0.00     0.00     862.29    246.84   ?       ?      164.33  27.11  0.00    27.11  
1 1 1 -10 2   19 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 2   20 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 2   21 o 8  136.04  21.70  586.91    163.78   440.84   517.91   603.14    172.64   111.33  47.07  137.37  22.68  -26.04  52.25  
1 1 1 -10 2   22 o 11 135.32  15.76  559.31    120.15   555.87   173.29   562.50    166.74   129.98  24.11  131.56  22.91  -1.58   33.26  
1 1 1 -10 2   23 o 19 154.87  18.04  749.15    157.40   729.92   230.97   765.82    215.08   144.33  28.89  150.66  25.80  -6.33   38.73  
1 1 1 -10 3   1  o 12 152.51  24.25  697.28    205.20   0.00     0.00     697.28    205.20   ?       ?      152.51  24.25  0.00    24.25  
1 1 1 -10 3   2  o 1  357.82  59.31  4209.35   1175.64  4209.35  1175.64  0.00      0.00     357.82  59.31  ?       ?      0.00    59.31  
1 1 1 -10 3   3  o 15 410.85  44.53  5244.09   1033.57  5455.75  1462.09  5032.66   1461.28  402.53  65.52  383.40  68.93  19.12   95.10  
1 1 1 -10 3   4  o 18 161.62  26.20  786.79    234.80   786.79   234.80   0.00      0.00     161.62  26.20  ?       ?      0.00    26.20  
1 1 1 -10 3   5  o 14 461.43  85.64  7835.52   2185.07  7835.52  2185.07  0.00      0.00     461.43  85.64  ?       ?      0.00    85.64  
1 1 1 -10 3   6  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 3   7  o 4  440.02  47.92  6056.46   1190.93  6321.40  1684.59  5791.75   1683.87  430.33  70.64  407.89  74.66  22.44   102.79 
1 1 1 -10 3   8  o 15 373.62  39.81  4269.12   840.72   4474.91  1189.63  4063.80   1188.29  370.80  57.77  350.56  61.28  20.24   84.21  
1 1 1 -10 3   9  f 0  474.96  89.86  8465.66   2360.51  8465.66  2360.51  0.00      0.00     474.96  89.86  ?       ?      0.00    89.86  
1 1 1 -10 3   10 o 15 292.90  30.82  2580.58   510.42   2659.98  721.85   2501.18   721.84   290.46  44.72  280.55  46.44  9.91    64.48  
1 1 1 -10 3   11 o 5  342.30  37.06  3614.37   716.56   3546.52  1013.30  3682.24   1013.45  325.20  56.32  332.54  55.01  -7.34   78.73  
1 1 1 -10 3   12 o 6  288.21  30.74  2534.66   500.77   2594.97  708.89   2474.58   707.50   282.48  45.24  274.86  46.49  7.62    64.87  
1 1 1 -10 3   13 o 1  176.06  18.78  920.05    186.84   983.14   265.81   858.43    262.70   179.22  26.64  166.52  28.51  12.70   39.02  
1 1 1 -10 3   14 o 10 426.88  51.25  6306.41   1230.80  6638.83  1740.92  5974.22   1740.31  394.86  79.55  364.78  84.73  30.08   116.22 
1 1 1 -10 3   15 o 15 201.79  21.35  1225.77   243.53   1335.82  345.00   1116.47   343.82   206.33  30.00  186.52  33.33  19.82   44.85  
1 1 1 -10 3   16 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 3   17 o 13 136.64  23.29  582.00    176.17   0.00     0.00     582.00    176.17   ?       ?      136.64  23.29  0.00    23.29  
1 1 1 -10 3   18 f 0  273.30  57.01  3095.50   865.48   0.00     0.00     3095.50   865.48   ?       ?      273.30  57.01  0.00    57.01  
1 1 1 -10 3   19 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 3   20 o 18 88.10   17.13  240.77    83.51    0.00     0.00     240.77    83.51    ?       ?      88.10   17.13  0.00    17.13  
1 1 1 -10 3   21 o 10 101.86  12.89  311.72    73.71    311.92   111.70   311.56    98.11    98.86   20.36  99.95   17.75  -1.09   27.01  
1 1 1 -10 3   22 o 14 109.62  21.53  390.46    130.62   390.46   130.62   0.00      0.00     109.62  21.53  ?       ?      0.00    21.53  
1 1 1 -10 3   23 o 7  92.96   20.80  283.73    108.23   283.73   108.23   0.00      0.00     92.96   20.80  ?       ?      0.00    20.80  
1 1 1 -10 4   1  o 13 177.59  27.88  951.40    274.85   0.00     0.00     951.40    274.85   ?       ?      177.59  27.88  0.00    27.88  
1 1 1 -10 4   2  o 9  402.63  43.55  5023.48   990.65   5285.83  1401.41  4761.42   1400.58  397.72  63.52  373.56  67.81  24.16   92.91  
1 1 1 -10 4   3  o 17 131.15  15.14  504.31    111.92   600.90   155.61   400.82    161.08   142.42  19.55  114.70  25.16  27.72   31.86  
1 1 1 -10 4   4  o 12 250.42  26.25  1863.85   371.73   1843.28  525.70   1884.43   525.71   244.28  38.78  247.26  38.27  -2.98   54.49  
1 1 1 -10 4   5  f 0  309.41  49.66  3044.88   852.32   3044.88  852.32   0.00      0.00     309.41  49.66  ?       ?      0.00    49.66  
1 1 1 -10 4   6  o 18 525.16  107.65 11253.90  3136.23  11253.90 3136.23  0.00      0.00     525.16  107.65 ?       ?      0.00    107.65 
1 1 1 -10 4   7  o 6  521.13  59.44  8846.89   1746.38  8474.72  2469.56  9219.17   2469.95  470.17  94.77  497.31  89.82  -27.14  130.58 
1 1 1 -10 4   8  f 0  275.93  29.05  2275.58   453.24   2191.17  640.40   2360.30   641.56   264.36  43.73  275.48  41.89  -11.12  60.55  
1 1 1 -10 4   9  o 4  294.60  31.17  2611.91   519.08   2494.17  733.63   2729.94   734.55   279.74  47.37  294.34  44.89  -14.60  65.26  
1 1 1 -10 4   10 o 10 215.58  22.83  1379.41   278.26   1255.25  393.12   1504.07   393.91   201.05  35.35  221.97  31.82  -20.92  47.56  
1 1 1 -10 4   11 o 3  270.83  28.80  2219.45   440.90   2185.93  623.21   2253.05   623.85   260.89  43.12  265.40  42.37  -4.51   60.45  
1 1 1 -10 4   12 o 10 377.04  42.49  4582.24   903.60   4640.96  1277.92  4523.54   1277.85  355.46  65.02  349.57  66.10  5.89    92.72  
1 1 1 -10 4   13 o 13 295.65  32.69  2730.02   545.63   2494.76  771.05   2965.99   772.23   266.81  52.21  296.44  46.94  -29.63  70.21  
1 1 1 -10 4   14 o 19 247.56  26.35  1875.86   368.69   2072.13  521.73   1680.08   521.09   253.15  36.99  223.95  42.08  29.20   56.03  
1 1 1 -10 4   15 o 12 272.23  48.93  2629.62   736.62   0.00     0.00     2629.62   736.62   ?       ?      272.23  48.93  0.00    48.93  
1 1 1 -10 4   16 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 4   17 o 17 154.53  16.95  717.55    147.87   783.15   209.53   652.45    208.72   158.28  23.80  142.89  26.42  15.39   35.56  
1 1 1 -10 4   18 o 17 92.76   19.95  269.84    103.09   269.84   103.09   0.00      0.00     92.76   19.95  ?       ?      0.00    19.95  
1 1 1 -10 4   19 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 4   20 o 12 111.28  21.29  394.75    131.04   394.75   131.04   0.00      0.00     111.28  21.29  ?       ?      0.00    21.29  
1 1 1 -10 4   21 o 2  59.09   19.10  106.89    73.81    106.89   73.81    0.00      0.00     59.09   19.10  ?       ?      0.00    19.10  
1 1 1 -10 4   22 o 14 37.00   16.26  -9.36     66.64    -9.36    66.64    0.00      0.00     37.00   16.26  ?       ?      0.00    16.26  
1 1 1 -10 4   23 o 6  120.13  19.69  465.64    131.08   408.62   525.87   469.42    135.35   99.66   44.63  120.20  20.34  -20.54  49.04  
1 1 1 -10 5   1  o 4  262.67  41.25  2140.37   601.52   0.00     0.00     2140.37   601.52   ?       ?      262.67  41.25  0.00    41.25  
1 1 1 -10 5   2  o 18 250.05  39.33  1930.63   545.94   0.00     0.00     1930.63   545.94   ?       ?      250.05  39.33  0.00    39.33  
1 1 1 -10 5   3  o 3  231.31  24.50  1584.63   320.32   1722.96  453.61   1447.05   452.40   238.02  34.18  216.43  37.79  21.59   50.95  
1 1 1 -10 5   4  o 3  299.40  31.57  2689.93   534.52   2532.48  754.76   2848.34   757.09   282.57  48.26  301.74  45.09  -19.17  66.05  
1 1 1 -10 5   5  o 10 223.17  34.86  1521.88   432.03   1521.88  432.03   0.00      0.00     223.17  34.86  ?       ?      0.00    34.86  
1 1 1 -10 5   6  o 2  126.79  22.17  482.63    155.53   482.63   155.53   0.00      0.00     126.79  22.17  ?       ?      0.00    22.17  
1 1 1 -10 5   7  o 18 553.37  64.84  10253.33  2020.62  10326.40 2857.48  10180.23  2857.70  506.90  101.74 501.81  102.66 5.09    144.53 
1 1 1 -10 5   8  o 16 257.69  27.06  1981.95   394.35   1785.30  557.54   2178.81   557.84   238.05  42.35  265.85  37.60  -27.80  56.63  
1 1 1 -10 5   9  o 9  430.30  48.12  5923.45   1168.36  5800.57  1652.18  6046.37   1652.44  398.86  74.91  409.63  72.95  -10.77  104.56 
1 1 1 -10 5   10 o 2  337.74  36.67  3538.99   699.63   3475.63  988.96   3602.46   989.90   319.90  55.88  326.83  54.69  -6.93   78.19  
1 1 1 -10 5   11 o 6  146.67  16.17  634.65    133.87   657.77   187.82   610.78    190.87   147.42  22.94  141.49  24.38  5.93    33.47  
1 1 1 -10 5   12 o 12 283.88  30.80  2493.48   493.93   2576.91  698.15   2409.87   698.90   277.68  45.36  266.71  47.38  10.97   65.60  
1 1 1 -10 5   13 o 1  218.98  23.46  1451.55   290.32   1428.32  409.84   1474.94   411.31   210.80  35.10  214.62  34.56  -3.82   49.26  
1 1 1 -10 5   14 o 19 161.77  26.48  815.08    237.43   0.00     0.00     815.08    237.43   ?       ?      161.77  26.48  0.00    26.48  
1 1 1 -10 5   15 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 5   16 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 5   17 o 15 252.39  28.25  2047.58   402.29   2242.19  568.37   1852.21   569.48   250.67  40.91  221.32  46.31  29.35   61.79  
1 1 1 -10 5   18 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 5   19 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 5   20 o 11 213.28  42.56  1791.73   502.81   1791.73  502.81   0.00      0.00     213.28  42.56  ?       ?      0.00    42.56  
1 1 1 -10 5   21 o 19 71.76   11.77  156.07    46.82    109.86   67.92    197.90    64.62    59.27   18.21  80.02   14.61  -20.75  23.34  
1 1 1 -10 5   22 o 14 58.17   14.37  106.27    47.70    0.00     0.00     106.27    47.70    ?       ?      58.17   14.37  0.00    14.37  
1 1 1 -10 6   1  o 16 232.33  37.15  1657.11   478.77   0.00     0.00     1657.11   478.77   ?       ?      232.33  37.15  0.00    37.15  
1 1 1 -10 6   2  o 18 426.53  75.00  6331.54   1769.53  0.00     0.00     6331.54   1769.53  ?       ?      426.53  75.00  0.00    75.00  
1 1 1 -10 6   3  o 13 378.34  40.71  4391.30   870.37   4715.37  1231.25  4067.62   1230.52  380.18  58.27  348.58  63.85  31.61   86.44  
1 1 1 -10 6   4  o 15 248.15  26.26  1830.39   368.36   1835.19  522.21   1825.64   519.68   243.84  38.59  243.23  38.50  0.61    54.51  
1 1 1 -10 6   5  o 10 396.75  42.91  4874.85   961.88   4510.70  1359.43  5239.93   1361.18  362.93  67.74  396.99  61.73  -34.06  91.65  
1 1 1 -10 6   6  o 6  339.63  56.25  3787.23   1058.31  3787.23  1058.31  0.00      0.00     339.63  56.25  ?       ?      0.00    56.25  
1 1 1 -10 6   7  o 10 310.62  50.85  3129.34   875.31   3129.34  875.31   0.00      0.00     310.62  50.85  ?       ?      0.00    50.85  
1 1 1 -10 6   8  o 19 139.37  16.07  571.74    126.19   501.97   172.41   652.27    185.21   128.45  24.27  147.34  22.62  -18.89  33.18  
1 1 1 -10 6   9  o 5  92.50   13.15  252.77    67.87    241.75   90.98    266.62    101.93   89.37   18.35  93.72   19.58  -4.34   26.83  
1 1 1 -10 6   10 o 15 311.21  54.43  3352.24   937.12   0.00     0.00     3352.24   937.12   ?       ?      311.21  54.43  0.00    54.43  
1 1 1 -10 6   11 o 15 403.69  99.45  8212.81   2289.37  0.00     0.00     8212.81   2289.37  ?       ?      403.69  99.45  0.00    99.45  
1 1 1 -10 6   12 o 12 101.40  12.95  303.81    73.67    314.05   100.23   291.78    108.66   101.92  17.78  97.57   20.07  4.35    26.81  
1 1 1 -10 6   13 o 18 296.19  33.01  2788.89   551.78   2756.99  779.59   2820.91   781.08   277.43  50.82  281.36  50.20  -3.93   71.43  
1 1 1 -10 6   14 o 18 194.15  20.99  1141.74   230.19   1227.85  324.17   1054.16   326.92   196.60  29.64  179.99  32.85  16.61   44.25  
1 1 1 -10 6   15 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 6   16 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 6   17 o 18 232.85  26.34  1737.75   345.86   1682.08  487.36   1794.23   490.91   214.18  41.13  222.85  39.84  -8.67   57.26  
1 1 1 -10 6   18 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 6   19 o 2  214.11  42.34  1791.05   501.99   1791.05  501.99   0.00      0.00     214.11  42.34  ?       ?      0.00    42.34  
1 1 1 -10 6   20 o 6  167.03  18.62  870.29    175.54   893.24   247.07   846.90    249.44   162.11  27.53  156.65  28.80  5.46    39.84  
1 1 1 -10 6   21 o 15 80.60   17.97  208.58    81.04    0.00     0.00     208.58    81.04    ?       ?      80.60   17.97  0.00    17.97  
1 1 1 -10 6   22 o 8  181.24  37.11  1330.63   373.07   0.00     0.00     1330.63   373.07   ?       ?      181.24  37.11  0.00    37.11  
1 1 1 -10 7   1  o 4  683.27  90.25  17512.68  3453.31  17967.21 4883.93  17058.22  4883.51  584.92  145.93 559.58  149.27 25.34   208.76 
1 1 1 -10 7   2  o 19 279.18  44.75  2454.11   693.01   0.00     0.00     2454.11   693.01   ?       ?      279.18  44.75  0.00    44.75  
1 1 1 -10 7   3  o 5  421.70  76.11  6353.51   1774.75  0.00     0.00     6353.51   1774.75  ?       ?      421.70  76.11  0.00    76.11  
1 1 1 -10 7   4  o 13 275.63  29.27  2280.97   456.08   2178.36  644.28   2384.03   645.71   262.15  44.40  275.72  42.13  -13.57  61.20  
1 1 1 -10 7   5  o 7  112.62  15.58  374.73    98.03    312.91   128.09   462.18    152.33   101.34  22.59  123.75  22.26  -22.41  31.72  
1 1 1 -10 7   6  o 7  296.56  48.94  2870.78   804.16   2870.78  804.16   0.00      0.00     296.56  48.94  ?       ?      0.00    48.94  
1 1 1 -10 7   7  o 15 317.29  54.22  3404.31   952.07   3404.31  952.07   0.00      0.00     317.29  54.22  ?       ?      0.00    54.22  
1 1 1 -10 7   8  o 15 345.39  62.97  4305.79   1202.51  4305.79  1202.51  0.00      0.00     345.39  62.97  ?       ?      0.00    62.97  
1 1 1 -10 7   9  o 1  172.31  27.53  915.22    263.21   915.22   263.21   0.00      0.00     172.31  27.53  ?       ?      0.00    27.53  
1 1 1 -10 7   10 o 5  273.98  47.39  2564.46   718.40   2564.46  718.40   0.00      0.00     273.98  47.39  ?       ?      0.00    47.39  
1 1 1 -10 7   11 o 9  231.08  38.74  1755.47   495.68   0.00     0.00     1755.47   495.68   ?       ?      231.08  38.74  0.00    38.74  
1 1 1 -10 7   12 o 10 328.08  37.43  3517.65   692.37   3330.83  978.58   3704.91   979.75   293.04  60.19  314.64  56.31  -21.60  82.42  
1 1 1 -10 7   13 o 6  325.33  38.41  3530.11   703.50   3837.33  994.73   3222.68   995.07   315.08  57.10  278.92  63.57  36.16   85.44  
1 1 1 -10 7   14 o 4  123.34  14.40  453.00    100.04   478.60   140.38   426.59    142.59   124.74  20.30  116.95  22.05  7.79    29.97  
1 1 1 -10 7   15 o 19 118.26  21.79  438.44    142.47   0.00     0.00     438.44    142.47   ?       ?      118.26  21.79  0.00    21.79  
1 1 1 -10 7   16 o 19 54.70   19.01  83.76     73.03    0.00     0.00     83.76     73.03    ?       ?      54.70   19.01  0.00    19.01  
1 1 1 -10 7   17 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 7   18 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 7   19 o 12 108.35  19.06  371.84    114.24   371.84   114.24   0.00      0.00     108.35  19.06  ?       ?      0.00    19.06  
1 1 1 -10 7   20 o 18 134.01  15.43  552.01    116.51   603.20   161.97   497.12    167.72   136.26  21.41  120.96  24.98  15.29   32.90  
1 1 1 -10 7   21 o 12 158.27  18.41  796.87    164.18   909.79   231.85   683.30    232.51   162.22  25.76  135.33  30.64  26.89   40.03  
1 1 1 -10 7   22 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 8   1  o 17 443.85  50.60  6403.88   1266.29  6575.79  1791.33  6232.17   1790.28  419.99  77.14  405.36  79.78  14.63   110.97 
1 1 1 -10 8   2  o 7  158.11  18.48  739.16    164.56   865.56   235.67   618.87    229.90   169.40  24.98  141.47  29.27  27.92   38.48  
1 1 1 -10 8   3  o 1  321.48  54.86  3483.49   976.07   0.00     0.00     3483.49   976.07   ?       ?      321.48  54.86  0.00    54.86  
1 1 1 -10 8   4  o 5  154.20  25.96  724.91    221.64   0.00     0.00     724.91    221.64   ?       ?      154.20  25.96  0.00    25.96  
1 1 1 -10 8   5  o 12 318.91  34.93  3158.96   629.00   3320.90  890.56   2997.77   888.51   314.41  51.09  295.70  54.34  18.71   74.59  
1 1 1 -10 8   6  o 5  314.49  34.48  3083.64   612.27   3103.03  866.47   3064.30   865.29   301.35  51.96  299.13  52.29  2.22    73.72  
1 1 1 -10 8   7  o 1  414.25  49.28  5800.52   1149.01  6075.84  1624.28  5524.75   1625.61  387.82  75.68  362.12  80.30  25.70   110.34 
1 1 1 -10 8   8  f 0  299.61  53.83  3187.14   891.89   3187.14  891.89   0.00      0.00     299.61  53.83  ?       ?      0.00    53.83  
1 1 1 -10 8   9  x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 8   10 f 0  113.56  15.14  383.95    96.26    381.09   126.05   387.96    149.11   111.59  20.43  111.50  24.01  0.10    31.52  
1 1 1 -10 8   11 o 3  61.18   20.85  105.06    87.72    0.00     0.00     105.06    87.72    ?       ?      61.18   20.85  0.00    20.85  
1 1 1 -10 8   12 o 7  169.12  18.72  861.67    178.71   894.66   249.71   827.04    255.86   168.48  26.71  160.75  28.78  7.73    39.27  
1 1 1 -10 8   13 o 5  301.15  34.88  3018.34   591.86   2828.35  835.80   3209.44   838.25   263.48  56.92  287.44  52.74  -23.96  77.60  
1 1 1 -10 8   14 o 16 260.95  30.35  2226.34   446.18   2364.78  629.90   2086.93   632.08   251.81  45.24  231.31  49.12  20.50   66.78  
1 1 1 -10 8   15 o 2  164.81  28.68  897.25    261.51   0.00     0.00     897.25    261.51   ?       ?      164.81  28.68  0.00    28.68  
1 1 1 -10 8   16 o 17 254.21  59.50  3048.09   852.82   0.00     0.00     3048.09   852.82   ?       ?      254.21  59.50  0.00    59.50  
1 1 1 -10 8   17 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 8   18 o 15 198.09  22.78  1265.49   254.31   1251.44  358.69   1279.68   360.62   183.96  35.25  186.38  34.99  -2.42   49.67  
1 1 1 -10 8   19 o 9  215.69  52.77  2307.05   647.88   2307.05  647.88   0.00      0.00     215.69  52.77  ?       ?      0.00    52.77  
1 1 1 -10 8   20 o 14 108.15  22.54  394.58    135.37   394.58   135.37   0.00      0.00     108.15  22.54  ?       ?      0.00    22.54  
1 1 1 -10 8   21 o 7  46.62   17.35  57.91     62.02    0.00     0.00     57.91     62.02    ?       ?      46.62   17.35  0.00    17.35  
1 1 1 -10 9   1  o 8  397.21  45.88  5181.08   1026.91  5374.62  1453.09  4987.96   1451.46  376.01  69.89  357.59  73.17  18.42   101.19 
1 1 1 -10 9   2  f 0  472.96  59.23  7947.90   1572.97  8292.89  2225.07  7603.26   2223.94  426.98  93.38  398.95  97.86  28.02   135.27 
1 1 1 -10 9   3  o 8  268.81  29.31  2217.48   444.94   2343.92  630.17   2091.79   628.32   267.58  42.44  250.36  45.39  17.21   62.14  
1 1 1 -10 9   4  o 1  375.92  43.58  4644.88   923.04   4989.83  1305.40  4299.95   1305.35  364.16  64.82  329.20  71.15  34.96   96.25  
1 1 1 -10 9   5  o 19 83.53   21.99  215.04    106.88   0.00     0.00     215.04    106.88   ?       ?      83.53   21.99  0.00    21.99  
1 1 1 -10 9   6  o 16 349.06  71.53  4957.17   1385.16  0.00     0.00     4957.17   1385.16  ?       ?      349.06  71.53  0.00    71.53  
1 1 1 -10 9   7  o 8  145.88  16.79  632.92    138.03   634.88   193.48   630.88    196.98   143.48  24.36  142.80  24.94  0.69    34.86  
1 1 1 -10 9   8  o 3  143.17  25.11  636.67    198.82   0.00     0.00     636.67    198.82   ?       ?      143.17  25.11  0.00    25.11  
1 1 1 -10 9   9  x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 9   10 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 9   11 f 0  121.84  14.90  443.30    102.02   373.70   138.28   526.42    151.13   108.99  22.83  130.71  20.84  -21.73  30.91  
1 1 1 -10 9   12 o 12 124.46  23.02  488.09    158.38   0.00     0.00     488.09    158.38   ?       ?      124.46  23.02  0.00    23.02  
1 1 1 -10 9   13 o 3  173.74  29.88  999.10    287.24   999.10   287.24   0.00      0.00     173.74  29.88  ?       ?      0.00    29.88  
1 1 1 -10 9   14 o 14 241.43  27.40  1896.10   373.05   1763.49  526.03   2030.27   529.13   213.95  44.29  234.55  40.78  -20.60  60.20  
1 1 1 -10 9   15 o 2  74.48   16.04  172.44    66.53    173.04   92.80    171.80    95.44    73.62   20.96  73.36   21.37  0.26    29.93  
1 1 1 -10 9   16 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 9   17 o 2  187.49  36.60  1328.59   379.83   0.00     0.00     1328.59   379.83   ?       ?      187.49  36.60  0.00    36.60  
1 1 1 -10 9   18 o 13 88.21   20.47  255.46    101.65   0.00     0.00     255.46    101.65   ?       ?      88.21   20.47  0.00    20.47  
1 1 1 -10 9   19 o 1  102.22  15.49  326.60    88.03    395.02   134.34   275.11    116.55   108.24  22.36  89.76   22.63  18.48   31.81  
1 1 1 -10 9   20 o 5  50.78   21.54  34.82     109.00   34.82    109.00   0.00      0.00     50.78   21.54  ?       ?      0.00    21.54  
1 1 1 -10 10  1  o 11 250.90  27.13  1928.72   384.61   1816.02  543.48   2041.80   544.38   233.64  42.07  250.20  39.19  -16.56  57.49  
1 1 1 -10 10  2  o 12 148.76  17.16  658.05    143.86   680.07   203.42   636.01    203.49   148.64  24.71  143.27  25.69  5.37    35.64  
1 1 1 -10 10  3  o 5  235.08  25.85  1690.27   343.06   1898.69  485.36   1482.21   484.95   242.81  35.90  210.17  41.67  32.64   55.00  
1 1 1 -10 10  4  o 19 263.66  28.73  2156.54   427.87   2013.36  605.09   2299.73   605.12   242.19  45.18  262.38  41.56  -20.19  61.39  
1 1 1 -10 10  5  o 6  340.16  39.59  3820.32   758.70   3951.02  1073.34  3689.80   1072.59  320.28  60.60  305.70  63.21  14.59   87.56  
1 1 1 -10 10  6  o 4  202.06  34.11  1326.14   381.60   0.00     0.00     1326.14   381.60   ?       ?      202.06  34.11  0.00    34.11  
1 1 1 -10 10  7  o 7  160.67  27.49  815.45    244.40   0.00     0.00     815.45    244.40   ?       ?      160.67  27.49  0.00    27.49  
1 1 1 -10 10  8  f 0  187.15  31.82  1138.75   329.67   0.00     0.00     1138.75   329.67   ?       ?      187.15  31.82  0.00    31.82  
1 1 1 -10 10  9  o 9  115.49  14.86  399.03    96.24    332.98   132.99   471.64    139.44   102.59  23.14  123.73  20.34  -21.13  30.80  
1 1 1 -10 10  10 o 19 215.73  38.50  1622.23   459.29   1622.23  459.29   0.00      0.00     215.73  38.50  ?       ?      0.00    38.50  
1 1 1 -10 10  11 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 10  12 o 3  129.70  16.87  512.17    122.67   578.37   176.67   450.53    170.45   134.47  23.76  117.17  26.02  17.30   35.23  
1 1 1 -10 10  13 o 5  119.79  15.44  435.23    103.72   356.34   151.68   504.52    142.15   103.72  25.63  126.88  20.19  -23.16  32.62  
1 1 1 -10 10  14 o 13 183.75  21.42  1065.13   221.70   1111.35  315.76   1020.19   311.36   178.59  31.97  169.87  33.12  8.73    46.03  
1 1 1 -10 10  15 o 6  97.50   16.14  294.27    87.16    292.48   133.15   295.60    115.30   93.41   24.52  95.26   21.59  -1.85   32.67  
1 1 1 -10 10  16 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 10  17 o 6  121.91  16.92  465.70    115.23   493.09   170.21   442.52    156.57   119.49  25.59  113.69  24.70  5.81    35.56  
1 1 1 -10 10  18 o 18 48.67   19.89  43.61     88.14    0.00     0.00     43.61     88.14    ?       ?      48.67   19.89  0.00    19.89  
1 1 1 -10 10  19 f 0  90.24   22.63  282.90    117.00   0.00     0.00     282.90    117.00   ?       ?      90.24   22.63  0.00    22.63  
1 1 1 -10 11  1  o 15 235.66  26.67  1722.33   354.43   1952.05  504.81   1498.98   497.76   242.91  37.40  207.84  43.13  35.07   57.09  
1 1 1 -10 11  2  o 8  226.75  25.07  1584.47   320.90   1540.92  456.37   1627.06   451.31   214.21  38.53  221.63  36.76  -7.42   53.25  
1 1 1 -10 11  3  o 16 338.54  40.96  3892.23   779.89   4249.67  1104.65  3537.00   1101.23  325.27  61.41  285.34  68.17  39.93   91.75  
1 1 1 -10 11  4  o 4  161.77  19.08  790.36    173.78   822.95   251.24   760.47    240.63   160.65  28.27  154.34  28.20  6.31    39.93  
1 1 1 -10 11  5  o 12 288.77  33.54  2724.46   545.70   2848.11  773.25   2601.78   770.22   275.52  50.76  259.64  53.46  15.88   73.72  
1 1 1 -10 11  6  o 15 91.02   16.68  252.79    83.93    272.58   129.52   238.46    110.21   92.52   24.14  86.97   22.05  5.54    32.69  
1 1 1 -10 11  7  o 15 178.90  20.50  979.35    206.72   1018.77  297.07   942.34    287.85   176.36  30.44  169.27  30.76  7.09    43.27  
1 1 1 -10 11  8  o 15 76.16   20.75  182.48    93.16    0.00     0.00     182.48    93.16    ?       ?      76.16   20.75  0.00    20.75  
1 1 1 -10 11  9  o 1  88.48   21.55  249.21    108.42   0.00     0.00     249.21    108.42   ?       ?      88.48   21.55  0.00    21.55  
1 1 1 -10 11  10 o 14 101.56  16.40  315.64    92.34    322.22   145.05   311.15    119.74   99.07   25.39  98.75   21.71  0.33    33.41  
1 1 1 -10 11  11 o 16 205.42  23.70  1341.97   274.39   1336.87  391.93   1346.87   384.28   192.82  36.75  194.66  35.70  -1.83   51.24  
1 1 1 -10 11  12 o 19 227.44  48.94  2178.86   619.99   2178.86  619.99   0.00      0.00     227.44  48.94  ?       ?      0.00    48.94  
1 1 1 -10 11  13 o 15 162.88  31.91  937.74    287.71   937.74   287.71   0.00      0.00     162.88  31.91  ?       ?      0.00    31.91  
1 1 1 -10 11  14 o 3  173.79  20.76  961.00    203.00   881.85   291.98   1035.04   282.42   154.57  33.84  172.34  29.61  -17.77  44.97  
1 1 1 -10 11  15 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 11  16 o 9  80.40   22.33  219.32    106.75   0.00     0.00     219.32    106.75   ?       ?      80.40   22.33  0.00    22.33  
1 1 1 -10 11  17 o 19 153.78  20.20  774.73    174.04   712.42   260.13   825.23    234.18   132.64  34.01  150.66  28.11  -18.03  44.12  
1 1 1 -10 11  18 o 6  82.09   19.53  225.95    90.71    129.70   175.66   260.94    105.93   67.83   27.95  87.24   21.33  -19.41  35.16  
1 1 1 -10 12  1  o 7  146.87  28.65  699.63    232.84   699.63   232.84   0.00      0.00     146.87  28.65  ?       ?      0.00    28.65  
1 1 1 -10 12  2  o 10 83.52   23.25  220.86    115.56   0.00     0.00     220.86    115.56   ?       ?      83.52   23.25  0.00    23.25  
1 1 1 -10 12  3  o 13 166.49  19.98  847.46    187.13   938.73   269.73   762.76    259.83   170.26  28.61  151.73  30.88  18.53   42.10  
1 1 1 -10 12  4  o 11 234.39  26.84  1748.12   354.69   1718.82  505.57   1776.52   497.75   218.20  41.88  223.66  40.25  -5.46   58.09  
1 1 1 -10 12  5  o 3  138.96  17.91  587.76    139.53   617.05   205.94   562.90    189.70   137.81  27.00  132.04  25.95  5.76    37.45  
1 1 1 -10 12  6  o 5  153.25  29.82  781.10    252.89   781.10   252.89   0.00      0.00     153.25  29.82  ?       ?      0.00    29.82  
1 1 1 -10 12  7  o 17 47.64   18.48  47.52     72.18    63.99    130.52   40.26     86.64    59.99   24.33  49.32   19.88  10.67   31.42  
1 1 1 -10 12  8  o 15 272.41  33.67  2551.88   515.29   2914.40  731.86   2195.48   725.66   268.11  49.37  218.70  57.17  49.41   75.54  
1 1 1 -10 12  9  o 5  196.00  36.87  1389.47   399.69   0.00     0.00     1389.47   399.69   ?       ?      196.00  36.87  0.00    36.87  
1 1 1 -10 12  10 o 2  65.64   20.69  134.50    87.05    0.00     0.00     134.50    87.05    ?       ?      65.64   20.69  0.00    20.69  
1 1 1 -10 12  11 o 1  111.60  17.31  386.89    107.29   379.86   171.77   391.39    137.38   104.81  28.01  109.52  22.60  -4.71   35.99  
1 1 1 -10 12  12 o 1  89.63   18.01  254.76    89.48    287.13   147.91   236.08    112.37   91.34   26.60  84.34   22.71  6.99    34.97  
1 1 1 -10 12  13 o 16 220.78  63.05  2963.87   838.74   2963.87  838.74   0.00      0.00     220.78  63.05  ?       ?      0.00    63.05  
1 1 1 -10 12  14 f 0  75.81   27.17  193.22    150.02   193.22   150.02   0.00      0.00     75.81   27.17  ?       ?      0.00    27.17  
1 1 1 -10 12  15 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 12  16 o 18 75.13   21.12  192.56    94.88    401.09   184.25   117.30    110.68   101.73  29.70  61.89   23.14  39.83   37.66  
1 1 1 -10 13  1  o 7  216.48  25.15  1486.20   306.73   1405.14  439.70   1563.04   428.09   196.80  40.28  211.73  36.54  -14.93  54.38  
1 1 1 -10 13  2  o 5  254.60  55.35  2761.12   785.77   2761.12  785.77   0.00      0.00     254.60  55.35  ?       ?      0.00    55.35  
1 1 1 -10 13  3  o 1  240.86  50.53  2361.32   676.30   2361.32  676.30   0.00      0.00     240.86  50.53  ?       ?      0.00    50.53  
1 1 1 -10 13  4  f 0  172.81  21.04  929.95    204.42   930.56   297.72   929.41    281.18   164.37  32.70  165.94  30.65  -1.57   44.82  
1 1 1 -10 13  5  o 8  136.05  18.46  570.68    140.48   550.16   214.48   586.09    185.92   126.91  29.93  134.25  25.04  -7.34   39.02  
1 1 1 -10 13  6  o 2  189.94  22.90  1145.08   244.64   1254.91  354.80   1045.54   337.78   188.95  33.96  170.46  35.67  18.49   49.25  
1 1 1 -10 13  7  o 6  194.55  23.25  1209.76   254.55   1157.18  368.42   1257.80   352.12   176.78  37.47  188.54  33.77  -11.76  50.44  
1 1 1 -10 13  8  o 17 222.51  26.97  1643.90   337.54   1717.33  484.75   1574.78   470.29   209.19  41.83  199.22  42.42  9.97    59.58  
1 1 1 -10 13  9  o 1  86.34   28.46  254.33    163.59   254.33   163.59   0.00      0.00     86.34   28.46  ?       ?      0.00    28.46  
1 1 1 -10 13  10 o 4  145.62  28.09  734.59    226.34   0.00     0.00     734.59    226.34   ?       ?      145.62  28.09  0.00    28.09  
1 1 1 -10 13  11 o 1  103.71  24.07  365.42    140.55   0.00     0.00     365.42    140.55   ?       ?      103.71  24.07  0.00    24.07  
1 1 1 -10 13  12 o 11 187.70  41.45  1514.80   434.71   0.00     0.00     1514.80   434.71   ?       ?      187.70  41.45  0.00    41.45  
1 1 1 -10 13  13 o 11 215.41  28.24  1664.10   340.83   1905.08  495.91   1448.38   469.21   204.81  43.52  170.61  46.60  34.20   63.76  
1 1 1 -10 13  14 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -10 14  1  o 3  161.88  30.24  894.26    270.72   0.00     0.00     894.26    270.72   ?       ?      161.88  30.24  0.00    30.24  
1 1 1 -10 14  2  o 16 120.37  18.93  452.36    126.49   453.52   208.80   451.69    158.99   113.55  31.11  117.34  24.40  -3.79   39.54  
1 1 1 -10 14  3  o 4  151.77  20.26  723.33    172.09   819.14   264.31   652.83    226.73   153.42  31.08  137.70  29.57  15.72   42.89  
1 1 1 -10 14  4  o 6  169.50  35.50  1053.96   334.38   1053.96  334.38   0.00      0.00     169.50  35.50  ?       ?      0.00    35.50  
1 1 1 -10 14  5  f 0  130.43  31.79  611.25    235.82   611.25   235.82   0.00      0.00     130.43  31.79  ?       ?      0.00    31.79  
1 1 1 -10 14  6  o 19 61.37   20.43  115.73    84.24    199.28   167.90   87.62     97.38    78.76   28.67  57.61   21.67  21.15   35.94  
1 1 1 -10 14  7  o 10 76.49   20.02  190.57    88.91    326.16   162.37   132.49    106.26   96.25   27.82  65.58   22.92  30.66   36.05  
1 1 1 -10 14  8  o 1  112.60  18.86  404.58    117.62   540.18   192.40   323.65    148.63   123.87  27.75  96.26   26.20  27.60   38.16  
1 1 1 -10 14  9  o 1  50.10   19.11  62.80     76.37    32.81    160.16   71.63     86.89    58.85   25.55  53.11   20.36  5.74    32.67  
1 1 1 -10 14  10 o 13 113.93  19.04  418.99    120.16   435.83   210.61   410.86    146.30   105.96  31.97  109.40  23.96  -3.44   39.95  
1 1 1 -10 14  11 o 18 51.75   19.38  72.79     77.66    43.55    197.68   78.13     84.45    63.37   27.92  53.52   20.17  9.84    34.45  
1 1 1 -10 15  1  o 11 130.65  20.04  542.52    145.49   553.47   236.10   535.81    184.73   122.44  32.89  125.51  26.47  -3.08   42.22  
1 1 1 -10 15  2  o 18 39.55   18.30  -64.64    98.20    0.00     0.00     -64.64    98.20    ?       ?      39.55   18.30  0.00    18.30  
1 1 1 -10 15  3  o 6  49.58   20.49  36.74     94.78    0.00     0.00     36.74     94.78    ?       ?      49.58   20.49  0.00    20.49  
1 1 1 -10 15  4  o 17 160.88  31.90  942.82    284.24   0.00     0.00     942.82    284.24   ?       ?      160.88  31.90  0.00    31.90  
1 1 1 -10 15  5  o 19 48.84   19.69  45.39     84.94    136.77   170.17   15.05     98.03    70.58   28.07  47.29   20.25  23.30   34.61  
1 1 1 -9  -15 1  o 3  76.58   26.26  173.93    139.16   173.93   139.16   0.00      0.00     76.58   26.26  ?       ?      0.00    26.26  
1 1 1 -9  -15 2  o 8  61.81   24.46  76.19     128.60   76.19    128.60   0.00      0.00     61.81   24.46  ?       ?      0.00    24.46  
1 1 1 -9  -15 3  o 5  68.28   24.83  125.99    125.89   125.99   125.89   0.00      0.00     68.28   24.83  ?       ?      0.00    24.83  
1 1 1 -9  -15 4  o 18 106.69  27.03  369.68    165.73   369.68   165.73   0.00      0.00     106.69  27.03  ?       ?      0.00    27.03  
1 1 1 -9  -15 5  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  -14 1  o 5  71.03   18.76  155.30    77.59    9.71     129.43   236.97    96.95    54.68   23.34  87.53   19.76  -32.85  30.58  
1 1 1 -9  -14 2  o 4  106.48  16.53  341.59    97.76    398.47   149.99   299.59    128.89   112.71  23.92  97.67   23.31  15.04   33.40  
1 1 1 -9  -14 3  o 1  176.35  20.43  941.43    202.98   884.09   294.30   993.46    280.32   164.80  32.26  177.11  28.54  -12.31  43.08  
1 1 1 -9  -14 4  o 18 99.54   17.01  300.41    93.69    254.38   149.61   330.10    120.16   89.88   26.90  103.21  21.00  -13.33  34.13  
1 1 1 -9  -14 5  x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  -14 6  o 13 145.71  17.97  639.80    147.11   629.26   218.07   648.60    199.29   140.00  28.11  143.68  25.07  -3.67   37.67  
1 1 1 -9  -14 7  o 12 159.74  18.20  769.14    163.94   874.56   238.06   674.05    226.11   166.79  25.69  144.76  28.22  22.03   38.16  
1 1 1 -9  -14 8  o 6  206.53  22.38  1309.07   261.06   1501.57  376.27   1130.39   362.50   215.05  31.41  183.01  35.79  32.03   47.61  
1 1 1 -9  -13 1  o 14 210.42  23.57  1344.95   279.79   1243.88  399.09   1442.64   392.37   194.80  37.04  212.58  33.24  -17.78  49.77  
1 1 1 -9  -13 2  o 16 280.73  30.79  2467.17   488.02   2615.55  692.30   2320.61   688.03   276.89  45.11  257.61  48.30  19.28   66.09  
1 1 1 -9  -13 3  o 9  329.07  37.54  3514.57   696.45   3550.33  986.96   3479.10   982.91   308.18  57.91  304.44  58.36  3.73    82.22  
1 1 1 -9  -13 4  o 11 105.55  25.47  350.50    152.54   350.50   152.54   0.00      0.00     105.55  25.47  ?       ?      0.00    25.47  
1 1 1 -9  -13 5  o 12 264.87  47.01  2446.60   688.64   0.00     0.00     2446.60   688.64   ?       ?      264.87  47.01  0.00    47.01  
1 1 1 -9  -13 6  f 0  97.31   16.16  285.21    87.09    290.01   136.47   281.92    113.12   96.06   24.63  95.40   21.20  0.66    32.50  
1 1 1 -9  -13 7  o 3  120.82  16.34  436.85    110.45   460.22   167.82   418.99    146.69   121.12  24.97  116.18  22.81  4.93    33.82  
1 1 1 -9  -13 8  o 18 162.68  18.14  793.32    166.50   895.57   239.49   697.64    231.65   169.75  25.35  148.09  28.28  21.66   37.98  
1 1 1 -9  -13 9  o 4  171.78  18.77  887.86    182.06   995.21   260.34   785.13    254.69   178.32  26.21  156.36  29.45  21.96   39.43  
1 1 1 -9  -13 10 o 12 189.58  21.46  1096.51   229.40   1073.49  330.34   1117.95   318.82   180.65  33.07  185.84  30.97  -5.19   45.31  
1 1 1 -9  -13 11 o 11 55.83   19.76  83.48     79.18    57.70    156.12   92.41     91.87    63.96   26.35  59.14   21.25  4.82    33.85  
1 1 1 -9  -12 1  o 6  207.85  22.64  1296.12   265.82   1338.84  379.11   1254.80   372.84   206.50  33.10  199.45  33.77  7.05    47.28  
1 1 1 -9  -12 2  o 19 258.82  28.22  2048.03   412.55   1997.29  585.41   2098.09   581.48   246.22  42.98  253.64  41.36  -7.42   59.65  
1 1 1 -9  -12 3  o 1  189.71  21.01  1077.11   224.98   1052.48  322.33   1100.50   314.18   182.89  31.86  187.93  30.14  -5.04   43.86  
1 1 1 -9  -12 4  x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  -12 5  o 10 142.48  17.15  603.82    137.47   679.33   200.72   537.12    188.67   148.82  24.34  131.43  25.93  17.39   35.56  
1 1 1 -9  -12 6  o 2  214.55  23.35  1392.46   282.91   1438.41  403.17   1347.89   397.10   212.22  34.26  204.85  35.02  7.36    48.99  
1 1 1 -9  -12 7  o 10 137.00  16.87  558.96    129.84   598.44   190.78   524.90    177.22   139.12  24.80  130.16  24.62  8.96    34.94  
1 1 1 -9  -12 8  o 19 125.62  16.37  470.53    115.22   486.18   170.91   457.50    156.00   125.01  24.69  121.69  23.18  3.32    33.86  
1 1 1 -9  -12 9  o 6  127.58  15.96  484.73    114.34   599.71   169.33   388.36    155.03   140.16  21.75  111.27  24.89  28.89   33.06  
1 1 1 -9  -12 10 o 11 193.07  20.60  1123.92   224.79   1170.34  313.65   1074.91   322.33   192.60  29.29  182.99  31.84  9.61    43.26  
1 1 1 -9  -12 11 o 1  104.64  18.31  333.44    106.00   342.75   170.25   327.55    135.46   103.42  28.00  102.11  23.58  1.31    36.61  
1 1 1 -9  -12 12 o 4  112.64  17.35  383.95    108.57   429.86   179.35   357.39    136.39   115.60  27.44  106.73  22.94  8.87    35.77  
1 1 1 -9  -12 13 o 11 89.48   19.04  247.62    94.77    325.54   172.58   213.97    113.40   100.30  28.59  82.54   23.05  17.76   36.72  
1 1 1 -9  -11 1  o 11 366.13  66.55  4821.33   1347.35  0.00     0.00     4821.33   1347.35  ?       ?      366.13  66.55  0.00    66.55  
1 1 1 -9  -11 2  o 1  136.07  24.14  563.15    181.67   0.00     0.00     563.15    181.67   ?       ?      136.07  24.14  0.00    24.14  
1 1 1 -9  -11 3  x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  -11 4  o 14 210.35  34.01  1382.60   396.67   0.00     0.00     1382.60   396.67   ?       ?      210.35  34.01  0.00    34.01  
1 1 1 -9  -11 5  o 9  133.07  23.21  538.66    170.84   0.00     0.00     538.66    170.84   ?       ?      133.07  23.21  0.00    23.21  
1 1 1 -9  -11 6  o 4  188.39  30.64  1103.28   320.00   0.00     0.00     1103.28   320.00   ?       ?      188.39  30.64  0.00    30.64  
1 1 1 -9  -11 7  o 8  185.06  30.24  1067.06   310.22   0.00     0.00     1067.06   310.22   ?       ?      185.06  30.24  0.00    30.24  
1 1 1 -9  -11 8  o 4  393.55  92.45  7359.31   2053.01  0.00     0.00     7359.31   2053.01  ?       ?      393.55  92.45  0.00    92.45  
1 1 1 -9  -11 9  o 1  219.97  66.50  1962.26   910.79   1962.26  910.79   0.00      0.00     219.97  66.50  ?       ?      0.00    66.50  
1 1 1 -9  -11 10 o 9  260.97  35.70  2186.22   520.82   2322.18  1008.32  2136.75   608.25   234.22  69.78  251.69  43.68  -17.47  82.32  
1 1 1 -9  -11 11 o 10 245.89  35.96  1957.43   492.63   2240.00  1168.35  1896.33   543.28   217.47  76.01  237.87  41.28  -20.40  86.49  
1 1 1 -9  -11 12 o 6  121.24  23.74  457.25    159.34   0.00     0.00     457.25    159.34   ?       ?      121.24  23.74  0.00    23.74  
1 1 1 -9  -11 13 o 12 158.27  26.73  787.24    234.21   243.51   992.10   819.33    241.03   131.94  59.98  161.42  26.96  -29.47  65.76  
1 1 1 -9  -11 14 o 12 87.93   21.21  241.67    105.79   30.78    1047.57  243.84    106.34   125.84  58.76  88.32   21.24  37.53   62.48  
1 1 1 -9  -11 15 o 13 57.62   18.84  96.61     71.71    106.47   143.45   93.33     82.80    67.82   26.11  58.16   20.24  9.66    33.04  
1 1 1 -9  -10 1  o 2  367.97  39.81  4186.20   827.48   4223.14  1170.62  4149.31   1169.86  354.90  59.57  351.22  60.19  3.68    84.68  
1 1 1 -9  -10 2  o 11 359.37  38.78  3990.57   787.45   4109.47  1114.77  3872.16   1112.47  350.95  57.31  338.82  59.36  12.13   82.51  
1 1 1 -9  -10 3  x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  -10 4  o 10 203.59  21.91  1230.51   252.05   1245.83  358.43   1215.51   354.52   201.22  32.11  198.67  32.18  2.54    45.46  
1 1 1 -9  -10 5  o 16 197.01  21.34  1151.98   237.49   1159.12  338.56   1145.06   333.24   194.06  31.47  192.98  31.14  1.07    44.27  
1 1 1 -9  -10 6  o 18 237.89  25.44  1696.64   342.05   1671.34  484.99   1721.67   482.49   230.35  38.00  234.32  37.10  -3.97   53.11  
1 1 1 -9  -10 7  o 3  413.66  47.18  5566.76   1100.39  5526.06  1556.93  5607.38   1555.44  382.51  73.57  386.36  72.80  -3.85   103.50 
1 1 1 -9  -10 8  o 3  319.99  34.35  3176.03   621.14   3488.46  879.86   2865.62   877.01   324.00  48.82  287.98  55.06  36.02   73.58  
1 1 1 -9  -10 9  o 2  302.99  33.00  2849.89   564.77   2894.28  800.46   2805.89   796.96   292.62  49.41  287.42  50.12  5.19    70.38  
1 1 1 -9  -10 10 o 13 357.43  39.80  4117.59   802.74   4534.33  1137.86  3704.65   1132.66  355.47  57.74  311.93  65.35  43.54   87.20  
1 1 1 -9  -10 11 o 19 91.52   18.54  255.14    94.08    360.03   143.54   176.16    124.56   107.70  23.85  77.10   24.80  30.60   34.40  
1 1 1 -9  -10 12 o 15 57.57   20.08  89.01     81.53    57.29    132.66   108.27    103.35   60.90   24.58  63.77   22.58  -2.87   33.38  
1 1 1 -9  -10 13 o 19 187.76  30.90  1118.58   321.49   1118.58  321.49   0.00      0.00     187.76  30.90  ?       ?      0.00    30.90  
1 1 1 -9  -10 14 o 17 162.92  18.78  796.82    172.47   838.10   249.79   759.21    238.41   163.22  27.64  155.12  27.79  8.11    39.20  
1 1 1 -9  -10 15 o 5  163.67  18.06  803.82    166.87   996.76   246.20   639.89    226.94   179.40  24.55  141.10  28.99  38.30   37.99  
1 1 1 -9  -10 16 o 11 68.97   20.61  145.71    87.87    0.00     0.00     145.71    87.87    ?       ?      68.97   20.61  0.00    20.61  
1 1 1 -9  -10 17 o 17 187.19  29.68  1131.69   308.27   1289.85  1046.61  1116.67   322.59   161.77  67.56  184.63  31.57  -22.86  74.57  
1 1 1 -9  -9  1  o 10 211.45  33.34  1355.36   391.35   1355.36  391.35   0.00      0.00     211.45  33.34  ?       ?      0.00    33.34  
1 1 1 -9  -9  2  o 18 626.13  185.88 25720.85  7164.77  25720.85 7164.77  0.00      0.00     626.13  185.88 ?       ?      0.00    185.88 
1 1 1 -9  -9  3  x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  -9  4  o 4  335.20  55.07  3648.75   1022.94  3648.75  1022.94  0.00      0.00     335.20  55.07  ?       ?      0.00    55.07  
1 1 1 -9  -9  5  o 1  235.31  37.52  1713.87   489.84   1713.87  489.84   0.00      0.00     235.31  37.52  ?       ?      0.00    37.52  
1 1 1 -9  -9  6  o 11 143.81  24.97  626.04    198.65   626.04   198.65   0.00      0.00     143.81  24.97  ?       ?      0.00    24.97  
1 1 1 -9  -9  7  f 0  132.54  23.89  532.51    175.06   532.51   175.06   0.00      0.00     132.54  23.89  ?       ?      0.00    23.89  
1 1 1 -9  -9  8  o 14 315.53  53.30  3318.59   931.17   3318.59  931.17   0.00      0.00     315.53  53.30  ?       ?      0.00    53.30  
1 1 1 -9  -9  9  o 2  188.69  30.63  1096.81   320.46   1096.81  320.46   0.00      0.00     188.69  30.63  ?       ?      0.00    30.63  
1 1 1 -9  -9  10 o 6  333.27  59.74  3915.40   1101.04  3915.40  1101.04  0.00      0.00     333.27  59.74  ?       ?      0.00    59.74  
1 1 1 -9  -9  11 f 0  245.35  41.34  1957.10   561.60   1957.10  561.60   0.00      0.00     245.35  41.34  ?       ?      0.00    41.34  
1 1 1 -9  -9  12 o 5  238.89  40.78  1870.20   539.16   1870.20  539.16   0.00      0.00     238.89  40.78  ?       ?      0.00    40.78  
1 1 1 -9  -9  13 o 2  101.12  25.90  320.55    151.02   320.55   151.02   0.00      0.00     101.12  25.90  ?       ?      0.00    25.90  
1 1 1 -9  -9  14 f 0  182.24  32.13  1060.31   323.84   1060.31  323.84   0.00      0.00     182.24  32.13  ?       ?      0.00    32.13  
1 1 1 -9  -9  15 o 5  122.06  26.57  471.05    180.91   471.05   180.91   0.00      0.00     122.06  26.57  ?       ?      0.00    26.57  
1 1 1 -9  -9  16 o 5  168.32  30.88  912.90    287.42   912.90   287.42   0.00      0.00     168.32  30.88  ?       ?      0.00    30.88  
1 1 1 -9  -9  17 o 14 188.71  34.86  1187.76   363.80   1187.76  363.80   0.00      0.00     188.71  34.86  ?       ?      0.00    34.86  
1 1 1 -9  -9  18 o 15 75.15   17.70  174.80    75.10    343.20   152.50   120.88    86.29    103.22  25.81  63.77   20.65  39.45   33.05  
1 1 1 -9  -8  1  o 3  651.68  76.66  14266.23  2813.02  14161.89 3978.50  14370.55  3977.92  589.53  121.60 595.72  120.46 -6.19   171.16 
1 1 1 -9  -8  2  o 4  527.07  96.90  10128.80  2824.05  10128.80 2824.05  0.00      0.00     527.07  96.90  ?       ?      0.00    96.90  
1 1 1 -9  -8  3  o 6  347.63  55.63  3830.70   1072.81  0.00     0.00     3830.70   1072.81  ?       ?      347.63  55.63  0.00    55.63  
1 1 1 -9  -8  4  o 2  531.57  59.15  8980.89   1774.50  8803.54  2509.78  9158.17   2509.28  495.15  91.67  507.73  89.35  -12.58  128.01 
1 1 1 -9  -8  5  o 18 500.67  55.28  7919.12   1562.54  7888.73  2210.16  7949.48   2209.38  472.96  84.50  475.28  84.05  -2.31   119.19 
1 1 1 -9  -8  6  o 19 425.15  46.30  5611.10   1111.73  5427.62  1572.86  5794.28   1571.58  398.82  71.32  414.92  68.36  -16.10  98.79  
1 1 1 -9  -8  7  o 19 358.30  38.15  3922.78   772.62   4096.47  1093.53  3749.66   1091.76  354.97  55.48  337.20  58.52  17.77   80.64  
1 1 1 -9  -8  8  o 7  186.56  29.55  1058.46   305.95   0.00     0.00     1058.46   305.95   ?       ?      186.56  29.55  0.00    29.55  
1 1 1 -9  -8  9  o 8  250.74  27.00  1885.96   382.59   1799.16  542.50   1971.84   539.64   238.37  41.13  251.06  38.68  -12.70  56.46  
1 1 1 -9  -8  10 o 6  343.90  36.79  3660.19   714.98   4092.21  1013.33  3231.89   1008.96  352.23  51.65  306.01  59.58  46.22   78.85  
1 1 1 -9  -8  11 o 16 213.67  23.32  1364.34   281.45   1407.00  403.78   1324.02   392.53   212.42  34.28  205.86  34.43  6.55    48.58  
1 1 1 -9  -8  12 o 15 337.52  36.59  3571.06   697.61   3939.81  989.57   3206.74   983.60   340.80  52.24  300.60  59.11  40.20   78.89  
1 1 1 -9  -8  13 o 11 194.49  21.17  1131.55   232.59   1265.32  335.05   1007.12   323.13   202.04  29.78  178.49  32.74  23.54   44.26  
1 1 1 -9  -8  14 o 11 158.08  17.76  743.44    158.40   815.40   226.39   674.44    221.70   163.01  24.99  147.08  27.26  15.93   36.98  
1 1 1 -9  -8  15 o 12 208.61  22.28  1314.62   262.70   1307.53  359.87   1322.71   384.37   202.97  31.94  202.79  34.23  0.19    46.82  
1 1 1 -9  -8  16 o 18 211.47  21.13  1348.53   253.04   1561.86  349.02   1112.15   367.40   224.04  27.73  183.68  36.13  40.36   45.54  
1 1 1 -9  -8  17 o 8  98.68   16.11  293.72    88.12    322.90   145.18   276.70    110.88   100.94  25.15  94.35   21.01  6.58    32.77  
1 1 1 -9  -8  18 o 14 93.66   16.23  266.19    84.11    357.31   147.61   222.38    102.35   105.97  24.72  84.27   21.18  21.70   32.56  
1 1 1 -9  -8  19 o 19 102.75  27.27  343.72    163.52   343.72   163.52   0.00      0.00     102.75  27.27  ?       ?      0.00    27.27  
1 1 1 -9  -7  1  o 2  334.85  35.23  3372.23   667.06   3399.57  944.80   3345.07   941.95   327.90  51.92  325.03  52.25  2.87    73.66  
1 1 1 -9  -7  2  x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  -7  3  o 13 91.75   15.55  249.89    79.00    229.25   114.30   268.77    109.32   87.14   22.65  94.40   20.74  -7.26   30.71  
1 1 1 -9  -7  4  o 6  106.62  15.32  334.96    91.08    322.84   130.50   346.46    127.17   103.38  22.62  107.36  21.38  -3.98   31.13  
1 1 1 -9  -7  5  o 9  531.11  58.81  8922.46   1762.93  8743.65  2493.24  9101.26   2493.09  496.19  90.88  508.84  88.56  -12.65  126.90 
1 1 1 -9  -7  6  o 2  249.89  26.07  1844.13   368.50   1923.64  521.54   1764.87   520.74   251.79  37.20  240.32  39.09  11.47   53.96  
1 1 1 -9  -7  7  o 12 428.52  46.06  5645.15   1115.28  5603.92  1577.64  5686.33   1576.84  410.77  69.37  414.36  68.70  -3.59   97.63  
1 1 1 -9  -7  8  o 13 106.08  15.41  332.13    91.10    310.34   132.54   351.64    125.42   101.11  23.31  108.13  20.96  -7.02   31.35  
1 1 1 -9  -7  9  o 11 240.60  25.39  1719.71   345.36   1829.37  489.88   1611.36   486.97   244.28  36.01  227.94  38.59  16.35   52.78  
1 1 1 -9  -7  10 o 16 292.80  47.83  2755.46   776.27   2755.46  776.27   0.00      0.00     292.80  47.83  ?       ?      0.00    47.83  
1 1 1 -9  -7  11 o 10 287.88  30.68  2513.29   499.27   2616.33  707.99   2411.36   704.16   285.77  44.61  272.89  46.62  12.89   64.53  
1 1 1 -9  -7  12 o 17 149.85  18.23  665.09    153.61   619.97   226.11   703.75    209.32   141.54  28.81  152.33  24.79  -10.79  38.01  
1 1 1 -9  -7  13 o 18 69.06   19.40  143.94    80.07    263.98   130.07   70.69     101.60   92.59   24.20  57.80   22.05  34.79   32.74  
1 1 1 -9  -7  14 o 3  288.24  26.51  2517.49   433.79   2764.83  565.70   2164.47   675.84   297.52  33.72  252.45  48.40  45.07   58.98  
1 1 1 -9  -7  15 o 1  171.18  18.66  873.23    180.41   909.46   253.24   835.90    257.09   171.66  26.55  163.64  28.40  8.02    38.88  
1 1 1 -9  -7  16 o 16 116.63  15.77  405.49    102.90   466.36   155.58   358.16    137.20   122.98  22.88  107.43  22.94  15.55   32.40  
1 1 1 -9  -7  17 o 3  95.99   16.07  277.70    85.44    279.65   139.49   276.54    108.09   94.22   25.27  94.60   20.50  -0.38   32.54  
1 1 1 -9  -7  18 o 17 63.45   17.34  123.07    64.97    199.68   118.41   90.07     77.72    80.25   23.91  57.04   19.62  23.20   30.93  
1 1 1 -9  -7  19 o 10 94.40   15.54  269.36    81.28    273.22   141.03   267.44    99.46    92.47   25.66  92.94   19.27  -0.47   32.10  
1 1 1 -9  -7  20 o 19 64.56   17.71  128.71    67.61    262.06   135.78   84.74     77.97    90.29   25.23  55.72   19.62  34.56   31.96  
1 1 1 -9  -6  1  o 8  253.26  39.22  1964.05   551.77   1964.05  551.77   0.00      0.00     253.26  39.22  ?       ?      0.00    39.22  
1 1 1 -9  -6  2  o 5  482.18  86.71  8295.40   2312.02  0.00     0.00     8295.40   2312.02  ?       ?      482.18  86.71  0.00    86.71  
1 1 1 -9  -6  3  o 11 338.82  35.68  3456.42   683.59   3441.04  967.52   3471.75   965.98   329.29  52.98  331.00  52.59  -1.71   74.65  
1 1 1 -9  -6  4  o 2  329.88  34.61  3267.79   645.71   3332.80  914.10   3203.04   912.25   325.45  50.57  318.33  51.69  7.12    72.31  
1 1 1 -9  -6  5  o 13 495.62  54.51  7725.49   1525.37  7601.46  2157.49  7849.44   2156.90  465.92  83.74  475.31  82.01  -9.39   117.21 
1 1 1 -9  -6  6  o 14 252.89  26.53  1890.42   379.45   1788.84  536.50   1992.10   536.76   241.56  40.09  256.10  37.63  -14.55  54.99  
1 1 1 -9  -6  7  o 4  362.78  38.51  3967.02   789.77   3727.36  1116.85  4206.73   1116.96  340.98  59.20  365.16  54.99  -24.18  80.80  
1 1 1 -9  -6  8  o 19 546.35  60.78  9516.99   1873.94  9622.51  2650.12  9411.47   2650.18  518.02  92.51  510.74  93.85  7.28    131.78 
1 1 1 -9  -6  9  o 10 203.06  21.86  1213.70   250.79   1233.99  356.71   1193.87   352.67   202.09  31.80  198.65  32.01  3.45    45.12  
1 1 1 -9  -6  10 o 8  194.03  21.21  1110.11   232.36   1087.28  330.20   1132.51   327.02   189.06  31.53  193.38  30.46  -4.32   43.85  
1 1 1 -9  -6  11 o 10 176.39  19.57  917.91    194.88   962.56   277.01   874.16    274.22   178.30  27.98  169.34  29.27  8.96    40.49  
1 1 1 -9  -6  12 o 10 193.12  21.14  1105.83   230.52   1075.59  327.24   1135.63   324.78   186.88  31.63  192.61  30.38  -5.74   43.86  
1 1 1 -9  -6  13 o 9  219.56  23.52  1439.29   291.78   1509.81  416.26   1371.17   409.11   220.55  33.97  209.38  35.29  11.17   48.98  
1 1 1 -9  -6  14 o 5  157.65  18.36  736.93    163.07   762.05   236.72   714.24    224.97   157.54  27.16  152.58  26.65  4.96    38.05  
1 1 1 -9  -6  15 o 19 71.51   18.88  155.76    78.63    194.42   130.24   133.59    98.64    80.63   25.29  67.97   22.08  12.66   33.57  
1 1 1 -9  -6  16 o 7  109.72  21.75  369.92    132.18   0.00     0.00     369.92    132.18   ?       ?      109.72  21.75  0.00    21.75  
1 1 1 -9  -6  17 o 4  239.44  22.80  1735.03   309.68   1909.97  414.73   1514.58   465.56   246.97  29.86  213.15  39.50  33.81   49.52  
1 1 1 -9  -6  18 o 14 116.10  15.48  402.45    100.63   437.48   154.47   376.63    132.64   118.44  23.55  110.30  21.72  8.13    32.04  
1 1 1 -9  -6  19 o 3  140.78  15.64  590.74    124.30   738.78   186.07   471.42    167.04   155.32  21.44  122.27  24.65  33.04   32.67  
1 1 1 -9  -6  20 o 12 53.44   17.43  82.83     61.44    116.51   114.49   69.21     72.82    65.66   23.71  52.06   18.89  13.60   30.31  
1 1 1 -9  -6  21 f 0  183.06  19.53  1023.40   202.11   1119.40  289.29   931.87    282.48   186.06  27.95  167.77  30.45  18.28   41.33  
1 1 1 -9  -5  1  x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  -5  2  f 0  522.97  57.53  8623.35   1698.57  8662.81  2402.35  8583.90   2401.93  497.24  87.35  494.43  87.84  2.81    123.88 
1 1 1 -9  -5  3  o 7  426.16  45.76  5571.46   1102.05  5398.94  1558.79  5743.86   1558.27  403.23  69.87  418.21  67.18  -14.98  96.93  
1 1 1 -9  -5  4  o 5  68.32   16.30  140.43    63.04    0.00     0.00     140.43    63.04    ?       ?      68.32   16.30  0.00    16.30  
1 1 1 -9  -5  5  o 10 405.64  67.92  5471.55   1525.84  0.00     0.00     5471.55   1525.84  ?       ?      405.64  67.92  0.00    67.92  
1 1 1 -9  -5  6  o 8  468.08  83.00  7707.47   2148.62  0.00     0.00     7707.47   2148.62  ?       ?      468.08  83.00  0.00    83.00  
1 1 1 -9  -5  7  o 19 327.68  52.13  3387.58   947.79   0.00     0.00     3387.58   947.79   ?       ?      327.68  52.13  0.00    52.13  
1 1 1 -9  -5  8  o 11 136.79  24.39  561.61    184.53   0.00     0.00     561.61    184.53   ?       ?      136.79  24.39  0.00    24.39  
1 1 1 -9  -5  9  o 16 167.32  27.57  840.60    255.62   0.00     0.00     840.60    255.62   ?       ?      167.32  27.57  0.00    27.57  
1 1 1 -9  -5  10 o 18 71.43   23.03  144.89    107.40   0.00     0.00     144.89    107.40   ?       ?      71.43   23.03  0.00    23.03  
1 1 1 -9  -5  11 o 13 263.89  41.65  2158.93   610.07   0.00     0.00     2158.93   610.07   ?       ?      263.89  41.65  0.00    41.65  
1 1 1 -9  -5  12 o 17 247.70  39.42  1910.42   541.71   0.00     0.00     1910.42   541.71   ?       ?      247.70  39.42  0.00    39.42  
1 1 1 -9  -5  13 o 17 407.54  76.79  6201.90   1730.75  0.00     0.00     6201.90   1730.75  ?       ?      407.54  76.79  0.00    76.79  
1 1 1 -9  -5  14 o 19 193.07  31.14  1150.46   333.38   0.00     0.00     1150.46   333.38   ?       ?      193.07  31.14  0.00    31.14  
1 1 1 -9  -5  15 o 1  136.31  23.67  565.95    178.48   0.00     0.00     565.95    178.48   ?       ?      136.31  23.67  0.00    23.67  
1 1 1 -9  -5  16 o 8  256.69  43.14  2177.75   613.13   0.00     0.00     2177.75   613.13   ?       ?      256.69  43.14  0.00    43.14  
1 1 1 -9  -5  17 o 16 89.94   19.87  248.63    99.85    -347.99  661.34   262.55    101.01   99.50   46.53  92.53   19.63  6.97    50.50  
1 1 1 -9  -5  18 f 0  118.28  20.88  428.82    136.61   280.08   699.14   434.72    139.29   123.02  53.39  119.01  21.16  4.00    57.43  
1 1 1 -9  -5  19 f 0  64.69   18.90  127.28    74.58    539.62   706.85   122.64    75.00    132.86  55.51  63.68   19.04  69.18   58.69  
1 1 1 -9  -5  20 o 8  124.89  21.06  481.85    145.65   118.58   757.25   495.80    148.42   115.49  52.46  126.69  21.15  -11.21  56.56  
1 1 1 -9  -5  21 o 18 72.55   18.75  164.07    78.67    -63.55   873.45   165.93    78.99    112.21  52.79  72.95   18.76  39.25   56.03  
1 1 1 -9  -5  22 o 8  83.40   18.29  217.14    85.15    459.66   918.65   215.04    85.52    124.46  57.01  82.95   18.44  41.52   59.92  
1 1 1 -9  -4  1  o 15 726.48  173.33 25591.95  7127.56  0.00     0.00     25591.95  7127.56  ?       ?      726.48  173.33 0.00    173.33 
1 1 1 -9  -4  2  o 7  347.91  54.67  3783.09   1055.89  0.00     0.00     3783.09   1055.89  ?       ?      347.91  54.67  0.00    54.67  
1 1 1 -9  -4  3  o 10 124.60  19.95  460.90    137.86   0.00     0.00     460.90    137.86   ?       ?      124.60  19.95  0.00    19.95  
1 1 1 -9  -4  4  o 7  436.20  72.96  6322.31   1762.44  0.00     0.00     6322.31   1762.44  ?       ?      436.20  72.96  0.00    72.96  
1 1 1 -9  -4  5  o 9  172.46  26.43  889.24    253.30   0.00     0.00     889.24    253.30   ?       ?      172.46  26.43  0.00    26.43  
1 1 1 -9  -4  6  o 7  243.87  25.34  1757.68   349.56   1732.52  494.83   1782.75   493.88   238.19  37.42  241.95  36.71  -3.76   52.42  
1 1 1 -9  -4  7  o 1  515.39  57.54  8482.02   1673.33  8404.60  2366.55  8559.42   2366.34  481.93  88.81  487.60  87.76  -5.68   124.86 
1 1 1 -9  -4  8  o 6  321.24  33.71  3094.90   612.38   3141.68  866.40   3048.19   865.67   316.34  49.32  311.05  50.19  5.29    70.36  
1 1 1 -9  -4  9  o 11 357.68  37.76  3859.57   763.59   3851.36  1080.09  3867.78   1079.68  347.71  56.01  348.56  55.84  -0.86   79.09  
1 1 1 -9  -4  10 o 15 465.01  50.37  6711.88   1323.13  6777.02  1871.64  6646.80   1870.74  447.70  75.51  442.54  76.40  5.17    107.42 
1 1 1 -9  -4  11 o 13 385.97  41.07  4532.55   896.05   4530.25  1267.69  4534.84   1266.72  373.72  61.21  373.97  61.11  -0.26   86.49  
1 1 1 -9  -4  12 o 5  207.88  22.42  1275.95   263.38   1178.95  372.54   1372.89   372.42   196.15  34.33  213.04  31.39  -16.89  46.52  
1 1 1 -9  -4  13 o 6  317.84  33.99  3071.21   610.58   3026.09  863.51   3116.33   863.47   305.38  51.06  310.60  50.13  -5.22   71.56  
1 1 1 -9  -4  14 o 14 283.22  30.30  2433.50   485.02   2416.97  686.36   2449.99   685.49   273.68  45.27  275.87  44.82  -2.18   63.70  
1 1 1 -9  -4  15 o 3  327.95  35.23  3337.27   652.84   3545.11  923.72   3129.85   922.78   325.54  51.11  302.05  55.25  23.49   75.27  
1 1 1 -9  -4  16 o 6  344.02  52.19  4044.48   998.37   2919.01  1478.89  4986.87   1353.28  251.55  85.61  364.70  67.11  -113.15 108.78 
1 1 1 -9  -4  17 o 1  182.57  18.77  992.08    193.96   1006.97  264.27   974.70    285.55   181.02  26.19  176.70  29.17  4.32    39.20  
1 1 1 -9  -4  18 o 3  117.08  15.01  407.54    98.54    392.19   141.74   421.91    137.09   112.50  22.73  117.31  21.13  -4.81   31.04  
1 1 1 -9  -4  19 o 13 219.71  22.00  1465.60   273.75   1592.49  371.05   1314.05   405.52   224.45  29.51  198.62  36.92  25.83   47.27  
1 1 1 -9  -4  20 o 3  222.49  21.19  1504.58   267.33   1705.73  362.99   1266.18   395.18   232.61  27.73  193.55  36.91  39.06   46.17  
1 1 1 -9  -4  21 o 19 98.74   15.18  294.18    83.31    387.53   139.87   242.86    103.71   110.83  22.75  87.91   20.87  22.92   30.87  
1 1 1 -9  -4  22 o 14 194.14  31.38  1257.96   337.78   1257.96  337.78   0.00      0.00     194.14  31.38  ?       ?      0.00    31.38  
1 1 1 -9  -4  23 o 6  60.86   23.73  84.17     119.56   84.17    119.56   0.00      0.00     60.86   23.73  ?       ?      0.00    23.73  
1 1 1 -9  -3  1  o 17 640.14  122.35 15552.97  4332.29  0.00     0.00     15552.97  4332.29  ?       ?      640.14  122.35 0.00    122.35 
1 1 1 -9  -3  2  o 1  292.60  44.94  2613.04   730.75   0.00     0.00     2613.04   730.75   ?       ?      292.60  44.94  0.00    44.94  
1 1 1 -9  -3  3  o 7  393.97  41.24  4664.74   918.81   4721.70  1299.62  4607.82   1299.16  386.90  60.49  381.64  61.38  5.27    86.18  
1 1 1 -9  -3  4  o 12 146.78  15.78  629.03    130.86   529.85   184.13   730.24    186.00   132.80  25.07  157.33  21.13  -24.52  32.79  
1 1 1 -9  -3  5  o 4  217.13  22.66  1385.24   278.28   1223.24  392.96   1548.23   394.14   200.54  35.43  227.54  30.98  -27.00  47.06  
1 1 1 -9  -3  6  o 15 689.87  84.59  16481.08  3279.81  14917.09 4638.27  18045.17  4638.42  569.78  142.25 656.94  127.59 -87.16  191.09 
1 1 1 -9  -3  7  o 12 142.65  23.64  608.88    186.79   608.88   186.79   0.00      0.00     142.65  23.64  ?       ?      0.00    23.64  
1 1 1 -9  -3  8  f 0  367.90  60.43  4409.68   1231.93  4409.68  1231.93  0.00      0.00     367.90  60.43  ?       ?      0.00    60.43  
1 1 1 -9  -3  9  o 2  367.53  60.32  4395.97   1228.64  4395.97  1228.64  0.00      0.00     367.53  60.32  ?       ?      0.00    60.32  
1 1 1 -9  -3  10 f 0  194.06  30.67  1135.83   330.37   1135.83  330.37   0.00      0.00     194.06  30.67  ?       ?      0.00    30.67  
1 1 1 -9  -3  11 o 5  313.54  49.74  3083.04   865.48   3083.04  865.48   0.00      0.00     313.54  49.74  ?       ?      0.00    49.74  
1 1 1 -9  -3  12 o 10 274.05  43.12  2324.92   655.98   2324.92  655.98   0.00      0.00     274.05  43.12  ?       ?      0.00    43.12  
1 1 1 -9  -3  13 f 0  343.66  56.72  3859.98   1080.03  3859.98  1080.03  0.00      0.00     343.66  56.72  ?       ?      0.00    56.72  
1 1 1 -9  -3  14 o 14 166.52  27.21  841.87    251.16   841.87   251.16   0.00      0.00     166.52  27.21  ?       ?      0.00    27.21  
1 1 1 -9  -3  15 f 0  131.29  23.40  523.63    169.89   523.63   169.89   0.00      0.00     131.29  23.40  ?       ?      0.00    23.40  
1 1 1 -9  -3  16 o 13 215.01  34.83  1454.38   415.19   1454.38  415.19   0.00      0.00     215.01  34.83  ?       ?      0.00    34.83  
1 1 1 -9  -3  17 o 16 184.07  30.24  1057.76   308.49   1057.76  308.49   0.00      0.00     184.07  30.24  ?       ?      0.00    30.24  
1 1 1 -9  -3  18 o 19 92.91   21.94  267.61    115.13   267.61   115.13   0.00      0.00     92.91   21.94  ?       ?      0.00    21.94  
1 1 1 -9  -3  19 o 1  71.59   21.85  155.56    98.04    155.56   98.04    0.00      0.00     71.59   21.85  ?       ?      0.00    21.85  
1 1 1 -9  -3  20 o 17 57.57   20.99  84.49     90.02    84.49    90.02    0.00      0.00     57.57   20.99  ?       ?      0.00    20.99  
1 1 1 -9  -3  21 o 17 84.47   21.96  225.09    107.49   225.09   107.49   0.00      0.00     84.47   21.96  ?       ?      0.00    21.96  
1 1 1 -9  -3  22 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  -3  23 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  -2  1  o 1  576.52  62.82  10404.79  2045.50  10631.15 2892.97  10178.49  2892.59  556.31  93.93  541.66  96.57  14.65   134.71 
1 1 1 -9  -2  2  o 14 371.08  39.03  4117.11   819.07   3800.75  1158.12  4433.71   1158.55  347.12  60.31  378.20  54.97  -31.08  81.60  
1 1 1 -9  -2  3  o 15 322.66  34.04  3092.14   621.10   2670.08  877.91   3515.08   878.81   292.15  54.35  339.72  46.26  -47.57  71.37  
1 1 1 -9  -2  4  o 10 541.22  94.73  10179.53  2836.12  10179.53 2836.12  0.00      0.00     541.22  94.73  ?       ?      0.00    94.73  
1 1 1 -9  -2  5  o 6  502.02  86.29  8602.59   2397.05  8602.59  2397.05  0.00      0.00     502.02  86.29  ?       ?      0.00    86.29  
1 1 1 -9  -2  6  o 19 238.44  36.34  1721.47   481.68   1721.47  481.68   0.00      0.00     238.44  36.34  ?       ?      0.00    36.34  
1 1 1 -9  -2  7  o 16 455.53  78.59  7103.55   1980.83  7103.55  1980.83  0.00      0.00     455.53  78.59  ?       ?      0.00    78.59  
1 1 1 -9  -2  8  f 0  288.88  45.49  2599.03   729.41   2599.03  729.41   0.00      0.00     288.88  45.49  ?       ?      0.00    45.49  
1 1 1 -9  -2  9  o 4  544.24  61.79  9647.13   1896.48  9825.37  2682.45  9468.99   2681.62  511.56  94.83  499.15  97.08  12.41   135.71 
1 1 1 -9  -2  10 o 3  207.52  21.99  1268.80   257.98   1229.38  366.65   1307.45   363.06   201.12  32.89  208.03  31.38  -6.91   45.46  
1 1 1 -9  -2  11 o 13 381.79  40.28  4432.07   869.62   4647.61  1230.56  4217.04   1229.11  380.15  58.24  359.46  61.79  20.69   84.91  
1 1 1 -9  -2  12 o 18 295.59  31.20  2608.57   521.40   2513.84  737.89   2703.04   736.86   283.47  46.99  295.15  44.90  -11.69  64.99  
1 1 1 -9  -2  13 o 6  66.03   16.01  131.24    60.04    106.72   92.74    148.94    78.78    62.92   21.44  70.43   19.03  -7.51   28.67  
1 1 1 -9  -2  14 o 2  88.19   14.08  230.52    68.90    223.21   104.43   236.16    91.69    85.72   21.31  88.46   18.65  -2.74   28.32  
1 1 1 -9  -2  15 o 16 191.01  30.61  1121.06   324.28   1121.06  324.28   0.00      0.00     191.01  30.61  ?       ?      0.00    30.61  
1 1 1 -9  -2  16 o 8  260.52  27.25  2055.04   401.47   2230.33  569.50   1881.88   566.04   265.00  38.57  240.64  42.53  24.36   57.41  
1 1 1 -9  -2  17 o 11 192.07  18.85  1094.41   205.21   1145.45  272.70   1027.77   311.59   194.22  25.04  181.22  31.07  13.00   39.90  
1 1 1 -9  -2  18 o 9  371.52  42.64  4576.80   892.88   4757.99  1263.91  4396.28   1261.54  349.99  65.31  331.56  68.54  18.43   94.68  
1 1 1 -9  -2  19 o 2  200.52  21.04  1214.63   238.60   1160.72  317.95   1284.13   361.00   191.31  29.93  199.72  32.61  -8.41   44.26  
1 1 1 -9  -2  20 o 2  38.13   14.11  33.73     40.94    -18.61   85.51    49.30     46.63    41.74   18.38  43.29   15.18  -1.55   23.84  
1 1 1 -9  -2  21 o 9  78.05   12.76  182.72    55.20    162.02   97.11    192.60    67.10    72.39   21.68  79.53   15.25  -7.14   26.50  
1 1 1 -9  -2  22 o 19 151.88  15.68  691.71    134.78   753.80   190.77   629.83    190.45   155.59  21.97  140.71  24.46  14.88   32.88  
1 1 1 -9  -2  23 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  -2  24 o 8  52.76   20.95  55.62     94.68    55.62    94.68    0.00      0.00     52.76   20.95  ?       ?      0.00    20.95  
1 1 1 -9  -1  1  o 13 335.49  35.06  3345.89   665.20   3092.31  940.32   3599.92   941.15   315.21  53.90  342.67  49.26  -27.47  73.02  
1 1 1 -9  -1  2  o 9  554.47  97.18  10697.98  2980.45  10697.98 2980.45  0.00      0.00     554.47  97.18  ?       ?      0.00    97.18  
1 1 1 -9  -1  3  o 15 284.89  43.58  2470.52   690.13   2470.52  690.13   0.00      0.00     284.89  43.58  ?       ?      0.00    43.58  
1 1 1 -9  -1  4  o 15 554.69  97.84  10774.36  3001.67  10774.36 3001.67  0.00      0.00     554.69  97.84  ?       ?      0.00    97.84  
1 1 1 -9  -1  5  o 3  660.82  135.22 17795.93  4956.71  17795.93 4956.71  0.00      0.00     660.82  135.22 ?       ?      0.00    135.22 
1 1 1 -9  -1  6  o 4  77.08   12.70  175.65    54.23    197.94   77.57    154.34    75.85    81.24   17.17  71.68   18.36  9.56    25.14  
1 1 1 -9  -1  7  o 15 540.81  59.85  9296.44   1827.11  9466.55  2584.17  9126.39   2583.68  516.05  90.53  504.23  92.67  11.82   129.55 
1 1 1 -9  -1  8  o 18 387.31  41.14  4567.95   900.79   4586.97  1274.10  4548.94   1273.71  375.85  61.15  374.06  61.45  1.79    86.69  
1 1 1 -9  -1  9  o 13 475.15  52.46  7133.27   1407.20  7088.74  1990.43  7177.77   1989.74  448.13  80.32  451.68  79.65  -3.55   113.12 
1 1 1 -9  -1  10 f 0  319.96  33.64  3081.65   608.58   3120.85  861.74   3042.65   859.59   314.00  49.44  309.61  50.07  4.39    70.37  
1 1 1 -9  -1  11 o 7  159.84  17.78  749.74    160.37   726.65   229.58   771.74    224.11   155.25  26.72  160.52  25.15  -5.26   36.69  
1 1 1 -9  -1  12 o 12 330.74  34.57  3289.20   646.78   3463.86  915.96   3115.51   913.41   331.98  49.58  312.82  52.74  19.16   72.38  
1 1 1 -9  -1  13 o 5  236.32  24.55  1651.38   328.26   1772.05  465.73   1532.24   462.75   241.60  34.56  223.32  37.42  18.28   50.94  
1 1 1 -9  -1  14 o 16 235.52  24.58  1646.05   327.42   1697.49  465.10   1595.51   461.03   235.21  35.55  227.50  36.54  7.71    50.98  
1 1 1 -9  -1  15 o 11 191.06  20.43  1080.52   220.64   1052.72  314.92   1107.33   309.23   185.16  30.70  190.57  29.19  -5.41   42.37  
1 1 1 -9  -1  16 o 1  306.10  52.38  3176.44   887.36   0.00     0.00     3176.44   887.36   ?       ?      306.10  52.38  0.00    52.38  
1 1 1 -9  -1  17 o 16 170.89  18.58  867.30    179.34   842.30   256.90   891.07    250.48   164.97  28.14  170.46  26.45  -5.49   38.62  
1 1 1 -9  -1  18 o 6  260.11  24.00  2045.24   354.26   2082.96  450.05   1983.78   574.40   258.33  30.96  243.78  42.59  14.55   52.66  
1 1 1 -9  -1  19 o 9  125.40  14.72  466.48    103.97   493.91   148.74   440.27    145.39   127.04  21.14  119.49  22.01  7.55    30.51  
1 1 1 -9  -1  20 o 9  197.72  18.97  1176.25   212.67   1241.54  286.16   1095.71   317.86   199.60  25.56  183.90  31.22  15.69   40.35  
1 1 1 -9  -1  21 f 0  80.59   12.37  194.10    55.39    243.16   100.90   172.94    66.26    88.14   20.35  75.12   15.86  13.02   25.80  
1 1 1 -9  -1  22 o 12 81.11   21.59  208.52    102.33   208.52   102.33   0.00      0.00     81.11   21.59  ?       ?      0.00    21.59  
1 1 1 -9  -1  23 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  -1  24 o 4  39.25   17.81  -39.91    86.89    -39.91   86.89    0.00      0.00     39.25   17.81  ?       ?      0.00    17.81  
1 1 1 -9  0   1  o 9  224.41  33.91  1510.96   423.28   1510.96  423.28   0.00      0.00     224.41  33.91  ?       ?      0.00    33.91  
1 1 1 -9  0   2  o 1  653.83  128.18 16655.23  4639.17  16655.23 4639.17  0.00      0.00     653.83  128.18 ?       ?      0.00    128.18 
1 1 1 -9  0   3  o 3  244.10  37.02  1795.91   502.44   1795.91  502.44   0.00      0.00     244.10  37.02  ?       ?      0.00    37.02  
1 1 1 -9  0   4  o 2  39.70   11.81  45.92     28.89    14.22    35.50    108.09    49.71    31.98   12.78  60.04   14.57  -28.06  19.39  
1 1 1 -9  0   5  o 4  332.23  34.76  3286.07   653.17   3066.85  923.48   3505.54   923.98   313.54  53.21  337.54  49.13  -23.99  72.42  
1 1 1 -9  0   6  o 1  233.30  24.16  1600.25   318.89   1554.75  451.29   1645.62   450.66   226.76  35.86  233.81  34.62  -7.05   49.84  
1 1 1 -9  0   7  f 0  92.91   12.30  253.05    64.00    197.10   90.22    309.74    90.81    80.86   19.64  102.34  15.98  -21.48  25.32  
1 1 1 -9  0   8  o 13 199.32  20.89  1167.43   235.47   1133.87  333.52   1200.78   332.49   193.76  31.03  199.85  29.90  -6.09   43.09  
1 1 1 -9  0   9  o 14 647.42  78.84  14603.20  2869.66  14840.58 4058.50  14365.86  4058.13  580.62  125.43 566.45  127.84 14.17   179.10 
1 1 1 -9  0   10 o 9  121.50  14.38  432.62    98.36    418.48   140.52   446.20    137.73   118.03  21.53  122.23  20.34  -4.20   29.62  
1 1 1 -9  0   11 o 1  530.47  60.10  9158.53   1797.91  9373.10  2543.02  8944.10   2542.23  500.46  91.90  485.12  94.69  15.34   131.95 
1 1 1 -9  0   12 f 0  292.84  30.72  2562.83   508.73   2557.48  719.79   2568.17   719.11   286.19  45.32  286.88  45.16  -0.69   63.98  
1 1 1 -9  0   13 o 11 153.53  25.24  707.89    214.70   0.00     0.00     707.89    214.70   ?       ?      153.53  25.24  0.00    25.24  
1 1 1 -9  0   14 o 3  291.07  30.62  2542.45   503.94   2564.09  713.83   2520.96   711.54   285.46  45.05  282.84  45.35  2.62    63.93  
1 1 1 -9  0   15 o 14 145.01  15.99  617.98    130.87   705.81   192.57   542.61    178.39   153.46  22.53  133.76  24.12  19.70   33.00  
1 1 1 -9  0   16 o 8  145.37  16.10  623.00    132.08   682.54   193.62   571.18    180.65   150.26  23.19  137.00  23.83  13.26   33.26  
1 1 1 -9  0   17 o 1  133.04  15.27  522.59    114.53   518.39   168.85   526.17    155.86   130.16  23.46  131.82  21.32  -1.67   31.70  
1 1 1 -9  0   18 o 4  252.27  26.28  1943.78   375.07   2132.65  533.02   1758.54   527.87   257.06  37.20  230.04  41.50  27.02   55.73  
1 1 1 -9  0   19 o 6  235.49  24.04  1692.99   320.44   1945.82  455.92   1446.17   450.48   246.44  33.06  207.68  39.22  38.76   51.30  
1 1 1 -9  0   20 o 14 262.63  23.21  2113.06   346.36   2307.01  445.36   1816.21   550.98   269.70  29.23  226.12  44.03  43.58   52.85  
1 1 1 -9  0   21 o 15 159.07  15.34  754.42    138.32   880.72   194.53   625.27    196.71   169.69  20.38  140.23  25.37  29.45   32.54  
1 1 1 -9  0   22 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  0   23 o 17 103.81  21.05  342.10    121.14   342.10   121.14   0.00      0.00     103.81  21.05  ?       ?      0.00    21.05  
1 1 1 -9  0   24 o 3  100.01  21.55  323.17    120.09   323.17   120.09   0.00      0.00     100.01  21.55  ?       ?      0.00    21.55  
1 1 1 -9  0   25 o 12 203.68  41.98  1664.18   474.58   1664.18  474.58   0.00      0.00     203.68  41.98  ?       ?      0.00    41.98  
1 1 1 -9  1   1  o 11 188.87  28.49  1063.57   299.25   1063.57  299.25   0.00      0.00     188.87  28.49  ?       ?      0.00    28.49  
1 1 1 -9  1   2  o 2  197.00  29.71  1158.87   325.61   1158.87  325.61   0.00      0.00     197.00  29.71  ?       ?      0.00    29.71  
1 1 1 -9  1   3  o 18 254.40  38.67  1956.70   547.06   1956.70  547.06   0.00      0.00     254.40  38.67  ?       ?      0.00    38.67  
1 1 1 -9  1   4  o 13 367.94  38.70  4053.33   805.22   3592.77  1138.46  4514.36   1139.04  336.09  61.26  381.78  53.43  -45.69  81.29  
1 1 1 -9  1   5  o 13 430.89  46.01  5640.22   1120.54  5085.51  1584.45  6195.26   1584.93  393.41  72.84  440.75  64.55  -47.34  97.33  
1 1 1 -9  1   6  o 10 565.60  62.62  10146.18  1999.34  10126.03 2827.56  10166.32  2827.42  533.62  95.82  534.97  95.57  -1.35   135.34 
1 1 1 -9  1   7  o 9  225.53  34.53  1538.36   432.83   1538.36  432.83   0.00      0.00     225.53  34.53  ?       ?      0.00    34.53  
1 1 1 -9  1   8  o 18 579.49  66.40  11021.46  2169.16  11106.98 3067.83  10935.97  3067.48  538.20  103.05 532.59  104.06 5.61    146.45 
1 1 1 -9  1   9  o 12 178.85  18.65  938.65    188.63   971.52   267.26   906.02    266.28   180.01  26.67  173.44  27.67  6.57    38.43  
1 1 1 -9  1   10 o 5  159.17  16.98  742.88    152.74   763.66   215.82   722.03    216.19   159.71  24.31  154.98  25.16  4.73    34.98  
1 1 1 -9  1   11 f 0  217.47  22.80  1397.22   280.45   1372.77  396.40   1421.72   396.82   212.09  33.68  216.15  33.03  -4.06   47.17  
1 1 1 -9  1   12 o 17 224.62  23.31  1489.97   296.21   1553.15  419.10   1426.91   418.69   226.24  33.26  216.08  34.95  10.16   48.24  
1 1 1 -9  1   13 o 13 283.67  29.72  2403.68   476.84   2409.40  675.14   2398.00   673.58   277.97  43.75  277.29  43.77  0.68    61.89  
1 1 1 -9  1   14 f 0  240.93  25.57  1725.60   348.30   1632.53  492.91   1818.41   492.24   229.31  38.83  243.34  36.35  -14.04  53.19  
1 1 1 -9  1   15 o 2  220.99  34.82  1512.12   427.17   0.00     0.00     1512.12   427.17   ?       ?      220.99  34.82  0.00    34.82  
1 1 1 -9  1   16 o 3  100.55  18.00  304.25    100.08   0.00     0.00     304.25    100.08   ?       ?      100.55  18.00  0.00    18.00  
1 1 1 -9  1   17 o 1  343.45  65.39  4453.71   1242.10  0.00     0.00     4453.71   1242.10  ?       ?      343.45  65.39  0.00    65.39  
1 1 1 -9  1   18 o 18 103.21  17.93  322.05    102.37   0.00     0.00     322.05    102.37   ?       ?      103.21  17.93  0.00    17.93  
1 1 1 -9  1   19 f 0  178.77  24.26  983.56    242.60   926.13   472.18   1004.15   282.77   159.73  47.79  178.46  28.56  -18.73  55.68  
1 1 1 -9  1   20 o 3  218.48  28.92  1519.91   353.82   1528.22  632.08   1516.11   426.98   195.32  54.38  212.51  36.30  -17.18  65.38  
1 1 1 -9  1   21 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  1   22 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  1   23 o 16 62.49   21.17  115.92    90.42    115.92   90.42    0.00      0.00     62.49   21.17  ?       ?      0.00    21.17  
1 1 1 -9  1   24 f 0  89.86   20.91  261.18    105.85   261.18   105.85   0.00      0.00     89.86   20.91  ?       ?      0.00    20.91  
1 1 1 -9  1   25 o 14 119.48  20.08  456.57    132.84   456.57   132.84   0.00      0.00     119.48  20.08  ?       ?      0.00    20.08  
1 1 1 -9  2   1  o 1  84.84   15.33  213.99    71.90    213.99   71.90    0.00      0.00     84.84   15.33  ?       ?      0.00    15.33  
1 1 1 -9  2   2  o 8  172.60  26.09  886.44    250.46   886.44   250.46   0.00      0.00     172.60  26.09  ?       ?      0.00    26.09  
1 1 1 -9  2   3  o 4  473.32  50.94  6864.87   1362.48  6270.00  1926.66  7459.96   1927.01  432.79  80.51  479.21  72.30  -46.42  108.21 
1 1 1 -9  2   4  f 0  210.34  21.97  1297.32   261.42   1093.24  369.03   1502.88   370.37   189.70  35.18  224.83  29.40  -35.13  45.85  
1 1 1 -9  2   5  o 11 495.93  53.68  7612.43   1503.97  7385.18  2127.03  7839.64   2126.84  466.96  82.36  483.98  79.29  -17.02  114.32 
1 1 1 -9  2   6  f 0  105.50  12.47  325.15    74.06    299.47   106.60   349.11    102.97   100.02  19.26  108.60  17.08  -8.57   25.75  
1 1 1 -9  2   7  o 5  85.26   11.78  213.43    56.14    202.46   80.44    223.85    78.39    82.08   17.60  86.58   16.37  -4.50   24.04  
1 1 1 -9  2   8  o 11 88.54   12.15  230.28    60.16    205.32   83.93    256.64    86.26    82.56   18.20  92.74   16.82  -10.19  24.78  
1 1 1 -9  2   9  o 7  458.12  83.70  7606.57   2120.08  7606.57  2120.08  0.00      0.00     458.12  83.70  ?       ?      0.00    83.70  
1 1 1 -9  2   10 o 7  238.90  24.80  1692.79   335.12   1748.27  474.43   1637.54   473.43   238.89  35.69  230.52  37.03  8.37    51.43  
1 1 1 -9  2   11 f 0  127.55  14.35  476.34    103.25   500.37   146.84   452.84    145.22   129.53  20.42  122.88  21.36  6.65    29.55  
1 1 1 -9  2   12 o 18 212.15  22.18  1327.90   266.16   1347.69  376.27   1308.07   376.53   210.73  32.12  207.35  32.72  3.39    45.85  
1 1 1 -9  2   13 o 6  387.20  65.70  5046.33   1408.19  0.00     0.00     5046.33   1408.19  ?       ?      387.20  65.70  0.00    65.70  
1 1 1 -9  2   14 o 5  247.33  38.79  1897.60   532.65   0.00     0.00     1897.60   532.65   ?       ?      247.33  38.79  0.00    38.79  
1 1 1 -9  2   15 o 2  230.55  36.52  1658.37   467.28   0.00     0.00     1658.37   467.28   ?       ?      230.55  36.52  0.00    36.52  
1 1 1 -9  2   16 o 3  337.27  60.90  4069.73   1135.70  0.00     0.00     4069.73   1135.70  ?       ?      337.27  60.90  0.00    60.90  
1 1 1 -9  2   17 o 15 275.29  29.92  2340.94   465.25   2308.23  658.75   2373.49   657.19   262.02  45.44  266.52  44.52  -4.50   63.62  
1 1 1 -9  2   18 o 8  93.83   12.19  259.98    64.11    287.82   96.59    238.06    85.72    97.39   17.94  88.48   17.50  8.91    25.06  
1 1 1 -9  2   19 o 9  228.39  24.66  1603.31   318.19   1615.60  452.03   1591.24   447.97   220.74  36.98  219.07  36.93  1.66    52.26  
1 1 1 -9  2   20 o 1  50.49   18.57  62.64     70.77    62.64    70.77    0.00      0.00     50.49   18.57  ?       ?      0.00    18.57  
1 1 1 -9  2   21 o 8  177.06  51.57  1291.60   555.90   1291.60  555.90   0.00      0.00     177.06  51.57  ?       ?      0.00    51.57  
1 1 1 -9  2   22 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  2   23 o 5  55.42   19.51  86.29     77.04    86.29    77.04    0.00      0.00     55.42   19.51  ?       ?      0.00    19.51  
1 1 1 -9  2   24 o 11 185.53  35.69  1273.64   366.31   1273.64  366.31   0.00      0.00     185.53  35.69  ?       ?      0.00    35.69  
1 1 1 -9  2   25 o 18 73.42   22.22  177.50    101.67   177.50   101.67   0.00      0.00     73.42   22.22  ?       ?      0.00    22.22  
1 1 1 -9  3   1  o 7  277.49  42.51  2345.00   655.55   2345.00  655.55   0.00      0.00     277.49  42.51  ?       ?      0.00    42.51  
1 1 1 -9  3   2  o 7  259.93  39.65  2048.73   572.99   2048.73  572.99   0.00      0.00     259.93  39.65  ?       ?      0.00    39.65  
1 1 1 -9  3   3  o 1  620.33  70.01  12400.29  2449.49  11560.24 3464.02  13240.41  3464.18  554.01  112.76 605.27  103.41 -51.26  153.00 
1 1 1 -9  3   4  o 1  261.82  40.14  2085.24   584.14   0.00     0.00     2085.24   584.14   ?       ?      261.82  40.14  0.00    40.14  
1 1 1 -9  3   5  o 10 571.01  63.62  10416.41  2050.08  10625.60 2899.40  10207.27  2899.11  543.80  96.41  529.99  98.93  13.81   138.13 
1 1 1 -9  3   6  o 17 265.77  27.53  2091.42   413.93   2130.31  585.88   2052.65   584.90   264.00  39.90  258.73  40.72  5.26    57.01  
1 1 1 -9  3   7  f 0  317.98  50.50  3190.71   891.00   0.00     0.00     3190.71   891.00   ?       ?      317.98  50.50  0.00    50.50  
1 1 1 -9  3   8  o 11 390.48  41.91  4685.63   924.71   4653.66  1307.98  4717.57   1307.50  374.49  63.08  377.54  62.51  -3.05   88.81  
1 1 1 -9  3   9  o 2  322.18  34.11  3139.69   621.22   3088.67  878.94   3190.61   878.14   310.17  51.14  316.01  50.07  -5.84   71.58  
1 1 1 -9  3   10 o 14 366.86  39.43  4135.26   817.30   4079.69  1156.10  4190.78   1155.59  350.49  59.59  356.11  58.56  -5.62   83.55  
1 1 1 -9  3   11 o 12 227.74  24.11  1537.26   310.46   1398.17  438.66   1676.85   439.45   212.53  37.32  234.69  33.57  -22.17  50.19  
1 1 1 -9  3   12 o 8  267.02  41.97  2219.54   622.12   0.00     0.00     2219.54   622.12   ?       ?      267.02  41.97  0.00    41.97  
1 1 1 -9  3   13 o 12 238.60  37.32  1754.18   494.43   0.00     0.00     1754.18   494.43   ?       ?      238.60  37.32  0.00    37.32  
1 1 1 -9  3   14 o 17 209.32  32.73  1342.44   380.40   0.00     0.00     1342.44   380.40   ?       ?      209.32  32.73  0.00    32.73  
1 1 1 -9  3   15 o 10 246.16  26.30  1822.37   365.92   1724.75  517.68   1919.84   517.31   232.64  40.22  247.14  37.65  -14.51  55.09  
1 1 1 -9  3   16 o 19 114.67  19.48  396.88    123.64   0.00     0.00     396.88    123.64   ?       ?      114.67  19.48  0.00    19.48  
1 1 1 -9  3   17 o 10 290.36  33.06  2652.34   541.28   2341.28  765.66   2963.13   765.32   255.10  53.97  295.11  46.73  -40.01  71.39  
1 1 1 -9  3   18 o 2  115.33  20.23  406.17    129.05   406.17   129.05   0.00      0.00     115.33  20.23  ?       ?      0.00    20.23  
1 1 1 -9  3   19 f 0  223.68  38.35  1687.60   474.72   1687.60  474.72   0.00      0.00     223.68  38.35  ?       ?      0.00    38.35  
1 1 1 -9  3   20 o 13 131.08  22.21  535.92    161.13   535.92   161.13   0.00      0.00     131.08  22.21  ?       ?      0.00    22.21  
1 1 1 -9  3   21 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  3   22 o 2  81.76   10.52  198.47    48.23    228.21   80.15    181.59    60.39    85.81   16.87  77.14   14.16  8.67    22.03  
1 1 1 -9  3   23 o 14 126.25  18.70  496.73    131.43   496.73   131.43   0.00      0.00     126.25  18.70  ?       ?      0.00    18.70  
1 1 1 -9  3   24 o 3  44.53   16.68  48.60     57.52    48.60    57.52    0.00      0.00     44.53   16.68  ?       ?      0.00    16.68  
1 1 1 -9  3   25 o 16 41.58   15.75  40.96     51.66    40.96    51.66    0.00      0.00     41.58   15.75  ?       ?      0.00    15.75  
1 1 1 -9  4   1  o 14 71.99   16.10  155.53    64.86    155.53   64.86    0.00      0.00     71.99   16.10  ?       ?      0.00    16.10  
1 1 1 -9  4   2  o 8  197.17  30.04  1164.61   329.32   1164.61  329.32   0.00      0.00     197.17  30.04  ?       ?      0.00    30.04  
1 1 1 -9  4   3  o 13 399.87  65.05  5170.85   1441.96  5170.85  1441.96  0.00      0.00     399.87  65.05  ?       ?      0.00    65.05  
1 1 1 -9  4   4  o 2  296.18  30.81  2608.05   516.29   2563.25  729.77   2652.93   730.51   287.89  45.68  293.37  44.79  -5.48   63.98  
1 1 1 -9  4   5  o 15 127.25  13.91  472.87    99.99    408.29   141.58   537.13    141.23   116.61  21.95  134.85  18.75  -18.24  28.87  
1 1 1 -9  4   6  o 9  167.12  17.42  817.90    164.68   865.80   233.35   770.39    232.42   170.40  24.56  160.15  26.19  10.26   35.90  
1 1 1 -9  4   7  o 9  206.05  21.49  1251.01   250.51   1076.50  354.60   1424.89   353.96   187.26  34.25  217.89  29.02  -30.62  44.89  
1 1 1 -9  4   8  o 8  404.01  44.01  5073.49   1004.16  4614.88  1420.03  5532.19   1420.17  364.75  70.37  407.00  62.80  -42.25  94.32  
1 1 1 -9  4   9  o 13 474.75  92.88  8758.58   2440.63  0.00     0.00     8758.58   2440.63  ?       ?      474.75  92.88  0.00    92.88  
1 1 1 -9  4   10 o 7  209.28  21.83  1293.83   258.44   1291.35  365.21   1296.33   365.76   205.87  31.94  206.28  31.92  -0.41   45.15  
1 1 1 -9  4   11 o 3  228.75  23.99  1550.27   310.35   1413.98  438.54   1687.01   439.26   213.85  37.06  235.47  33.43  -21.62  49.92  
1 1 1 -9  4   12 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  4   13 o 6  135.71  22.91  553.73    172.12   0.00     0.00     553.73    172.12   ?       ?      135.71  22.91  0.00    22.91  
1 1 1 -9  4   14 o 17 48.67   16.70  63.09     56.30    63.09    56.30    0.00      0.00     48.67   16.70  ?       ?      0.00    16.70  
1 1 1 -9  4   15 o 14 146.81  16.15  635.58    133.85   576.99   187.95   695.87    190.66   137.37  24.74  151.89  22.55  -14.52  33.48  
1 1 1 -9  4   16 o 5  128.57  14.47  487.61    104.94   464.57   146.97   511.57    149.90   123.51  21.51  129.97  20.79  -6.46   29.91  
1 1 1 -9  4   17 o 7  231.79  38.59  1765.15   495.40   1765.15  495.40   0.00      0.00     231.79  38.59  ?       ?      0.00    38.59  
1 1 1 -9  4   18 o 10 47.42   16.59  59.52     55.67    59.52    55.67    0.00      0.00     47.42   16.59  ?       ?      0.00    16.59  
1 1 1 -9  4   19 o 18 318.52  38.97  3453.54   697.66   3202.50  987.00   3704.22   986.28   271.77  64.28  302.02  59.00  -30.24  87.25  
1 1 1 -9  4   20 o 1  124.97  21.06  486.50    145.74   486.50   145.74   0.00      0.00     124.97  21.06  ?       ?      0.00    21.06  
1 1 1 -9  4   21 o 17 99.74   16.97  305.77    93.71    0.00     0.00     305.77    93.71    ?       ?      99.74   16.97  0.00    16.97  
1 1 1 -9  4   22 o 9  53.89   9.28   86.95     27.67    115.41   50.06    74.43     33.20    61.08   14.50  49.33   11.87  11.75   18.73  
1 1 1 -9  4   23 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  4   24 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  4   25 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  5   1  o 11 407.70  43.37  5068.18   999.53   5055.46  1413.50  5080.91   1413.59  393.81  64.77  394.96  64.58  -1.15   91.46  
1 1 1 -9  5   2  f 0  290.18  45.24  2608.53   729.11   2608.53  729.11   0.00      0.00     290.18  45.24  ?       ?      0.00    45.24  
1 1 1 -9  5   3  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  5   4  o 17 253.38  26.34  1902.24   377.55   1913.07  533.49   1891.38   534.38   249.88  38.42  248.30  38.76  1.58    54.57  
1 1 1 -9  5   5  o 4  167.14  17.70  819.09    167.27   742.28   235.43   897.38    237.69   156.78  27.14  173.44  24.56  -16.66  36.60  
1 1 1 -9  5   6  o 2  121.23  13.73  430.09    93.88    365.10   131.83   496.95    133.71   110.01  21.65  129.52  18.51  -19.50  28.48  
1 1 1 -9  5   7  o 8  173.91  18.41  888.96    181.01   751.38   255.46   1027.68   256.51   156.84  29.45  185.52  24.70  -28.68  38.44  
1 1 1 -9  5   8  o 2  506.92  58.33  8450.80   1666.49  8199.49  2356.86  8702.07   2356.70  458.18  92.79  477.12  89.33  -18.94  128.80 
1 1 1 -9  5   9  o 8  317.27  33.59  3048.98   602.49   3101.35  852.33   2996.68   851.77   311.10  49.37  305.07  50.39  6.03    70.55  
1 1 1 -9  5   10 f 0  455.20  85.20  7694.00   2144.46  7694.00  2144.46  0.00      0.00     455.20  85.20  ?       ?      0.00    85.20  
1 1 1 -9  5   11 o 1  414.97  45.30  5380.76   1061.58  5234.87  1501.15  5526.71   1501.46  389.03  69.78  402.14  67.42  -13.11  97.03  
1 1 1 -9  5   12 o 3  166.15  26.25  832.55    242.06   0.00     0.00     832.55    242.06   ?       ?      166.15  26.25  0.00    26.25  
1 1 1 -9  5   13 o 13 152.74  24.18  703.05    205.00   0.00     0.00     703.05    205.00   ?       ?      152.74  24.18  0.00    24.18  
1 1 1 -9  5   14 o 5  141.66  15.55  590.63    124.41   478.60   175.24   704.49    176.67   124.80  25.33  153.57  20.56  -28.76  32.62  
1 1 1 -9  5   15 o 6  291.69  31.67  2636.98   521.75   2610.45  737.42   2663.58   738.31   277.80  47.97  281.13  47.43  -3.32   67.46  
1 1 1 -9  5   16 o 9  200.71  32.39  1279.24   360.49   1279.24  360.49   0.00      0.00     200.71  32.39  ?       ?      0.00    32.39  
1 1 1 -9  5   17 o 18 310.54  61.06  3762.11   1049.67  3762.11  1049.67  0.00      0.00     310.54  61.06  ?       ?      0.00    61.06  
1 1 1 -9  5   18 f 0  200.94  33.47  1322.95   372.55   0.00     0.00     1322.95   372.55   ?       ?      200.94  33.47  0.00    33.47  
1 1 1 -9  5   19 o 2  239.74  27.50  1828.37   371.66   1572.57  525.06   2085.26   526.17   205.43  45.70  245.41  38.62  -39.98  59.84  
1 1 1 -9  5   20 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  5   21 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  5   22 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  5   23 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  5   24 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  6   1  o 11 62.02   13.96  115.50    48.49    84.56    67.42    148.67    69.80    55.28   18.27  70.24   17.40  -14.96  25.23  
1 1 1 -9  6   2  o 14 436.43  77.05  6671.54   1859.95  0.00     0.00     6671.54   1859.95  ?       ?      436.43  77.05  0.00    77.05  
1 1 1 -9  6   3  x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  6   4  x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  6   5  o 7  303.25  48.94  2936.17   822.96   0.00     0.00     2936.17   822.96   ?       ?      303.25  48.94  0.00    48.94  
1 1 1 -9  6   6  o 8  352.62  37.71  3807.21   751.48   3565.31  1062.02  4049.79   1063.49  327.43  58.65  352.73  54.26  -25.30  79.90  
1 1 1 -9  6   7  o 14 424.88  77.22  6505.70   1814.19  0.00     0.00     6505.70   1814.19  ?       ?      424.88  77.22  0.00    77.22  
1 1 1 -9  6   8  o 5  91.57   19.75  253.54    100.78   0.00     0.00     253.54    100.78   ?       ?      91.57   19.75  0.00    19.75  
1 1 1 -9  6   9  o 7  181.39  19.15  967.99    196.36   830.77   275.70   1109.27   279.74   164.88  30.24  192.48  25.98  -27.60  39.87  
1 1 1 -9  6   10 o 19 330.17  35.06  3310.77   654.44   3341.02  925.01   3280.45   926.03   321.84  51.83  318.42  52.49  3.42    73.76  
1 1 1 -9  6   11 o 17 121.85  14.16  435.34    97.24    438.88   135.04   431.53    140.14   121.11  20.13  119.84  21.14  1.27    29.19  
1 1 1 -9  6   12 o 11 285.08  46.13  2607.15   729.21   0.00     0.00     2607.15   729.21   ?       ?      285.08  46.13  0.00    46.13  
1 1 1 -9  6   13 o 5  189.07  29.77  1098.84   312.42   0.00     0.00     1098.84   312.42   ?       ?      189.07  29.77  0.00    29.77  
1 1 1 -9  6   14 o 14 298.84  32.17  2768.95   543.23   2377.87  767.70   3161.16   768.81   261.01  53.05  309.67  44.53  -48.66  69.26  
1 1 1 -9  6   15 o 17 50.74   13.50  77.62     40.03    -7.91    52.54    195.88    61.78    33.60   14.61  80.91   13.80  -47.31  20.09  
1 1 1 -9  6   16 o 16 248.70  42.72  2102.60   587.95   2102.60  587.95   0.00      0.00     248.70  42.72  ?       ?      0.00    42.72  
1 1 1 -9  6   17 o 13 152.00  24.40  718.97    205.73   718.97   205.73   0.00      0.00     152.00  24.40  ?       ?      0.00    24.40  
1 1 1 -9  6   18 o 1  201.56  21.80  1246.91   248.22   1223.00  350.36   1271.00   351.72   192.10  32.96  196.38  32.32  -4.29   46.16  
1 1 1 -9  6   19 o 11 162.43  26.74  851.98    240.65   851.98   240.65   0.00      0.00     162.43  26.74  ?       ?      0.00    26.74  
1 1 1 -9  6   20 o 12 160.65  27.07  846.81    240.82   0.00     0.00     846.81    240.82   ?       ?      160.65  27.07  0.00    27.07  
1 1 1 -9  6   21 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  6   22 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  6   23 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  6   24 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  7   1  o 16 140.92  23.06  595.60    180.11   0.00     0.00     595.60    180.11   ?       ?      140.92  23.06  0.00    23.06  
1 1 1 -9  7   2  f 0  88.93   13.44  233.62    66.48    232.57   90.43    234.85    98.08    87.83   18.52  88.09   19.87  -0.26   27.16  
1 1 1 -9  7   3  f 0  497.16  56.45  8037.66   1582.51  7571.22  2237.76  8504.32   2238.26  444.07  90.85  479.71  84.36  -35.64  123.97 
1 1 1 -9  7   4  o 15 138.57  22.69  575.95    174.23   575.95   174.23   0.00      0.00     138.57  22.69  ?       ?      0.00    22.69  
1 1 1 -9  7   5  o 13 351.94  58.78  4102.74   1145.64  4102.74  1145.64  0.00      0.00     351.94  58.78  ?       ?      0.00    58.78  
1 1 1 -9  7   6  o 6  379.28  40.83  4437.53   875.07   4237.13  1237.14  4638.18   1237.93  354.50  63.10  374.06  59.65  -19.56  86.84  
1 1 1 -9  7   7  o 12 78.06   13.63  181.17    58.85    198.57   79.82    160.45    87.11    81.16   17.64  73.07   20.13  8.09    26.76  
1 1 1 -9  7   8  o 17 107.34  20.84  347.31    123.79   0.00     0.00     347.31    123.79   ?       ?      107.34  20.84  0.00    20.84  
1 1 1 -9  7   9  o 10 258.93  40.99  2093.06   589.01   0.00     0.00     2093.06   589.01   ?       ?      258.93  40.99  0.00    40.99  
1 1 1 -9  7   10 o 14 168.40  18.03  834.28    171.54   754.65   240.47   916.80    244.78   157.50  27.60  174.74  25.12  -17.23  37.32  
1 1 1 -9  7   11 o 16 102.20  13.35  307.41    76.43    288.69   103.96   329.43    112.75   97.79   19.20  104.56  19.50  -6.77   27.37  
1 1 1 -9  7   12 o 13 266.71  43.88  2310.23   648.49   0.00     0.00     2310.23   648.49   ?       ?      266.71  43.88  0.00    43.88  
1 1 1 -9  7   13 o 18 146.70  23.83  656.61    193.83   0.00     0.00     656.61    193.83   ?       ?      146.70  23.83  0.00    23.83  
1 1 1 -9  7   14 o 4  216.78  35.52  1514.84   426.75   0.00     0.00     1514.84   426.75   ?       ?      216.78  35.52  0.00    35.52  
1 1 1 -9  7   15 o 13 94.30   11.87  262.46    62.83    278.75   87.23    244.89    90.58    96.11   16.40  89.49   18.25  6.63    24.54  
1 1 1 -9  7   16 o 9  161.01  26.37  814.43    235.30   0.00     0.00     814.43    235.30   ?       ?      161.01  26.37  0.00    26.37  
1 1 1 -9  7   17 o 3  117.59  19.53  424.90    127.23   424.90   127.23   0.00      0.00     117.59  19.53  ?       ?      0.00    19.53  
1 1 1 -9  7   18 o 10 264.75  30.78  2305.83   459.13   2395.12  649.18   2216.48   649.42   250.64  46.84  237.75  49.21  12.89   67.94  
1 1 1 -9  7   19 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  7   20 o 6  180.13  32.00  1127.45   318.78   0.00     0.00     1127.45   318.78   ?       ?      180.13  32.00  0.00    32.00  
1 1 1 -9  7   21 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  7   22 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  7   23 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  7   24 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  8   1  o 19 154.95  24.53  719.92    210.94   0.00     0.00     719.92    210.94   ?       ?      154.95  24.53  0.00    24.53  
1 1 1 -9  8   2  o 6  408.89  70.89  5745.11   1603.67  0.00     0.00     5745.11   1603.67  ?       ?      408.89  70.89  0.00    70.89  
1 1 1 -9  8   3  o 6  438.08  48.06  6024.42   1188.76  5953.21  1681.71  6095.54   1680.63  413.41  73.56  419.54  72.40  -6.13   103.21 
1 1 1 -9  8   4  o 4  165.75  18.07  807.16    169.12   751.87   238.10   863.46    240.27   157.61  27.30  169.69  25.45  -12.07  37.33  
1 1 1 -9  8   5  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  8   6  o 18 242.23  38.09  1813.17   512.24   1813.17  512.24   0.00      0.00     242.23  38.09  ?       ?      0.00    38.09  
1 1 1 -9  8   7  o 10 184.17  19.69  999.40    204.95   959.93   288.38   1039.68   291.33   177.76  29.28  185.48  28.25  -7.72   40.69  
1 1 1 -9  8   8  f 0  187.08  19.91  1032.45   210.51   1052.56  296.01   1011.88   299.43   186.36  28.58  182.30  29.63  4.06    41.17  
1 1 1 -9  8   9  o 10 174.45  18.58  897.33    183.26   879.99   257.61   915.09    260.76   170.22  27.28  173.74  27.02  -3.52   38.40  
1 1 1 -9  8   10 o 13 149.18  16.24  655.30    136.83   540.68   190.77   776.75    196.37   132.73  25.97  161.07  21.80  -28.34  33.90  
1 1 1 -9  8   11 f 0  227.04  24.03  1549.39   308.45   1488.56  435.38   1610.69   437.06   216.54  36.31  226.28  34.76  -9.74   50.26  
1 1 1 -9  8   12 o 14 421.58  50.85  6122.75   1205.76  6045.00  1704.86  6200.57   1705.54  373.03  81.86  380.09  80.66  -7.06   114.93 
1 1 1 -9  8   13 o 18 220.34  23.42  1472.99   291.70   1378.53  411.66   1568.25   413.40   205.80  36.16  221.51  33.56  -15.70  49.34  
1 1 1 -9  8   14 o 19 90.76   19.65  253.84    99.40    0.00     0.00     253.84    99.40    ?       ?      90.76   19.65  0.00    19.65  
1 1 1 -9  8   15 o 17 263.68  48.76  2535.74   710.93   0.00     0.00     2535.74   710.93   ?       ?      263.68  48.76  0.00    48.76  
1 1 1 -9  8   16 o 1  65.74   14.97  132.34    55.22    136.59   83.77    129.07    73.44    66.82   20.16  64.84   18.70  1.98    27.50  
1 1 1 -9  8   17 o 14 100.58  13.49  302.92    75.90    294.14   115.91   309.51    100.43   96.34   21.50  100.12  18.14  -3.78   28.13  
1 1 1 -9  8   18 o 1  108.90  21.93  378.51    132.34   378.51   132.34   0.00      0.00     108.90  21.93  ?       ?      0.00    21.93  
1 1 1 -9  8   19 f 0  130.18  22.61  544.51    162.84   0.00     0.00     544.51    162.84   ?       ?      130.18  22.61  0.00    22.61  
1 1 1 -9  8   20 o 11 142.86  17.38  631.18    139.62   583.75   210.93   668.17    186.26   129.42  29.10  143.05  23.50  -13.63  37.40  
1 1 1 -9  8   21 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  8   22 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  8   23 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  9   1  o 8  202.17  21.57  1205.92   246.44   1208.29  349.54   1203.58   347.51   199.39  31.59  199.04  31.46  0.35    44.58  
1 1 1 -9  9   2  x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  9   3  o 11 152.14  25.08  696.97    211.42   0.00     0.00     696.97    211.42   ?       ?      152.14  25.08  0.00    25.08  
1 1 1 -9  9   4  o 14 119.89  22.09  433.24    146.42   0.00     0.00     433.24    146.42   ?       ?      119.89  22.09  0.00    22.09  
1 1 1 -9  9   5  o 19 329.63  54.73  3572.06   999.39   0.00     0.00     3572.06   999.39   ?       ?      329.63  54.73  0.00    54.73  
1 1 1 -9  9   6  o 15 168.98  18.16  841.08    173.37   761.05   244.70   921.73    245.67   157.90  28.02  175.05  25.17  -17.15  37.67  
1 1 1 -9  9   7  o 5  74.17   19.73  166.69    85.49    166.69   85.49    0.00      0.00     74.17   19.73  ?       ?      0.00    19.73  
1 1 1 -9  9   8  o 19 332.01  58.18  3822.99   1068.43  3822.99  1068.43  0.00      0.00     332.01  58.18  ?       ?      0.00    58.18  
1 1 1 -9  9   9  o 12 184.00  19.65  1006.34   204.31   929.77   287.58   1084.37   290.32   172.93  30.06  188.06  27.72  -15.13  40.89  
1 1 1 -9  9   10 o 1  55.82   18.70  86.89     70.53    86.89    70.53    0.00      0.00     55.82   18.70  ?       ?      0.00    18.70  
1 1 1 -9  9   11 o 12 168.47  18.11  845.48    172.39   748.18   242.79   944.42    244.81   154.35  28.45  175.43  25.02  -21.07  37.88  
1 1 1 -9  9   12 o 1  166.81  27.47  871.01    253.90   0.00     0.00     871.01    253.90   ?       ?      166.81  27.47  0.00    27.47  
1 1 1 -9  9   13 o 6  170.87  18.70  876.68    180.46   809.05   257.88   941.58    252.62   159.19  29.30  173.70  26.14  -14.51  39.27  
1 1 1 -9  9   14 o 4  169.06  18.91  863.00    180.41   889.78   258.48   837.57    251.93   167.11  27.93  161.92  28.12  5.18    39.63  
1 1 1 -9  9   15 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  9   16 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  9   17 o 9  99.49   14.84  300.56    82.15    298.95   124.83   301.78    109.11   96.03   22.96  97.64   20.14  -1.61   30.54  
1 1 1 -9  9   18 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  9   19 o 17 59.47   24.93  52.71     143.28   52.71    143.28   0.00      0.00     59.47   24.93  ?       ?      0.00    24.93  
1 1 1 -9  9   20 o 3  132.26  36.71  697.43    288.56   697.43   288.56   0.00      0.00     132.26  36.71  ?       ?      0.00    36.71  
1 1 1 -9  9   21 o 11 63.12   17.67  128.64    66.55    0.00     0.00     128.64    66.55    ?       ?      63.12   17.67  0.00    17.67  
1 1 1 -9  9   22 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  10  1  o 6  153.73  17.98  698.07    155.69   738.57   227.10   662.14    213.86   155.83  26.32  147.39  26.24  8.44    37.17  
1 1 1 -9  10  2  o 13 232.68  24.90  1619.26   327.45   1608.13  466.03   1630.12   460.19   226.56  37.12  228.54  36.29  -1.98   51.91  
1 1 1 -9  10  3  o 8  325.14  35.21  3262.88   646.69   3198.06  915.95   3327.30   913.18   308.50  53.67  316.02  52.15  -7.53   74.83  
1 1 1 -9  10  4  o 12 240.85  38.97  1839.45   520.41   0.00     0.00     1839.45   520.41   ?       ?      240.85  38.97  0.00    38.97  
1 1 1 -9  10  5  o 17 225.98  36.51  1612.15   457.46   0.00     0.00     1612.15   457.46   ?       ?      225.98  36.51  0.00    36.51  
1 1 1 -9  10  6  o 18 188.07  20.48  1053.94   217.50   1030.19  312.67   1076.21   302.76   181.77  31.08  186.70  29.20  -4.93   42.65  
1 1 1 -9  10  7  o 16 320.05  35.16  3222.74   635.28   3057.97  898.87   3387.19   897.99   294.03  55.28  313.36  51.72  -19.33  75.70  
1 1 1 -9  10  8  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  10  9  o 11 88.52   23.08  243.51    118.46   243.51   118.46   0.00      0.00     88.52   23.08  ?       ?      0.00    23.08  
1 1 1 -9  10  10 o 4  98.63   14.87  290.77    81.60    270.35   126.44   305.35    106.83   92.98   23.64  99.91   19.32  -6.93   30.53  
1 1 1 -9  10  11 o 2  226.61  24.89  1579.43   318.48   1611.36  452.87   1548.18   447.96   220.51  37.09  215.73  37.53  4.78    52.77  
1 1 1 -9  10  12 o 4  63.85   17.03  125.00    63.55    155.55   108.39   108.99    78.45    71.93   23.13  60.92   19.69  11.01   30.37  
1 1 1 -9  10  13 o 17 122.64  24.99  478.84    169.98   478.84   169.98   0.00      0.00     122.64  24.99  ?       ?      0.00    24.99  
1 1 1 -9  10  14 o 7  147.31  17.47  657.55    144.87   673.82   212.24   643.36    198.24   144.47  26.57  141.82  25.28  2.65    36.67  
1 1 1 -9  10  15 o 5  135.51  16.59  557.50    126.37   530.41   186.58   580.45    171.77   127.13  26.43  135.13  22.96  -8.01   35.01  
1 1 1 -9  10  16 o 11 84.04   20.32  225.74    96.95    0.00     0.00     225.74    96.95    ?       ?      84.04   20.32  0.00    20.32  
1 1 1 -9  10  17 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  10  18 o 6  122.81  22.86  494.58    155.24   0.00     0.00     494.58    155.24   ?       ?      122.81  22.86  0.00    22.86  
1 1 1 -9  10  19 o 17 121.88  19.11  474.08    129.30   379.55   259.40   505.33    149.15   98.58   35.67  124.18  21.71  -25.60  41.76  
1 1 1 -9  10  20 o 8  83.69   35.14  233.13    285.41   233.13   285.41   0.00      0.00     83.69   35.14  ?       ?      0.00    35.14  
1 1 1 -9  10  21 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  11  1  o 7  186.50  20.82  1039.69   219.15   1097.18  314.10   985.14    305.92   187.81  30.15  177.29  31.20  10.51   43.39  
1 1 1 -9  11  2  o 11 92.91   16.85  260.11    86.55    191.52   136.64   306.07    111.85   80.48   25.98  100.17  20.15  -19.69  32.88  
1 1 1 -9  11  3  o 14 241.33  26.16  1772.18   356.68   1705.71  507.23   1837.20   501.66   228.45  40.14  238.81  37.85  -10.36  55.18  
1 1 1 -9  11  4  o 19 260.10  28.20  2078.23   414.29   1888.97  588.36   2264.34   583.46   236.57  44.97  263.59  39.80  -27.02  60.05  
1 1 1 -9  11  5  o 13 199.03  33.92  1265.42   373.64   1265.42  373.64   0.00      0.00     199.03  33.92  ?       ?      0.00    33.92  
1 1 1 -9  11  6  x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  11  7  o 2  61.86   20.38  109.96    83.88    0.00     0.00     109.96    83.88    ?       ?      61.86   20.38  0.00    20.38  
1 1 1 -9  11  8  o 14 192.30  32.04  1186.15   341.21   0.00     0.00     1186.15   341.21   ?       ?      192.30  32.04  0.00    32.04  
1 1 1 -9  11  9  o 5  164.63  18.74  815.16    173.97   671.41   253.98   942.21    238.77   143.41  31.69  174.50  24.51  -31.09  40.07  
1 1 1 -9  11  10 o 17 96.99   25.08  299.62    140.63   299.62   140.63   0.00      0.00     96.99   25.08  ?       ?      0.00    25.08  
1 1 1 -9  11  11 o 1  151.26  28.32  739.38    236.83   739.38   236.83   0.00      0.00     151.26  28.32  ?       ?      0.00    28.32  
1 1 1 -9  11  12 o 15 105.76  21.19  351.36    124.14   0.00     0.00     351.36    124.14   ?       ?      105.76  21.19  0.00    21.19  
1 1 1 -9  11  13 o 18 85.25   15.95  223.18    75.20    103.38   125.84   289.73    93.79    64.44   24.55  96.87   17.51  -32.43  30.15  
1 1 1 -9  11  14 o 4  64.46   18.39  129.84    71.37    145.02   131.69   123.54    84.92    70.58   25.43  63.58   20.48  6.99    32.65  
1 1 1 -9  11  15 o 2  99.34   28.78  339.29    173.56   339.29   173.56   0.00      0.00     99.34   28.78  ?       ?      0.00    28.78  
1 1 1 -9  11  16 o 6  134.58  18.60  566.23    139.89   543.62   230.69   579.39    175.92   122.28  32.36  132.79  23.96  -10.51  40.27  
1 1 1 -9  11  17 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  11  18 o 1  116.78  22.99  457.02    148.67   0.00     0.00     457.02    148.67   ?       ?      116.78  22.99  0.00    22.99  
1 1 1 -9  11  19 o 9  118.52  23.49  481.55    154.18   0.00     0.00     481.55    154.18   ?       ?      118.52  23.49  0.00    23.49  
1 1 1 -9  11  20 f 0  82.42   20.48  231.06    96.50    330.95   387.24   224.44    99.64    88.32   38.99  80.80   21.21  7.52    44.39  
1 1 1 -9  12  1  o 8  214.23  23.67  1394.68   286.27   1440.98  411.33   1351.19   398.67   211.17  35.17  204.30  35.27  6.88    49.80  
1 1 1 -9  12  2  o 17 63.38   18.35  121.42    70.58    72.66    134.96   139.77    82.81    63.03   25.02  67.92   19.94  -4.89   31.99  
1 1 1 -9  12  3  o 19 110.91  16.54  369.10    102.08   338.12   164.09   388.66    130.38   103.23  27.28  112.52  20.96  -9.29   34.40  
1 1 1 -9  12  4  o 5  75.93   17.77  176.95    76.09    207.15   139.16   164.07    90.88    82.45   26.18  73.11   20.71  9.34    33.38  
1 1 1 -9  12  5  o 3  122.83  16.87  452.81    115.78   526.72   183.23   403.67    149.39   129.40  25.57  113.60  23.68  15.81   34.85  
1 1 1 -9  12  6  o 16 115.69  16.71  402.82    107.78   393.73   178.21   408.06    135.33   110.56  28.04  114.91  21.30  -4.35   35.21  
1 1 1 -9  12  7  f 0  178.35  30.10  1025.19   297.19   0.00     0.00     1025.19   297.19   ?       ?      178.35  30.10  0.00    30.10  
1 1 1 -9  12  8  o 10 170.80  29.02  941.19    274.32   0.00     0.00     941.19    274.32   ?       ?      170.80  29.02  0.00    29.02  
1 1 1 -9  12  9  o 3  250.99  48.49  2396.19   673.33   0.00     0.00     2396.19   673.33   ?       ?      250.99  48.49  0.00    48.49  
1 1 1 -9  12  10 o 14 266.65  31.59  2355.39   474.12   2076.22  674.04   2628.78   667.04   223.99  53.21  264.32  45.61  -40.33  70.08  
1 1 1 -9  12  11 o 13 173.87  20.56  936.26    201.22   814.04   295.90   1041.42   274.45   152.26  34.64  178.53  27.67  -26.27  44.33  
1 1 1 -9  12  12 o 12 65.82   25.78  102.14    141.71   102.14   141.71   0.00      0.00     65.82   25.78  ?       ?      0.00    25.78  
1 1 1 -9  12  13 o 2  86.72   28.91  250.00    168.69   250.00   168.69   0.00      0.00     86.72   28.91  ?       ?      0.00    28.91  
1 1 1 -9  12  14 o 9  47.64   22.79  -190.92   176.44   -190.92  176.44   0.00      0.00     47.64   22.79  ?       ?      0.00    22.79  
1 1 1 -9  12  15 o 17 103.36  19.40  341.36    110.88   424.13   215.94   311.73    129.21   107.06  32.38  96.54   23.53  10.52   40.03  
1 1 1 -9  12  16 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  12  17 o 9  89.07   22.15  268.82    112.81   0.00     0.00     268.82    112.81   ?       ?      89.07   22.15  0.00    22.15  
1 1 1 -9  12  18 o 19 143.49  49.07  1217.26   486.02   1217.26  486.02   0.00      0.00     143.49  49.07  ?       ?      0.00    49.07  
1 1 1 -9  12  19 o 9  78.02   20.96  209.69    95.89    0.00     0.00     209.69    95.89    ?       ?      78.02   20.96  0.00    20.96  
1 1 1 -9  13  1  o 6  176.37  33.14  1025.49   323.25   1025.49  323.25   0.00      0.00     176.37  33.14  ?       ?      0.00    33.14  
1 1 1 -9  13  2  o 2  157.15  18.88  747.29    166.95   606.72   254.87   852.94    220.96   134.62  33.19  165.60  23.94  -30.98  40.92  
1 1 1 -9  13  3  f 0  83.09   17.91  213.03    82.90    177.43   157.68   226.63    97.46    78.48   27.88  85.18   20.23  -6.70   34.45  
1 1 1 -9  13  4  o 15 90.53   18.14  252.68    90.98    271.97   161.70   243.75    110.06   92.03   28.06  87.90   21.89  4.13    35.59  
1 1 1 -9  13  5  o 15 93.79   17.87  270.76    92.70    302.23   163.22   255.78    112.62   96.36   27.91  89.90   22.00  6.46    35.54  
1 1 1 -9  13  6  o 11 224.57  41.34  1812.04   513.30   0.00     0.00     1812.04   513.30   ?       ?      224.57  41.34  0.00    41.34  
1 1 1 -9  13  7  o 11 45.17   18.51  26.28     76.53    0.00     0.00     26.28     76.53    ?       ?      45.17   18.51  0.00    18.51  
1 1 1 -9  13  8  o 2  222.43  25.92  1582.88   324.81   1456.93  466.79   1701.11   452.25   197.30  42.47  219.62  37.20  -22.33  56.46  
1 1 1 -9  13  9  o 7  148.26  26.24  716.98    215.17   0.00     0.00     716.98    215.17   ?       ?      148.26  26.24  0.00    26.24  
1 1 1 -9  13  10 f 0  68.42   20.18  147.44    84.68    0.00     0.00     147.44    84.68    ?       ?      68.42   20.18  0.00    20.18  
1 1 1 -9  13  11 o 12 192.14  36.04  1341.27   382.90   0.00     0.00     1341.27   382.90   ?       ?      192.14  36.04  0.00    36.04  
1 1 1 -9  13  12 o 5  50.82   18.92  65.88     73.82    0.00     0.00     65.88     73.82    ?       ?      50.82   18.92  0.00    18.92  
1 1 1 -9  13  13 o 1  193.06  24.40  1226.59   264.41   1178.39  398.47   1264.52   353.44   169.84  41.28  185.06  34.54  -15.23  53.82  
1 1 1 -9  13  14 o 17 75.24   31.21  144.50    221.09   144.50   221.09   0.00      0.00     75.24   31.21  ?       ?      0.00    31.21  
1 1 1 -9  13  15 o 6  123.79  38.50  661.86    302.52   661.86   302.52   0.00      0.00     123.79  38.50  ?       ?      0.00    38.50  
1 1 1 -9  13  16 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  13  17 o 7  48.83   18.55  63.17     71.77    -41.28   399.63   66.65     72.96    72.81   34.68  49.63   18.74  23.17   39.42  
1 1 1 -9  14  1  o 5  256.14  30.42  2145.06   438.53   1800.99  627.35   2473.84   613.25   210.26  52.21  261.54  42.29  -51.28  67.19  
1 1 1 -9  14  2  o 2  54.89   24.54  -39.09    158.20   -39.09   158.20   0.00      0.00     54.89   24.54  ?       ?      0.00    24.54  
1 1 1 -9  14  3  f 0  62.23   25.86  53.39     152.22   53.39    152.22   0.00      0.00     62.23   25.86  ?       ?      0.00    25.86  
1 1 1 -9  14  4  o 10 77.01   27.67  174.92    155.79   174.92   155.79   0.00      0.00     77.01   27.67  ?       ?      0.00    27.67  
1 1 1 -9  14  5  o 12 42.29   18.08  4.48      77.91    -9.81    150.58   9.70      91.04    55.69   24.46  46.06   19.62  9.63    31.35  
1 1 1 -9  14  6  o 6  143.24  19.26  634.81    154.38   555.27   239.72   691.18    201.80   125.71  32.86  146.23  24.93  -20.51  41.25  
1 1 1 -9  14  7  o 15 134.55  18.95  561.51    142.34   386.05   227.89   673.75    182.27   104.51  33.53  145.48  22.55  -40.97  40.41  
1 1 1 -9  14  8  o 7  40.99   17.93  -8.50     80.12    22.97    192.70   -15.07    88.10    64.15   27.93  42.19   18.61  21.95   33.57  
1 1 1 -9  14  9  o 8  70.48   20.81  158.92    89.97    182.75   217.58   154.00    98.82    80.45   31.82  69.65   22.05  10.79   38.71  
1 1 1 -9  14  10 o 7  80.35   22.38  212.42    107.03   0.00     0.00     212.42    107.03   ?       ?      80.35   22.38  0.00    22.38  
1 1 1 -9  14  11 o 13 94.71   21.83  295.78    116.24   426.77   265.59   264.74    129.28   104.59  36.26  88.30   24.60  16.29   43.81  
1 1 1 -9  14  12 o 13 107.86  23.69  393.19    142.65   0.00     0.00     393.19    142.65   ?       ?      107.86  23.69  0.00    23.69  
1 1 1 -9  14  13 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  14  14 o 2  156.44  24.71  846.68    214.58   616.36   373.43   960.23    262.19   110.16  42.21  161.34  29.39  -51.18  51.43  
1 1 1 -9  14  15 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -9  15  1  o 11 68.76   23.15  143.97    108.08   0.00     0.00     143.97    108.08   ?       ?      68.76   23.15  0.00    23.15  
1 1 1 -9  15  2  o 19 85.23   20.88  232.80    101.32   237.60   176.30   230.43    123.82   85.59   29.55  84.00   24.30  1.59    38.26  
1 1 1 -9  15  3  o 8  52.60   21.10  51.41     97.02    0.00     0.00     51.41     97.02    ?       ?      52.60   21.10  0.00    21.10  
1 1 1 -9  15  4  o 12 49.14   19.85  41.30     86.54    34.44    179.35   43.38     98.80    63.30   27.26  51.71   21.09  11.59   34.46  
1 1 1 -9  15  5  o 16 115.76  34.72  496.15    248.99   496.15   248.99   0.00      0.00     115.76  34.72  ?       ?      0.00    34.72  
1 1 1 -9  15  6  o 7  85.13   33.41  222.99    238.25   222.99   238.25   0.00      0.00     85.13   33.41  ?       ?      0.00    33.41  
1 1 1 -9  15  7  o 2  146.27  21.77  689.01    177.23   775.94   309.95   646.77    216.04   140.74  37.63  136.58  28.48  4.16    47.19  
1 1 1 -9  15  8  o 6  51.80   20.85  52.58     95.11    0.00     0.00     52.58     95.11    ?       ?      51.80   20.85  0.00    20.85  
1 1 1 -9  15  9  o 7  61.91   21.94  116.09    97.61    395.25   272.91   75.14     104.52   99.78   36.51  56.19   22.10  43.58   42.68  
1 1 1 -9  15  10 o 18 95.70   21.23  304.54    113.56   192.83   271.79   328.17    125.00   81.02   34.17  98.60   22.57  -17.58  40.95  
1 1 1 -9  15  11 o 17 99.38   21.99  333.43    122.14   513.51   276.50   289.77    136.14   109.10  37.02  90.48   25.25  18.62   44.81  
1 1 1 -9  15  12 o 7  70.94   22.92  171.11    106.38   0.00     0.00     171.11    106.38   ?       ?      70.94   22.92  0.00    22.92  
1 1 1 -9  16  1  o 4  66.30   21.87  137.61    96.60    72.32    199.47   157.61    110.41   68.29   29.06  70.45   23.39  -2.16   37.30  
1 1 1 -9  16  2  o 2  110.85  25.88  417.93    161.67   0.00     0.00     417.93    161.67   ?       ?      110.85  25.88  0.00    25.88  
1 1 1 -9  16  3  o 9  65.09   23.46  126.18    112.06   0.00     0.00     126.18    112.06   ?       ?      65.09   23.46  0.00    23.46  
1 1 1 -9  16  4  f 0  128.23  26.87  566.48    191.42   0.00     0.00     566.48    191.42   ?       ?      128.23  26.87  0.00    26.87  
1 1 1 -9  16  5  o 1  127.73  22.43  536.94    158.50   428.01   309.63   575.62    184.50   102.67  38.64  129.90  25.65  -27.22  46.38  
1 1 1 -9  16  6  o 1  88.61   22.81  264.98    116.73   202.86   300.20   276.05    126.70   83.90   35.67  89.82   24.08  -5.91   43.04  
1 1 1 -9  16  7  o 6  85.55   36.15  232.74    305.03   232.74   305.03   0.00      0.00     85.55   36.15  ?       ?      0.00    36.15  
1 1 1 -8  -16 1  o 2  136.74  27.50  602.91    208.35   602.91   208.35   0.00      0.00     136.74  27.50  ?       ?      0.00    27.50  
1 1 1 -8  -16 2  o 2  96.93   26.60  303.31    152.50   303.31   152.50   0.00      0.00     96.93   26.60  ?       ?      0.00    26.60  
1 1 1 -8  -16 3  o 10 68.07   25.08  122.09    129.12   122.09   129.12   0.00      0.00     68.07   25.08  ?       ?      0.00    25.08  
1 1 1 -8  -16 4  o 14 116.44  26.15  436.56    170.49   436.56   170.49   0.00      0.00     116.44  26.15  ?       ?      0.00    26.15  
1 1 1 -8  -16 5  o 5  163.75  30.71  879.12    278.11   879.12   278.11   0.00      0.00     163.75  30.71  ?       ?      0.00    30.71  
1 1 1 -8  -15 1  o 10 85.31   17.52  222.56    82.90    237.45   134.41   213.42    105.33   87.11   25.35  82.79   21.85  4.32    33.47  
1 1 1 -8  -15 2  o 14 205.30  21.64  1278.17   251.18   1303.43  346.32   1250.14   364.84   202.08  30.83  196.03  33.63  6.05    45.62  
1 1 1 -8  -15 3  o 9  98.43   16.07  292.08    87.69    264.47   135.12   312.18    115.26   91.59   25.00  100.48  20.67  -8.89   32.44  
1 1 1 -8  -15 4  o 7  134.14  16.63  538.42    125.31   517.77   184.95   555.95    170.38   127.97  26.06  134.00  22.97  -6.04   34.74  
1 1 1 -8  -15 5  o 12 67.28   18.69  138.80    74.77    149.51   123.34   132.58    94.02    72.08   24.72  66.87   21.55  5.21    32.79  
1 1 1 -8  -15 6  o 11 233.81  26.33  1703.74   347.22   1648.04  494.23   1758.02   487.92   218.55  40.90  227.84  38.69  -9.29   56.30  
1 1 1 -8  -15 7  x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  -15 8  o 19 143.76  26.87  658.57    213.57   658.57   213.57   0.00      0.00     143.76  26.87  ?       ?      0.00    26.87  
1 1 1 -8  -14 1  o 10 112.86  16.39  380.91    103.10   365.58   157.44   392.42    136.42   107.91  25.77  113.00  21.82  -5.09   33.77  
1 1 1 -8  -14 2  o 10 218.65  23.72  1450.48   292.99   1543.37  418.47   1361.16   410.34   219.53  34.33  204.75  36.24  14.78   49.91  
1 1 1 -8  -14 3  o 8  202.95  20.93  1236.98   240.34   1294.72  330.26   1171.96   350.42   203.70  29.07  191.45  33.08  12.25   44.04  
1 1 1 -8  -14 4  o 6  253.59  27.74  1984.68   397.20   2030.10  564.77   1940.23   558.72   246.66  41.35  240.53  41.99  6.13    58.93  
1 1 1 -8  -14 5  o 18 141.04  17.06  593.16    135.33   497.84   194.38   682.84    188.53   125.40  27.74  149.48  22.68  -24.07  35.83  
1 1 1 -8  -14 6  f 0  112.17  25.48  395.62    160.33   395.62   160.33   0.00      0.00     112.17  25.48  ?       ?      0.00    25.48  
1 1 1 -8  -14 7  o 4  56.27   19.64  85.29     77.99    0.00     0.00     85.29     77.99    ?       ?      56.27   19.64  0.00    19.64  
1 1 1 -8  -14 8  o 15 224.91  23.12  1539.87   294.29   1544.70  402.76   1534.33   431.05   219.09  33.05  216.27  35.98  2.82    48.86  
1 1 1 -8  -14 9  o 10 164.42  17.18  807.02    159.73   1037.71  229.16   589.03    222.77   184.51  22.07  135.18  29.53  49.33   36.87  
1 1 1 -8  -14 10 o 16 41.35   16.63  25.21     60.41    93.90    101.09   -12.94    75.34    60.72   22.22  39.71   17.38  21.00   28.21  
1 1 1 -8  -14 11 o 1  63.19   17.77  122.05    67.12    186.56   115.02   88.74     82.65    77.70   23.66  57.33   20.20  20.37   31.11  
1 1 1 -8  -13 1  o 15 89.18   16.95  239.73    83.61    222.81   126.07   253.01    111.73   85.41   24.46  90.80   21.73  -5.39   32.72  
1 1 1 -8  -13 2  o 9  167.99  18.83  837.98    178.42   919.08   256.55   762.01    248.31   173.32  26.64  156.76  28.65  16.56   39.12  
1 1 1 -8  -13 3  o 8  84.54   17.06  216.26    79.96    261.76   123.23   183.18    105.08   92.10   23.29  77.66   22.36  14.44   32.29  
1 1 1 -8  -13 4  o 11 93.10   16.12  260.09    83.04    302.80   128.86   229.76    108.59   99.02   23.09  86.42   21.87  12.61   31.81  
1 1 1 -8  -13 5  o 17 231.28  23.72  1612.23   310.53   1603.76  414.74   1623.04   468.46   225.89  32.95  224.40  37.70  1.49    50.07  
1 1 1 -8  -13 6  x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  -13 7  o 7  269.54  26.34  2215.33   402.38   2253.29  529.24   2163.33   619.46   265.72  35.59  253.79  44.12  11.93   56.68  
1 1 1 -8  -13 8  o 15 145.11  17.07  626.45    139.45   624.83   204.43   627.86    190.71   141.78  26.08  142.89  24.11  -1.11   35.51  
1 1 1 -8  -13 9  o 19 165.46  18.63  818.12    173.86   746.49   244.91   890.89    246.84   153.92  28.78  169.68  26.18  -15.77  38.90  
1 1 1 -8  -13 10 o 13 143.73  16.45  614.51    133.30   660.21   193.22   573.00    184.13   146.41  23.81  135.93  24.50  10.49   34.16  
1 1 1 -8  -13 11 o 14 106.40  15.13  338.16    89.79    398.20   137.55   293.57    118.53   113.53  21.90  97.19   21.78  16.33   30.89  
1 1 1 -8  -13 12 o 2  84.77   15.28  217.18    71.60    271.38   115.66   183.52    91.16    93.20   21.98  76.96   20.33  16.24   29.94  
1 1 1 -8  -13 13 o 13 49.12   18.33  56.33     69.39    27.43    141.10   65.55     79.69    58.51   24.64  52.65   19.65  5.86    31.52  
1 1 1 -8  -12 1  x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  -12 2  x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  -12 3  o 18 193.75  31.12  1155.20   334.41   0.00     0.00     1155.20   334.41   ?       ?      193.75  31.12  0.00    31.12  
1 1 1 -8  -12 4  o 15 159.73  26.44  777.35    234.00   0.00     0.00     777.35    234.00   ?       ?      159.73  26.44  0.00    26.44  
1 1 1 -8  -12 5  x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  -12 6  o 15 211.28  33.96  1395.15   397.94   0.00     0.00     1395.15   397.94   ?       ?      211.28  33.96  0.00    33.96  
1 1 1 -8  -12 7  o 5  54.32   19.55  73.81     77.79    -176.24  635.85   77.61     78.38    105.65  48.02  55.13   19.65  50.51   51.89  
1 1 1 -8  -12 8  o 18 231.74  35.65  1702.31   459.11   1020.39  905.07   1938.57   532.74   170.16  65.58  245.31  39.14  -75.15  76.37  
1 1 1 -8  -12 9  o 1  213.67  29.38  1413.19   350.89   1629.54  789.80   1359.99   391.66   206.42  61.82  207.01  34.15  -0.60   70.62  
1 1 1 -8  -12 10 o 7  114.96  20.51  402.18    130.41   645.92   740.74   394.39    132.48   145.43  58.31  113.65  21.08  31.79   62.00  
1 1 1 -8  -12 11 o 15 67.01   19.67  135.54    80.63    1008.65  794.17   126.44    81.05    164.46  61.89  65.10   19.87  99.36   65.00  
1 1 1 -8  -12 12 o 2  105.17  16.41  332.01    95.81    203.02   139.10   448.45    132.16   82.01   26.19  121.61  19.60  -39.60  32.71  
1 1 1 -8  -12 13 o 5  196.52  21.01  1165.27   233.38   1255.08  330.38   1075.83   329.71   199.42  29.77  182.76  32.62  16.66   44.16  
1 1 1 -8  -12 14 o 16 198.86  21.94  1202.62   246.25   1308.75  360.64   1109.91   337.06   201.39  32.28  184.73  32.99  16.66   46.16  
1 1 1 -8  -12 15 o 12 199.89  30.09  1280.24   334.60   2352.89  1149.68  1180.98   349.74   210.82  75.24  189.69  33.33  21.12   82.29  
1 1 1 -8  -11 1  o 7  629.46  77.07  13850.15  2726.97  13984.58 3856.96  13715.78  3856.08  560.42  123.25 552.22  124.61 8.20    175.26 
1 1 1 -8  -11 2  o 1  220.88  23.47  1444.18   293.00   1461.38  416.49   1427.33   412.28   218.60  34.32  215.95  34.41  2.65    48.60  
1 1 1 -8  -11 3  o 13 138.18  16.69  561.85    129.68   591.47   190.06   536.05    177.38   139.97  24.55  133.21  24.08  6.76    34.39  
1 1 1 -8  -11 4  o 5  259.67  27.43  2017.27   402.75   2065.56  570.79   1969.38   568.38   257.25  39.95  250.60  40.92  6.65    57.19  
1 1 1 -8  -11 5  x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  -11 6  o 15 440.07  49.83  6268.03   1236.69  6286.12  1749.60  6249.97   1748.28  411.10  76.96  409.63  77.18  1.47    108.99 
1 1 1 -8  -11 7  o 2  104.51  15.39  323.74    89.60    298.50   130.84   346.03    122.94   98.72   23.44  106.92  20.78  -8.20   31.32  
1 1 1 -8  -11 8  o 18 356.14  32.79  3876.45   662.93   3832.54  830.31   3953.66   1101.03  347.15  42.55  338.72  58.75  8.43    72.54  
1 1 1 -8  -11 9  o 11 357.88  29.99  3890.85   610.54   4082.28  771.63   3570.37   998.42   360.95  37.80  322.15  56.02  38.80   67.58  
1 1 1 -8  -11 10 o 3  181.70  19.31  980.27    198.33   1141.76  283.58   825.65    277.48   193.74  26.17  162.45  30.88  31.29   40.48  
1 1 1 -8  -11 11 o 13 147.99  16.48  647.99    137.61   668.99   195.41   627.34    193.82   148.11  23.79  143.09  24.47  5.02    34.13  
1 1 1 -8  -11 12 o 11 278.22  28.82  2380.96   453.60   2342.38  590.68   2436.41   708.14   268.45  39.51  266.84  47.99  1.60    62.16  
1 1 1 -8  -11 13 o 1  161.12  26.14  802.75    233.48   410.68   911.11   830.31    241.54   139.79  60.81  163.71  26.61  -23.93  66.38  
1 1 1 -8  -11 14 o 18 191.36  28.44  1143.89   302.92   1475.71  908.31   1102.37   321.32   187.03  66.86  186.36  31.13  0.67    73.76  
1 1 1 -8  -11 15 o 4  97.01   20.24  290.11    109.09   0.00     0.00     290.11    109.09   ?       ?      97.01   20.24  0.00    20.24  
1 1 1 -8  -11 16 o 12 288.33  37.14  2757.29   600.43   4139.38  1279.73  2367.15   679.92   297.16  75.02  255.96  48.04  41.21   89.08  
1 1 1 -8  -11 17 o 15 110.07  21.91  377.87    133.58   1301.36  1085.77  363.68    134.60   164.67  68.80  107.73  22.49  56.95   72.38  
1 1 1 -8  -10 1  f 0  444.20  75.40  6638.23   1854.07  6638.23  1854.07  0.00      0.00     444.20  75.40  ?       ?      0.00    75.40  
1 1 1 -8  -10 2  o 3  352.21  56.57  3941.02   1105.01  3941.02  1105.01  0.00      0.00     352.21  56.57  ?       ?      0.00    56.57  
1 1 1 -8  -10 3  o 18 159.09  26.97  760.46    237.55   760.46   237.55   0.00      0.00     159.09  26.97  ?       ?      0.00    26.97  
1 1 1 -8  -10 4  o 5  358.54  58.14  4128.53   1155.77  4128.53  1155.77  0.00      0.00     358.54  58.14  ?       ?      0.00    58.14  
1 1 1 -8  -10 5  x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  -10 6  o 10 213.54  33.74  1391.50   399.90   1391.50  399.90   0.00      0.00     213.54  33.74  ?       ?      0.00    33.74  
1 1 1 -8  -10 7  o 5  333.60  55.32  3649.38   1022.24  3649.38  1022.24  0.00      0.00     333.60  55.32  ?       ?      0.00    55.32  
1 1 1 -8  -10 8  o 4  326.26  54.54  3517.21   985.47   3517.21  985.47   0.00      0.00     326.26  54.54  ?       ?      0.00    54.54  
1 1 1 -8  -10 9  o 3  117.54  22.56  418.96    146.71   418.96   146.71   0.00      0.00     117.54  22.56  ?       ?      0.00    22.56  
1 1 1 -8  -10 10 o 8  217.65  34.93  1473.83   421.67   1473.83  421.67   0.00      0.00     217.65  34.93  ?       ?      0.00    34.93  
1 1 1 -8  -10 11 f 0  173.38  28.40  922.32    272.86   922.32   272.86   0.00      0.00     173.38  28.40  ?       ?      0.00    28.40  
1 1 1 -8  -10 12 o 17 113.84  26.08  402.35    166.78   402.35   166.78   0.00      0.00     113.84  26.08  ?       ?      0.00    26.08  
1 1 1 -8  -10 13 o 15 117.89  26.20  433.23    172.68   433.23   172.68   0.00      0.00     117.89  26.20  ?       ?      0.00    26.20  
1 1 1 -8  -10 14 o 9  48.60   17.98  55.20     66.49    12.39    131.56   69.88     77.05    55.74   23.65  53.32   19.42  2.42    30.60  
1 1 1 -8  -10 15 o 15 179.72  18.93  964.41    192.38   1122.73  274.24   811.04    269.93   191.17  25.63  159.82  30.53  31.35   39.87  
1 1 1 -8  -10 16 o 6  48.07   17.62  55.82     63.58    74.79    127.59   49.55     73.33    62.10   24.42  48.78   18.70  13.32   30.76  
1 1 1 -8  -10 17 o 5  172.00  19.28  890.77    187.12   981.28   276.02   813.81    254.53   176.24  28.24  159.91  28.78  16.33   40.32  
1 1 1 -8  -10 18 o 15 149.29  17.46  669.80    146.79   753.70   218.88   601.23    197.89   154.82  25.52  137.72  25.98  17.10   36.42  
1 1 1 -8  -10 19 o 4  64.33   24.99  91.11     132.24   91.11    132.24   0.00      0.00     64.33   24.99  ?       ?      0.00    24.99  
1 1 1 -8  -9  1  o 1  463.51  50.43  6687.73   1320.21  6638.92  1867.55  6736.50   1866.57  440.93  76.56  444.90  75.80  -3.96   107.73 
1 1 1 -8  -9  2  o 2  176.47  27.90  934.19    273.22   0.00     0.00     934.19    273.22   ?       ?      176.47  27.90  0.00    27.90  
1 1 1 -8  -9  3  o 19 276.46  28.90  2265.62   451.86   2254.59  640.12   2276.58   637.95   270.96  42.55  272.47  42.14  -1.51   59.89  
1 1 1 -8  -9  4  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  -9  5  o 17 502.80  88.70  8845.64   2466.56  0.00     0.00     8845.64   2466.56  ?       ?      502.80  88.70  0.00    88.70  
1 1 1 -8  -9  6  o 19 253.95  26.58  1905.11   381.83   1950.45  540.46   1859.94   539.51   253.26  38.37  246.84  39.40  6.42    55.00  
1 1 1 -8  -9  7  o 18 273.08  28.42  2212.14   439.01   2327.59  621.85   2097.43   619.85   275.83  40.48  260.60  42.93  15.23   59.00  
1 1 1 -8  -9  8  o 2  132.94  16.00  518.71    119.67   454.07   171.23   580.42    167.31   122.35  25.22  139.58  21.58  -17.22  33.19  
1 1 1 -8  -9  9  o 7  118.44  14.82  412.16    98.56    474.62   140.83   352.20    137.97   126.12  20.13  107.72  23.01  18.41   30.57  
1 1 1 -8  -9  10 o 8  278.82  24.11  2303.69   382.06   2576.69  488.71   1874.61   612.70   292.79  29.48  241.62  45.85  51.18   54.51  
1 1 1 -8  -9  11 o 15 291.65  27.05  2546.15   447.69   2628.45  569.62   2413.16   724.06   292.69  34.57  272.49  48.04  20.20   59.19  
1 1 1 -8  -9  12 o 15 110.20  16.63  361.16    101.93   328.78   156.75   384.88    134.18   103.22  26.36  112.68  21.53  -9.45   34.04  
1 1 1 -8  -9  13 o 13 320.06  28.02  3095.77   509.68   3367.55  650.34   2663.09   820.57   329.49  34.91  279.59  53.06  49.90   63.52  
1 1 1 -8  -9  14 o 17 60.88   18.30  109.95    69.11    166.63   124.36   84.62     83.12    75.75   24.81  57.13   20.25  18.62   32.02  
1 1 1 -8  -9  15 o 18 199.29  34.17  1265.43   376.82   1265.43  376.82   0.00      0.00     199.29  34.17  ?       ?      0.00    34.17  
1 1 1 -8  -9  16 o 7  72.84   25.26  148.03    128.89   148.03   128.89   0.00      0.00     72.84   25.26  ?       ?      0.00    25.26  
1 1 1 -8  -9  17 o 12 228.94  39.78  1748.15   503.91   1748.15  503.91   0.00      0.00     228.94  39.78  ?       ?      0.00    39.78  
1 1 1 -8  -9  18 o 5  143.35  27.59  651.67    218.77   651.67   218.77   0.00      0.00     143.35  27.59  ?       ?      0.00    27.59  
1 1 1 -8  -9  19 o 13 66.71   24.41  116.49    121.98   116.49   121.98   0.00      0.00     66.71   24.41  ?       ?      0.00    24.41  
1 1 1 -8  -9  20 o 7  76.73   25.32  178.78    129.41   178.78   129.41   0.00      0.00     76.73   25.32  ?       ?      0.00    25.32  
1 1 1 -8  -8  1  o 7  245.60  25.65  1781.69   356.35   1676.08  504.14   1887.14   503.76   233.95  38.90  249.52  36.23  -15.57  53.16  
1 1 1 -8  -8  2  o 8  608.16  70.13  12218.65  2403.74  12430.86 3399.58  12006.49  3399.22  566.05  108.57 552.73  110.99 13.33   155.26 
1 1 1 -8  -8  3  o 15 410.50  43.78  5156.16   1015.78  5273.50  1436.89  5038.94   1436.16  401.51  64.53  391.00  66.35  10.52   92.55  
1 1 1 -8  -8  4  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  -8  5  o 12 102.76  14.84  311.14    85.01    351.55   124.00   275.29    116.77   108.27  20.71  95.44   21.79  12.83   30.06  
1 1 1 -8  -8  6  o 19 404.32  42.86  4966.09   979.58   5070.59  1385.58  4861.67   1385.08  396.68  62.95  387.20  64.59  9.48    90.19  
1 1 1 -8  -8  7  o 12 264.08  27.41  2060.75   409.46   2293.22  579.41   1828.81   578.73   275.45  37.62  243.61  42.95  31.84   57.10  
1 1 1 -8  -8  8  o 14 292.69  30.47  2543.20   504.44   2685.26  714.17   2401.76   712.62   296.09  43.30  278.55  46.18  17.53   63.30  
1 1 1 -8  -8  9  o 1  175.79  18.90  905.87    187.74   975.63   266.45   837.10    264.57   180.81  26.45  166.66  28.69  14.15   39.02  
1 1 1 -8  -8  10 o 10 127.60  15.03  477.17    107.99   523.23   151.56   429.67    153.90   132.59  20.58  119.32  23.31  13.27   31.09  
1 1 1 -8  -8  11 o 11 277.16  26.06  2281.88   409.77   2321.99  528.71   2221.52   648.47   276.42  34.04  265.51  44.09  10.91   55.70  
1 1 1 -8  -8  12 o 7  338.89  28.73  3441.88   553.72   3720.06  702.99   2987.21   898.73   348.56  35.63  300.20  54.14  48.37   64.82  
1 1 1 -8  -8  13 o 14 142.26  16.46  596.27    131.96   716.27   187.31   478.04    185.93   154.77  21.68  124.61  26.79  30.16   34.46  
1 1 1 -8  -8  14 o 15 182.13  18.61  980.09    191.84   1119.55  265.64   828.06    277.35   192.88  24.55  163.28  30.72  29.59   39.32  
1 1 1 -8  -8  15 o 16 99.28   15.60  293.94    85.97    327.86   136.68   271.73    110.59   103.10  23.60  94.21   20.99  8.89    31.58  
1 1 1 -8  -8  16 o 3  158.19  17.34  742.42    154.85   792.93   221.71   694.32    216.38   160.97  24.79  149.94  26.09  11.03   35.98  
1 1 1 -8  -8  17 o 16 207.40  22.35  1298.22   261.93   1356.04  376.62   1244.05   364.53   206.48  32.87  197.33  33.37  9.15    46.84  
1 1 1 -8  -8  18 o 7  119.69  15.49  426.63    103.94   486.63   160.06   382.88    136.69   125.48  23.07  111.27  22.18  14.21   32.00  
1 1 1 -8  -8  19 o 18 203.32  28.87  1305.06   327.50   2058.84  924.47   1196.89   350.21   214.57  67.38  192.03  32.95  22.54   75.01  
1 1 1 -8  -8  20 o 17 126.73  27.38  516.51    193.37   516.51   193.37   0.00      0.00     126.73  27.38  ?       ?      0.00    27.38  
1 1 1 -8  -8  21 o 12 115.13  26.21  427.96    169.30   427.96   169.30   0.00      0.00     115.13  26.21  ?       ?      0.00    26.21  
1 1 1 -8  -7  1  o 14 226.54  23.38  1506.33   299.66   1521.99  424.57   1490.79   423.01   225.08  33.91  222.64  34.19  2.44    48.15  
1 1 1 -8  -7  2  o 17 572.95  63.38  10402.75  2049.73  10397.24 2898.89  10408.26  2898.63  541.33  96.84  541.70  96.76  -0.37   136.90 
1 1 1 -8  -7  3  o 14 409.35  66.81  5434.42   1515.81  5434.42  1515.81  0.00      0.00     409.35  66.81  ?       ?      0.00    66.81  
1 1 1 -8  -7  4  o 4  334.98  52.91  3522.27   983.71   0.00     0.00     3522.27   983.71   ?       ?      334.98  52.91  0.00    52.91  
1 1 1 -8  -7  5  o 16 287.40  29.80  2453.94   484.55   2571.71  685.78   2336.53   684.75   289.45  42.54  274.63  44.99  14.82   61.92  
1 1 1 -8  -7  6  o 2  354.29  37.23  3783.39   745.84   3928.70  1055.10  3638.24   1054.46  352.41  53.86  337.42  56.43  14.98   78.01  
1 1 1 -8  -7  7  o 14 101.75  14.47  304.80    82.15    295.16   117.63   313.98    114.78   98.91   21.34  102.25  20.27  -3.34   29.44  
1 1 1 -8  -7  8  o 12 325.61  34.02  3168.35   626.60   3237.32  886.61   3099.53   885.70   322.42  49.48  314.74  50.74  7.68    70.87  
1 1 1 -8  -7  9  o 16 108.89  15.47  349.14    93.96    442.61   134.55   260.18    131.26   122.03  19.89  92.82   24.34  29.21   31.43  
1 1 1 -8  -7  10 o 19 228.96  24.29  1544.49   314.40   1539.60  441.36   1549.51   447.98   225.50  35.25  226.09  35.70  -0.59   50.17  
1 1 1 -8  -7  11 o 4  106.38  17.41  336.01    102.62   465.05   146.48   211.64    143.80   124.79  21.20  85.17   26.55  39.62   33.98  
1 1 1 -8  -7  12 o 2  147.69  16.84  640.43    140.24   761.34   195.10   511.16    201.73   160.11  21.79  129.28  27.99  30.83   35.48  
1 1 1 -8  -7  13 o 17 304.15  32.15  2800.26   552.88   2956.91  783.19   2644.65   780.60   304.70  46.22  285.98  49.33  18.72   67.60  
1 1 1 -8  -7  14 o 13 190.94  19.09  1075.31   206.40   1135.47  280.67   1004.46   304.59   194.18  25.82  180.83  30.42  13.35   39.90  
1 1 1 -8  -7  15 o 10 126.10  15.85  469.70    112.20   454.07   163.08   483.75    154.62   121.85  24.17  126.42  22.11  -4.58   32.75  
1 1 1 -8  -7  16 o 17 168.76  18.80  845.47    179.07   838.43   259.88   851.83    247.08   164.68  28.52  166.72  26.72  -2.04   39.08  
1 1 1 -8  -7  17 o 17 150.57  17.35  673.46    147.25   691.38   219.15   658.72    198.81   149.44  26.52  146.54  24.50  2.90    36.10  
1 1 1 -8  -7  18 o 1  187.52  19.54  1051.84   207.22   1149.80  290.39   950.21    295.78   192.81  26.97  173.08  30.90  19.73   41.02  
1 1 1 -8  -7  19 o 14 382.71  32.18  4634.92   700.43   5212.39  885.64   3670.49   1144.53  397.12  39.37  295.03  68.84  102.09  79.30  
1 1 1 -8  -7  20 o 10 168.91  28.52  906.56    266.71   906.56   266.71   0.00      0.00     168.91  28.52  ?       ?      0.00    28.52  
1 1 1 -8  -7  21 o 13 129.03  25.95  531.15    185.52   531.15   185.52   0.00      0.00     129.03  25.95  ?       ?      0.00    25.95  
1 1 1 -8  -7  22 o 14 168.34  29.06  923.40    270.66   923.40   270.66   0.00      0.00     168.34  29.06  ?       ?      0.00    29.06  
1 1 1 -8  -6  1  o 8  519.80  87.67  9055.44   2523.09  0.00     0.00     9055.44   2523.09  ?       ?      519.80  87.67  0.00    87.67  
1 1 1 -8  -6  2  f 0  638.31  119.29 15115.77  4210.46  0.00     0.00     15115.77  4210.46  ?       ?      638.31  119.29 0.00    119.29 
1 1 1 -8  -6  3  x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  -6  4  o 9  220.25  33.47  1455.28   409.91   0.00     0.00     1455.28   409.91   ?       ?      220.25  33.47  0.00    33.47  
1 1 1 -8  -6  5  o 15 482.64  81.85  7846.56   2186.78  0.00     0.00     7846.56   2186.78  ?       ?      482.64  81.85  0.00    81.85  
1 1 1 -8  -6  6  o 17 357.27  56.86  4038.75   1127.17  0.00     0.00     4038.75   1127.17  ?       ?      357.27  56.86  0.00    56.86  
1 1 1 -8  -6  7  o 5  275.45  42.69  2333.09   653.16   0.00     0.00     2333.09   653.16   ?       ?      275.45  42.69  0.00    42.69  
1 1 1 -8  -6  8  x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  -6  9  o 13 428.64  72.40  6160.59   1718.26  0.00     0.00     6160.59   1718.26  ?       ?      428.64  72.40  0.00    72.40  
1 1 1 -8  -6  10 o 19 397.34  65.11  5130.98   1433.82  0.00     0.00     5130.98   1433.82  ?       ?      397.34  65.11  0.00    65.11  
1 1 1 -8  -6  11 o 9  495.61  87.38  8586.02   2395.39  0.00     0.00     8586.02   2395.39  ?       ?      495.61  87.38  0.00    87.38  
1 1 1 -8  -6  12 o 19 143.77  24.56  619.53    195.41   1509.65  649.00   530.78    204.92   216.90  52.66  132.15  27.89  84.75   59.59  
1 1 1 -8  -6  13 o 19 426.37  42.68  5591.34   1030.52  6440.39  1522.05  4872.69   1400.30  442.97  61.51  380.62  66.51  62.34   90.59  
1 1 1 -8  -6  14 o 1  219.95  30.14  1465.59   370.57   1222.31  694.42   1562.45   438.18   190.53  58.16  225.25  35.02  -34.73  67.89  
1 1 1 -8  -6  15 o 2  306.15  33.24  2866.71   574.75   3282.19  911.45   2592.43   740.55   314.66  52.29  282.44  47.35  32.22   70.54  
1 1 1 -8  -6  16 o 18 265.79  35.64  2201.87   530.04   1861.53  880.89   2395.02   663.62   224.78  64.75  272.07  43.99  -47.29  78.28  
1 1 1 -8  -6  17 o 9  283.44  48.08  2693.85   754.37   0.00     0.00     2693.85   754.37   ?       ?      283.44  48.08  0.00    48.08  
1 1 1 -8  -6  18 o 2  255.71  27.48  2004.34   397.10   2069.48  565.14   1940.81   558.10   251.04  40.60  242.21  41.64  8.83    58.16  
1 1 1 -8  -6  19 o 13 65.93   17.32  132.69    66.40    209.80   116.47   95.57     80.82    82.37   23.49  58.69   20.01  23.69   30.86  
1 1 1 -8  -6  20 o 18 132.51  15.53  522.47    115.92   602.33   175.23   460.31    154.58   139.88  22.59  121.79  22.95  18.09   32.21  
1 1 1 -8  -6  21 f 0  177.86  28.14  1004.96   277.80   1004.96  277.80   0.00      0.00     177.86  28.14  ?       ?      0.00    28.14  
1 1 1 -8  -6  22 f 0  102.22  24.75  335.06    143.68   335.06   143.68   0.00      0.00     102.22  24.75  ?       ?      0.00    24.75  
1 1 1 -8  -6  23 o 1  77.54   24.03  189.05    118.02   189.05   118.02   0.00      0.00     77.54   24.03  ?       ?      0.00    24.03  
1 1 1 -8  -5  1  o 14 415.16  66.31  5478.77   1527.25  0.00     0.00     5478.77   1527.25  ?       ?      415.16  66.31  0.00    66.31  
1 1 1 -8  -5  2  o 1  586.93  104.00 12118.33  3376.03  12118.33 3376.03  0.00      0.00     586.93  104.00 ?       ?      0.00    104.00 
1 1 1 -8  -5  3  o 9  458.72  74.49  6797.67   1894.40  0.00     0.00     6797.67   1894.40  ?       ?      458.72  74.49  0.00    74.49  
1 1 1 -8  -5  4  o 11 307.03  31.68  2785.65   550.36   2788.79  778.93   2782.52   777.72   302.46  46.34  302.12  46.32  0.34    65.52  
1 1 1 -8  -5  5  f 0  151.64  16.03  670.62    137.44   669.09   194.98   672.14    193.76   150.15  23.38  150.54  23.16  -0.39   32.91  
1 1 1 -8  -5  6  o 18 98.90   12.02  285.70    66.85    309.25   95.95    263.48    93.20    102.15  16.96  93.95   17.93  8.20    24.68  
1 1 1 -8  -5  7  o 19 165.18  17.46  797.38    163.07   648.30   228.78   951.36    232.51   146.55  28.22  179.50  23.10  -32.95  36.47  
1 1 1 -8  -5  8  o 5  196.64  20.74  1134.52   230.60   876.06   324.52   1398.12   327.73   169.17  34.58  217.07  26.87  -47.90  43.80  
1 1 1 -8  -5  9  o 13 334.34  35.66  3360.80   673.88   2727.29  951.53   3998.24   954.49   289.64  59.23  359.11  47.46  -69.46  75.90  
1 1 1 -8  -5  10 o 4  287.09  29.97  2453.55   486.67   2507.10  687.96   2399.92   688.54   284.90  43.44  278.10  44.64  6.80    62.28  
1 1 1 -8  -5  11 o 17 491.97  53.75  7579.27   1493.42  7649.95  2111.92  7508.57   2112.11  471.10  81.01  465.73  81.99  5.38    115.26 
1 1 1 -8  -5  12 o 7  608.46  69.46  12112.02  2382.97  12321.65 3369.94  11902.38  3370.11  569.91  106.93 556.77  109.34 13.14   152.94 
1 1 1 -8  -5  13 o 9  121.65  15.84  434.85    107.98   593.78   150.97   268.37    154.51   141.87  19.02  94.55   27.08  47.32   33.09  
1 1 1 -8  -5  14 o 6  161.07  17.52  761.20    159.39   824.76   222.19   693.81    228.77   166.25  23.97  151.36  27.34  14.90   36.36  
1 1 1 -8  -5  15 o 2  108.10  15.50  345.58    93.46    403.52   138.72   297.41    126.49   115.61  21.70  98.77   22.77  16.84   31.45  
1 1 1 -8  -5  16 o 5  201.93  20.09  1205.99   229.85   1192.04  307.43   1223.66   346.10   198.16  27.79  199.43  31.26  -1.28   41.82  
1 1 1 -8  -5  17 o 7  297.18  28.61  2677.65   482.13   2621.66  610.66   2770.34   785.61   288.53  37.77  288.35  49.23  0.18    62.05  
1 1 1 -8  -5  18 o 7  121.03  20.43  443.28    136.87   -193.72  541.49   486.76    141.47   96.34   43.99  127.06  20.06  -30.72  48.35  
1 1 1 -8  -5  19 o 13 214.13  35.21  1475.24   417.76   0.00     0.00     1475.24   417.76   ?       ?      214.13  35.21  0.00    35.21  
1 1 1 -8  -5  20 o 13 110.45  49.70  17.15     661.00   17.15    661.00   0.00      0.00     110.45  49.70  ?       ?      0.00    49.70  
1 1 1 -8  -5  21 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  -5  22 o 16 121.65  52.82  371.02    685.02   371.02   685.02   0.00      0.00     121.65  52.82  ?       ?      0.00    52.82  
1 1 1 -8  -5  23 o 14 91.37   41.43  -12.22    469.67   -12.22   469.67   0.00      0.00     91.37   41.43  ?       ?      0.00    41.43  
1 1 1 -8  -5  24 o 3  87.40   39.85  -27.15    442.34   -27.15   442.34   0.00      0.00     87.40   39.85  ?       ?      0.00    39.85  
1 1 1 -8  -4  1  o 15 208.07  21.61  1268.83   254.39   1124.53  359.11   1414.19   360.42   192.89  33.65  217.96  29.57  -25.07  44.80  
1 1 1 -8  -4  2  x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  -4  3  o 10 472.89  50.54  6820.38   1350.76  6369.33  1910.19  7271.49   1910.32  439.48  78.60  474.63  72.40  -35.14  106.86 
1 1 1 -8  -4  4  o 9  378.28  59.42  4475.80   1247.82  4475.80  1247.82  0.00      0.00     378.28  59.42  ?       ?      0.00    59.42  
1 1 1 -8  -4  5  o 7  503.51  83.89  8397.25   2339.62  8397.25  2339.62  0.00      0.00     503.51  83.89  ?       ?      0.00    83.89  
1 1 1 -8  -4  6  o 4  347.42  53.93  3731.64   1040.69  3731.64  1040.69  0.00      0.00     347.42  53.93  ?       ?      0.00    53.93  
1 1 1 -8  -4  7  o 9  394.43  62.54  4910.39   1368.86  4910.39  1368.86  0.00      0.00     394.43  62.54  ?       ?      0.00    62.54  
1 1 1 -8  -4  8  o 17 182.40  27.48  991.84    278.80   991.84   278.80   0.00      0.00     182.40  27.48  ?       ?      0.00    27.48  
1 1 1 -8  -4  9  o 18 326.50  51.38  3332.35   931.15   3332.35  931.15   0.00      0.00     326.50  51.38  ?       ?      0.00    51.38  
1 1 1 -8  -4  10 o 19 514.18  95.22  9715.03   2707.16  9715.03  2707.16  0.00      0.00     514.18  95.22  ?       ?      0.00    95.22  
1 1 1 -8  -4  11 o 1  399.02  66.68  5280.92   1473.49  5280.92  1473.49  0.00      0.00     399.02  66.68  ?       ?      0.00    66.68  
1 1 1 -8  -4  12 o 7  304.20  47.96  2889.30   809.83   2889.30  809.83   0.00      0.00     304.20  47.96  ?       ?      0.00    47.96  
1 1 1 -8  -4  13 o 13 379.26  61.82  4650.70   1299.56  4650.70  1299.56  0.00      0.00     379.26  61.82  ?       ?      0.00    61.82  
1 1 1 -8  -4  14 o 9  120.47  22.94  436.61    152.88   436.61   152.88   0.00      0.00     120.47  22.94  ?       ?      0.00    22.94  
1 1 1 -8  -4  15 o 18 240.36  37.77  1780.18   503.97   1780.18  503.97   0.00      0.00     240.36  37.77  ?       ?      0.00    37.77  
1 1 1 -8  -4  16 o 8  390.00  70.31  5432.23   1516.27  5432.23  1516.27  0.00      0.00     390.00  70.31  ?       ?      0.00    70.31  
1 1 1 -8  -4  17 o 9  320.36  55.11  3492.07   977.00   3492.07  977.00   0.00      0.00     320.36  55.11  ?       ?      0.00    55.11  
1 1 1 -8  -4  18 o 8  333.76  60.28  3978.99   1112.44  3978.99  1112.44  0.00      0.00     333.76  60.28  ?       ?      0.00    60.28  
1 1 1 -8  -4  19 o 6  159.85  26.56  789.29    235.19   789.29   235.19   0.00      0.00     159.85  26.56  ?       ?      0.00    26.56  
1 1 1 -8  -4  20 o 10 177.07  29.22  988.01    286.66   988.01   286.66   0.00      0.00     177.07  29.22  ?       ?      0.00    29.22  
1 1 1 -8  -4  21 o 8  72.40   20.50  161.31    89.04    161.31   89.04    0.00      0.00     72.40   20.50  ?       ?      0.00    20.50  
1 1 1 -8  -4  22 o 6  54.68   20.07  74.70     82.52    74.70    82.52    0.00      0.00     54.68   20.07  ?       ?      0.00    20.07  
1 1 1 -8  -4  23 o 6  51.86   19.39  64.33     77.68    64.33    77.68    0.00      0.00     51.86   19.39  ?       ?      0.00    19.39  
1 1 1 -8  -4  24 o 13 155.41  24.87  773.25    214.41   773.25   214.41   0.00      0.00     155.41  24.87  ?       ?      0.00    24.87  
1 1 1 -8  -3  1  o 6  200.21  30.27  1202.84   337.10   1202.84  337.10   0.00      0.00     200.21  30.27  ?       ?      0.00    30.27  
1 1 1 -8  -3  2  x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  -3  3  x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  -3  4  x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  -3  5  o 1  647.18  124.59 16015.59  4460.73  16015.59 4460.73  0.00      0.00     647.18  124.59 ?       ?      0.00    124.59 
1 1 1 -8  -3  6  o 4  126.50  13.37  465.99    95.63    440.08   134.24   492.70    136.26   121.81  19.88  129.22  18.93  -7.41   27.45  
1 1 1 -8  -3  7  o 5  423.67  44.85  5409.98   1074.25  4955.39  1519.12  5864.68   1519.32  392.49  69.99  431.77  63.16  -39.29  94.28  
1 1 1 -8  -3  8  o 10 590.79  65.63  11005.90  2188.19  9714.92  3094.43  12297.12  3094.72  517.92  107.60 599.77  92.88  -81.85  142.14 
1 1 1 -8  -3  9  o 15 120.79  13.70  425.95    93.35    374.94   133.65   474.54    130.44   111.85  21.60  126.79  18.46  -14.94  28.41  
1 1 1 -8  -3  10 o 1  469.45  50.66  6821.87   1343.75  6861.51  1900.64  6782.26   1900.06  451.66  76.00  448.55  76.53  3.11    107.86 
1 1 1 -8  -3  11 o 1  381.74  40.26  4430.41   868.94   4697.43  1229.29  4163.76   1228.45  382.54  57.78  356.86  62.23  25.68   84.91  
1 1 1 -8  -3  12 o 7  216.70  22.63  1384.15   277.35   1383.73  393.50   1384.56   390.97   213.58  33.17  213.72  32.92  -0.15   46.73  
1 1 1 -8  -3  13 o 1  283.57  29.08  2389.73   466.69   2699.71  661.03   2081.67   658.97   297.45  39.70  257.90  46.21  39.55   60.92  
1 1 1 -8  -3  14 o 18 236.45  25.33  1652.55   338.45   1404.34  479.65   1898.69   477.64   212.94  40.72  250.91  34.04  -37.97  53.07  
1 1 1 -8  -3  15 o 19 179.88  19.06  949.78    193.84   991.52   275.98   909.13    272.33   181.83  27.28  173.68  28.29  8.15    39.30  
1 1 1 -8  -3  16 o 14 348.42  32.42  3660.50   641.01   3402.93  795.60   4137.05   1082.19  329.98  43.02  355.95  54.71  -25.98  69.60  
1 1 1 -8  -3  17 o 14 108.48  20.86  356.26    125.22   356.26   125.22   0.00      0.00     108.48  20.86  ?       ?      0.00    20.86  
1 1 1 -8  -3  18 o 12 166.83  17.83  822.86    168.13   860.60   239.59   786.24    236.01   168.17  25.63  160.26  26.58  7.91    36.92  
1 1 1 -8  -3  19 o 4  235.48  23.39  1666.87   311.97   1580.59  403.79   1794.64   491.38   224.86  32.20  236.65  37.41  -11.79  49.36  
1 1 1 -8  -3  20 o 13 218.42  24.31  1452.36   299.60   1195.42  391.03   1817.63   466.24   191.00  37.00  237.76  35.22  -46.76  51.09  
1 1 1 -8  -3  21 o 13 159.93  24.88  794.21    221.02   794.21   221.02   0.00      0.00     159.93  24.88  ?       ?      0.00    24.88  
1 1 1 -8  -3  22 o 18 80.69   20.46  203.02    94.89    203.02   94.89    0.00      0.00     80.69   20.46  ?       ?      0.00    20.46  
1 1 1 -8  -3  23 o 9  122.42  22.23  469.16    150.49   469.16   150.49   0.00      0.00     122.42  22.23  ?       ?      0.00    22.23  
1 1 1 -8  -3  24 o 11 47.68   19.13  38.16     79.77    38.16    79.77    0.00      0.00     47.68   19.13  ?       ?      0.00    19.13  
1 1 1 -8  -3  25 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  -2  1  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  -2  2  x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  -2  3  o 4  90.95   15.76  245.73    79.29    0.00     0.00     245.73    79.29    ?       ?      90.95   15.76  0.00    15.76  
1 1 1 -8  -2  4  o 11 299.10  31.23  2655.71   528.33   2462.31  746.86   2849.44   747.49   281.78  47.88  305.26  43.92  -23.48  64.97  
1 1 1 -8  -2  5  o 14 315.60  32.63  2956.24   582.57   2981.76  823.99   2930.74   823.76   311.43  47.60  308.51  48.08  2.93    67.66  
1 1 1 -8  -2  6  o 16 371.94  38.82  4137.78   816.72   4071.06  1155.10  4204.48   1154.93  360.48  57.77  367.02  56.64  -6.54   80.90  
1 1 1 -8  -2  7  o 13 505.52  84.93  8534.54   2377.49  0.00     0.00     8534.54   2377.49  ?       ?      505.52  84.93  0.00    84.93  
1 1 1 -8  -2  8  o 5  228.07  23.41  1525.02   302.19   1562.58  427.67   1487.57   427.04   228.44  33.62  222.53  34.55  5.91    48.20  
1 1 1 -8  -2  9  o 10 359.49  37.33  3857.46   759.23   3950.42  1073.98  3764.59   1073.45  356.65  54.16  347.26  55.73  9.39    77.71  
1 1 1 -8  -2  10 o 7  418.40  44.33  5315.62   1048.54  5289.90  1483.01  5341.33   1482.71  404.58  66.14  406.85  65.72  -2.27   93.24  
1 1 1 -8  -2  11 o 15 310.18  32.27  2871.92   566.25   2927.31  801.40   2816.69   800.20   306.92  46.98  300.47  48.01  6.45    67.17  
1 1 1 -8  -2  12 o 5  376.55  39.94  4320.14   850.16   4424.89  1202.71  4215.52   1201.92  369.49  58.66  359.28  60.42  10.21   84.21  
1 1 1 -8  -2  13 o 19 202.55  21.22  1207.56   243.05   1204.74  345.12   1210.34   342.34   199.55  31.14  200.14  30.78  -0.59   43.79  
1 1 1 -8  -2  14 o 16 505.70  94.07  9438.02   2630.35  9438.02  2630.35  0.00      0.00     505.70  94.07  ?       ?      0.00    94.07  
1 1 1 -8  -2  15 o 13 150.55  17.11  664.77    145.29   622.90   208.36   704.38    202.68   143.67  26.23  153.60  23.75  -9.94   35.39  
1 1 1 -8  -2  16 o 2  108.83  13.37  347.23    81.76    234.59   118.35   450.07    113.08   87.96   23.13  123.58  16.34  -35.62  28.32  
1 1 1 -8  -2  17 o 14 45.57   16.37  51.03     54.52    29.12    76.57    73.57     77.66    46.42   18.70  54.41   19.54  -8.00   27.05  
1 1 1 -8  -2  18 o 15 170.06  23.18  870.38    220.39   961.18   498.99   848.37    245.65   168.72  48.77  166.69  26.56  2.02    55.54  
1 1 1 -8  -2  19 o 18 245.66  21.59  1799.14   301.45   1964.64  387.36   1545.01   480.01   254.25  26.95  218.19  39.79  36.06   48.06  
1 1 1 -8  -2  20 o 8  222.59  21.66  1487.98   273.31   1411.46  350.78   1606.20   436.02   212.85  29.50  223.85  35.08  -11.00  45.84  
1 1 1 -8  -2  21 o 1  186.84  24.37  1074.18   255.17   1074.18  255.17   0.00      0.00     186.84  24.37  ?       ?      0.00    24.37  
1 1 1 -8  -2  22 o 7  52.70   19.20  69.93     75.31    69.93    75.31    0.00      0.00     52.70   19.20  ?       ?      0.00    19.20  
1 1 1 -8  -2  23 o 17 179.66  23.83  1007.26   239.68   1007.26  239.68   0.00      0.00     179.66  23.83  ?       ?      0.00    23.83  
1 1 1 -8  -2  24 f 0  46.86   18.41  42.38     72.38    42.38    72.38    0.00      0.00     46.86   18.41  ?       ?      0.00    18.41  
1 1 1 -8  -2  25 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  -2  26 o 13 80.54   19.26  206.76    87.83    206.76   87.83    0.00      0.00     80.54   19.26  ?       ?      0.00    19.26  
1 1 1 -8  -1  1  x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  -1  2  o 7  307.74  48.52  2971.11   828.82   2971.11  828.82   0.00      0.00     307.74  48.52  ?       ?      0.00    48.52  
1 1 1 -8  -1  3  o 17 244.04  25.25  1758.88   348.67   1684.49  493.14   1833.23   493.04   234.75  37.88  245.78  36.01  -11.03  52.27  
1 1 1 -8  -1  4  o 3  283.37  29.35  2382.19   470.55   2356.23  665.57   2408.13   665.34   276.72  43.32  280.05  42.74  -3.33   60.85  
1 1 1 -8  -1  5  o 16 112.67  11.82  369.63    75.30    378.28   106.39   360.95    106.58   113.19  16.89  110.42  17.39  2.77    24.24  
1 1 1 -8  -1  6  o 12 562.01  61.72  9936.98   1958.46  9889.25  2769.76  9984.72   2769.60  531.99  94.14  535.18  93.55  -3.19   132.72 
1 1 1 -8  -1  7  o 13 393.67  62.65  4909.74   1368.38  4909.74  1368.38  0.00      0.00     393.67  62.65  ?       ?      0.00    62.65  
1 1 1 -8  -1  8  o 5  443.51  46.65  5956.54   1169.99  6156.97  1655.02  5756.31   1654.22  438.94  67.87  422.38  70.72  16.55   98.02  
1 1 1 -8  -1  9  f 0  474.75  50.40  6881.96   1352.55  7032.34  1913.17  6731.69   1912.41  464.68  74.21  453.03  76.24  11.65   106.40 
1 1 1 -8  -1  10 o 19 292.31  45.02  2617.87   731.26   0.00     0.00     2617.87   731.26   ?       ?      292.31  45.02  0.00    45.02  
1 1 1 -8  -1  11 o 1  191.30  19.80  1072.64   214.33   1105.93  304.13   1039.78   302.10   192.25  28.41  186.07  29.25  6.17    40.77  
1 1 1 -8  -1  12 o 4  388.59  41.39  4612.18   909.18   4629.23  1286.13  4595.15   1285.42  376.33  61.67  374.74  61.91  1.59    87.38  
1 1 1 -8  -1  13 o 19 253.61  26.59  1910.32   381.43   1818.99  540.21   2001.12   538.64   242.34  40.24  255.43  37.88  -13.09  55.27  
1 1 1 -8  -1  14 o 18 172.02  18.27  868.13    177.70   861.85   252.89   874.26    249.75   169.32  26.92  170.72  26.33  -1.40   37.65  
1 1 1 -8  -1  15 o 9  260.83  27.16  2018.84   400.76   2046.92  567.86   1990.96   565.67   258.13  39.58  254.31  40.07  3.82    56.32  
1 1 1 -8  -1  16 o 4  255.87  26.31  1943.02   380.92   2081.34  539.86   1805.89   537.54   260.89  37.09  241.43  40.20  19.46   54.69  
1 1 1 -8  -1  17 o 5  225.16  23.37  1504.84   297.64   1573.89  422.31   1436.68   419.56   226.57  33.47  215.62  35.10  10.95   48.50  
1 1 1 -8  -1  18 o 16 169.01  18.09  843.95    172.78   744.77   231.12   969.61    260.15   156.02  26.77  178.73  26.13  -22.71  37.40  
1 1 1 -8  -1  19 o 15 33.07   13.13  16.86     37.22    6.41     72.06    20.66     43.47    41.68   17.59  35.91   14.22  5.76    22.61  
1 1 1 -8  -1  20 o 11 151.79  15.98  681.51    137.12   743.48   198.92   625.39    189.29   156.33  22.84  142.75  23.95  13.59   33.09  
1 1 1 -8  -1  21 o 11 54.10   19.36  75.63     76.16    75.63    76.16    0.00      0.00     54.10   19.36  ?       ?      0.00    19.36  
1 1 1 -8  -1  22 o 5  179.17  25.18  1002.37   251.90   1002.37  251.90   0.00      0.00     179.17  25.18  ?       ?      0.00    25.18  
1 1 1 -8  -1  23 o 14 174.76  21.81  942.18    214.07   942.18   214.07   0.00      0.00     174.76  21.81  ?       ?      0.00    21.81  
1 1 1 -8  -1  24 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  -1  25 o 8  36.70   16.40  -23.93    70.74    -23.93   70.74    0.00      0.00     36.70   16.40  ?       ?      0.00    16.40  
1 1 1 -8  -1  26 o 2  43.04   17.63  25.61     69.44    25.61    69.44    0.00      0.00     43.04   17.63  ?       ?      0.00    17.63  
1 1 1 -8  0   1  o 1  281.60  44.11  2470.71   689.71   0.00     0.00     2470.71   689.71   ?       ?      281.60  44.11  0.00    44.11  
1 1 1 -8  0   2  o 5  274.47  28.48  2241.06   442.19   2251.37  625.47   2230.76   625.22   269.91  41.71  268.56  41.92  1.36    59.14  
1 1 1 -8  0   3  o 8  365.80  59.57  4334.12   1208.01  0.00     0.00     4334.12   1208.01  ?       ?      365.80  59.57  0.00    59.57  
1 1 1 -8  0   4  o 15 416.10  44.29  5300.03   1041.73  5443.54  1473.37  5156.56   1473.09  407.90  65.11  395.18  67.35  12.72   93.67  
1 1 1 -8  0   5  f 0  543.53  60.05  9366.22   1842.52  9502.76  2605.81  9229.70   2605.62  518.26  90.90  508.82  92.61  9.44    129.77 
1 1 1 -8  0   6  o 17 275.33  28.25  2239.55   440.21   2327.29  622.71   2151.91   622.38   276.80  40.38  265.28  42.29  11.52   58.47  
1 1 1 -8  0   7  o 5  527.63  58.07  8676.68   1729.83  7799.64  2446.17  9553.97   2446.53  472.03  93.58  533.94  82.47  -61.92  124.73 
1 1 1 -8  0   8  o 5  608.46  67.55  11765.75  2319.85  11673.95 3280.88  11857.54  3280.65  571.20  103.88 576.89  102.83 -5.69   146.17 
1 1 1 -8  0   9  o 9  381.14  39.95  4355.70   861.06   4271.32  1217.84  4440.05   1217.60  368.18  59.66  376.27  58.25  -8.09   83.38  
1 1 1 -8  0   10 o 14 317.36  32.90  2992.04   590.64   2990.28  835.63   2993.80   834.94   311.45  48.30  311.67  48.22  -0.22   68.25  
1 1 1 -8  0   11 o 12 224.86  23.32  1487.27   296.60   1445.11  419.90   1529.25   419.01   218.51  34.63  225.29  33.41  -6.78   48.12  
1 1 1 -8  0   12 o 3  268.32  27.59  2136.30   418.97   2271.39  593.38   2001.99   591.66   272.52  39.04  254.36  41.98  18.16   57.33  
1 1 1 -8  0   13 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  0   14 o 12 205.53  31.64  1281.36   361.30   0.00     0.00     1281.36   361.30   ?       ?      205.53  31.64  0.00    31.64  
1 1 1 -8  0   15 o 1  460.67  82.93  7581.09   2112.56  0.00     0.00     7581.09   2112.56  ?       ?      460.67  82.93  0.00    82.93  
1 1 1 -8  0   16 o 5  299.00  47.50  2818.58   788.04   0.00     0.00     2818.58   788.04   ?       ?      299.00  47.50  0.00    47.50  
1 1 1 -8  0   17 o 14 117.39  19.42  412.02    126.32   0.00     0.00     412.02    126.32   ?       ?      117.39  19.42  0.00    19.42  
1 1 1 -8  0   18 o 5  425.56  53.69  6074.07   1282.45  5630.76  1835.38  6497.00   1792.69  366.28  88.32  408.17  79.37  -41.90  118.74 
1 1 1 -8  0   19 o 16 147.99  23.14  665.15    190.14   0.00     0.00     665.15    190.14   ?       ?      147.99  23.14  0.00    23.14  
1 1 1 -8  0   20 o 10 127.58  20.32  493.01    143.83   0.00     0.00     493.01    143.83   ?       ?      127.58  20.32  0.00    20.32  
1 1 1 -8  0   21 o 12 156.85  40.92  846.93    372.23   846.93   372.23   0.00      0.00     156.85  40.92  ?       ?      0.00    40.92  
1 1 1 -8  0   22 o 15 155.27  39.85  846.27    357.00   846.27   357.00   0.00      0.00     155.27  39.85  ?       ?      0.00    39.85  
1 1 1 -8  0   23 o 5  228.77  47.97  1988.28   609.80   1988.28  609.80   0.00      0.00     228.77  47.97  ?       ?      0.00    47.97  
1 1 1 -8  0   24 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  0   25 o 17 69.28   27.25  116.21    158.80   116.21   158.80   0.00      0.00     69.28   27.25  ?       ?      0.00    27.25  
1 1 1 -8  0   26 o 12 138.67  29.34  666.99    226.25   666.99   226.25   0.00      0.00     138.67  29.34  ?       ?      0.00    29.34  
1 1 1 -8  1   1  o 17 138.40  14.29  559.38    111.92   576.51   158.45   542.31    158.12   139.34  20.41  134.90  21.11  4.43    29.37  
1 1 1 -8  1   2  o 6  493.18  92.00  9005.83   2508.77  0.00     0.00     9005.83   2508.77  ?       ?      493.18  92.00  0.00    92.00  
1 1 1 -8  1   3  o 19 294.21  30.64  2582.46   509.87   2543.31  721.14   2621.59   720.99   285.70  45.49  290.55  44.65  -4.85   63.75  
1 1 1 -8  1   4  o 8  505.09  55.65  8058.99   1586.86  8120.91  2244.23  7997.08   2244.08  480.62  84.42  476.03  85.25  4.59    119.98 
1 1 1 -8  1   5  o 6  356.69  37.36  3826.14   753.67   3862.68  1065.97  3789.62   1065.74  349.66  54.91  345.92  55.55  3.74    78.11  
1 1 1 -8  1   6  o 5  509.41  55.45  8088.36   1595.49  7962.66  2256.44  8214.04   2256.29  481.77  84.68  490.98  83.01  -9.20   118.58 
1 1 1 -8  1   7  o 15 449.38  74.41  6647.75   1852.57  6647.75  1852.57  0.00      0.00     449.38  74.41  ?       ?      0.00    74.41  
1 1 1 -8  1   8  o 18 506.36  54.37  7912.37   1555.61  8045.31  2200.09  7779.46   2199.85  491.24  80.82  481.52  82.55  9.73    115.53 
1 1 1 -8  1   9  o 11 263.54  27.29  2047.11   406.89   1966.81  575.40   2127.43   575.46   254.26  40.80  265.28  38.95  -11.01  56.41  
1 1 1 -8  1   10 o 15 282.20  43.35  2433.85   679.92   0.00     0.00     2433.85   679.92   ?       ?      282.20  43.35  0.00    43.35  
1 1 1 -8  1   11 o 10 415.21  68.60  5662.37   1578.12  0.00     0.00     5662.37   1578.12  ?       ?      415.21  68.60  0.00    68.60  
1 1 1 -8  1   12 o 10 490.86  90.47  8814.14   2455.33  0.00     0.00     8814.14   2455.33  ?       ?      490.86  90.47  0.00    90.47  
1 1 1 -8  1   13 f 0  118.47  19.38  418.54    127.28   0.00     0.00     418.54    127.28   ?       ?      118.47  19.38  0.00    19.38  
1 1 1 -8  1   14 o 15 199.71  20.79  1175.21   234.89   1192.94  332.65   1157.58   331.72   198.51  30.14  195.35  30.58  3.17    42.94  
1 1 1 -8  1   15 o 12 329.06  53.14  3474.81   969.66   0.00     0.00     3474.81   969.66   ?       ?      329.06  53.14  0.00    53.14  
1 1 1 -8  1   16 o 11 270.11  27.99  2174.01   427.78   2258.32  606.47   2090.52   603.48   270.28  40.32  259.10  42.01  11.19   58.23  
1 1 1 -8  1   17 o 6  132.58  14.33  514.68    107.31   636.16   158.21   411.16    146.05   146.52  19.28  116.53  22.65  29.99   29.74  
1 1 1 -8  1   18 o 3  146.60  15.59  631.91    129.20   679.48   186.30   587.83    179.33   150.32  22.26  139.32  23.24  10.99   32.18  
1 1 1 -8  1   19 o 10 155.50  16.96  715.78    148.93   609.14   199.59   849.75    223.71   140.57  25.68  167.26  23.98  -26.69  35.14  
1 1 1 -8  1   20 o 11 248.11  22.42  1851.34   315.88   1852.70  397.72   1849.04   519.86   244.63  28.88  237.26  39.56  7.38    48.98  
1 1 1 -8  1   21 f 0  73.11   18.81  164.55    79.41    164.55   79.41    0.00      0.00     73.11   18.81  ?       ?      0.00    18.81  
1 1 1 -8  1   22 o 17 77.08   18.14  183.83    78.94    183.83   78.94    0.00      0.00     77.08   18.14  ?       ?      0.00    18.14  
1 1 1 -8  1   23 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  1   24 o 7  101.33  20.45  323.60    114.85   323.60   114.85   0.00      0.00     101.33  20.45  ?       ?      0.00    20.45  
1 1 1 -8  1   25 o 7  108.43  16.13  360.10    97.33    360.10   97.33    0.00      0.00     108.43  16.13  ?       ?      0.00    16.13  
1 1 1 -8  1   26 o 11 229.55  55.32  2565.81   720.34   2565.81  720.34   0.00      0.00     229.55  55.32  ?       ?      0.00    55.32  
1 1 1 -8  2   1  o 13 284.97  29.59  2420.61   476.98   2497.89  674.76   2343.42   674.34   284.12  42.69  274.27  44.34  9.84    61.55  
1 1 1 -8  2   2  o 18 529.84  103.33 10877.62  3030.01  0.00     0.00     10877.62  3030.01  ?       ?      529.84  103.33 0.00    103.33 
1 1 1 -8  2   3  f 0  393.89  41.96  4735.98   934.19   4679.27  1321.21  4792.68   1321.08  378.12  63.09  383.43  62.14  -5.31   88.55  
1 1 1 -8  2   4  o 8  335.56  35.16  3378.98   667.20   3322.61  943.64   3435.33   943.48   324.49  52.45  330.63  51.38  -6.14   73.42  
1 1 1 -8  2   5  o 1  555.01  61.77  9821.19   1934.89  9795.89  2736.43  9846.49   2736.27  521.69  94.87  523.41  94.54  -1.73   133.93 
1 1 1 -8  2   6  o 14 139.45  21.07  576.55    163.41   576.55   163.41   0.00      0.00     139.45  21.07  ?       ?      0.00    21.07  
1 1 1 -8  2   7  o 3  393.24  41.40  4661.15   920.49   4550.61  1301.86  4771.66   1301.67  377.73  62.20  388.03  60.40  -10.29  86.70  
1 1 1 -8  2   8  f 0  331.80  34.44  3276.35   646.48   3271.34  914.34   3281.36   914.19   325.13  50.64  325.68  50.53  -0.55   71.54  
1 1 1 -8  2   9  o 17 324.28  50.44  3255.94   908.50   0.00     0.00     3255.94   908.50   ?       ?      324.28  50.44  0.00    50.44  
1 1 1 -8  2   10 o 2  394.53  63.64  4995.19   1392.23  0.00     0.00     4995.19   1392.23  ?       ?      394.53  63.64  0.00    63.64  
1 1 1 -8  2   11 o 18 333.37  52.82  3503.04   977.14   0.00     0.00     3503.04   977.14   ?       ?      333.37  52.82  0.00    52.82  
1 1 1 -8  2   12 o 10 493.40  54.84  7751.86   1527.00  7758.15  2159.59  7745.57   2159.43  465.16  83.96  464.69  84.04  0.47    118.80 
1 1 1 -8  2   13 o 13 101.46  12.06  301.22    68.89    255.55   98.61    344.75    96.28    92.04   19.28  107.93  16.02  -15.89  25.07  
1 1 1 -8  2   14 o 10 362.03  38.90  4019.84   795.82   3952.90  1125.48  4086.78   1125.43  345.59  58.84  352.42  57.62  -6.84   82.35  
1 1 1 -8  2   15 o 1  285.39  29.70  2436.37   479.54   2488.48  678.14   2384.26   678.20   282.40  43.20  275.74  44.35  6.66    61.91  
1 1 1 -8  2   16 o 7  133.50  21.91  533.58    162.06   533.58   162.06   0.00      0.00     133.50  21.91  ?       ?      0.00    21.91  
1 1 1 -8  2   17 o 9  257.32  40.83  2078.78   583.07   2078.78  583.07   0.00      0.00     257.32  40.83  ?       ?      0.00    40.83  
1 1 1 -8  2   18 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  2   19 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  2   20 o 16 42.67   16.79  31.68     60.36    31.68    60.36    0.00      0.00     42.67   16.79  ?       ?      0.00    16.79  
1 1 1 -8  2   21 o 16 78.38   19.25  189.88    85.99    189.88   85.99    0.00      0.00     78.38   19.25  ?       ?      0.00    19.25  
1 1 1 -8  2   22 o 17 79.96   18.02  197.85    80.75    197.85   80.75    0.00      0.00     79.96   18.02  ?       ?      0.00    18.02  
1 1 1 -8  2   23 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  2   24 o 6  44.40   17.53  36.92     65.90    36.92    65.90    0.00      0.00     44.40   17.53  ?       ?      0.00    17.53  
1 1 1 -8  2   25 o 8  161.40  28.58  879.70    255.07   879.70   255.07   0.00      0.00     161.40  28.58  ?       ?      0.00    28.58  
1 1 1 -8  2   26 o 14 57.23   19.12  99.14     73.78    99.14    73.78    0.00      0.00     57.23   19.12  ?       ?      0.00    19.12  
1 1 1 -8  3   1  o 1  412.30  44.03  5211.50   1026.00  5342.97  1451.10  5080.07   1450.87  403.43  64.85  391.65  66.93  11.77   93.20  
1 1 1 -8  3   2  o 8  151.25  15.64  668.25    133.84   640.78   189.65   695.50    188.91   146.52  23.33  153.05  22.14  -6.53   32.16  
1 1 1 -8  3   3  o 6  223.13  22.91  1464.68   289.28   1516.54  409.37   1412.94   408.84   224.35  32.75  215.99  34.10  8.37    47.28  
1 1 1 -8  3   4  o 7  432.77  46.27  5737.06   1131.73  5586.97  1600.57  5887.14   1600.44  411.07  70.35  423.89  68.07  -12.81  97.90  
1 1 1 -8  3   5  f 0  98.53   10.67  282.71    59.39    260.07   85.13    304.18    82.90    93.52   16.46  101.65  14.63  -8.13   22.02  
1 1 1 -8  3   6  o 17 336.11  35.00  3371.33   665.42   3348.30  941.18   3394.34   940.90   327.87  51.72  330.37  51.27  -2.50   72.83  
1 1 1 -8  3   7  o 10 258.18  26.53  1964.07   387.58   2032.66  548.41   1895.63   547.84   259.33  37.96  249.76  39.52  9.58    54.80  
1 1 1 -8  3   8  o 4  54.96   14.56  90.24     46.66    0.00     0.00     90.24     46.66    ?       ?      54.96   14.56  0.00    14.56  
1 1 1 -8  3   9  o 18 154.98  23.60  713.89    203.39   0.00     0.00     713.89    203.39   ?       ?      154.98  23.60  0.00    23.60  
1 1 1 -8  3   10 o 6  398.31  64.89  5140.27   1432.66  0.00     0.00     5140.27   1432.66  ?       ?      398.31  64.89  0.00    64.89  
1 1 1 -8  3   11 o 8  105.04  11.89  322.06    70.42    350.11   99.27    293.65    99.92    108.81  16.40  99.12   18.23  9.69    24.52  
1 1 1 -8  3   12 o 5  332.79  35.13  3350.90   661.10   3348.06  935.14   3353.73   934.73   323.21  52.18  323.54  52.10  -0.33   73.73  
1 1 1 -8  3   13 o 5  186.50  19.42  1023.79   204.91   1025.62  289.82   1021.96   289.75   184.18  28.32  183.83  28.37  0.35    40.08  
1 1 1 -8  3   14 o 10 199.85  30.89  1214.32   342.96   1214.32  342.96   0.00      0.00     199.85  30.89  ?       ?      0.00    30.89  
1 1 1 -8  3   15 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  3   16 o 11 374.71  63.85  4748.93   1324.35  4748.93  1324.35  0.00      0.00     374.71  63.85  ?       ?      0.00    63.85  
1 1 1 -8  3   17 f 0  209.73  21.96  1304.86   260.48   1288.92  369.00   1320.70   367.76   204.64  32.49  207.44  31.90  -2.80   45.54  
1 1 1 -8  3   18 o 11 77.37   10.78  176.30    46.58    181.81   68.48    171.56    63.55    77.61   15.90  75.47   15.20  2.15    22.00  
1 1 1 -8  3   19 o 7  243.53  26.08  1808.51   358.96   1797.05  508.14   1819.93   507.15   234.66  39.10  236.46  38.70  -1.79   55.01  
1 1 1 -8  3   20 o 19 144.02  16.96  618.38    137.56   965.61   295.30   522.16    155.45   174.28  30.63  130.71  21.46  43.57   37.40  
1 1 1 -8  3   21 o 7  145.62  23.54  658.09    190.10   658.09   190.10   0.00      0.00     145.62  23.54  ?       ?      0.00    23.54  
1 1 1 -8  3   22 o 4  123.85  15.77  461.13    109.59   461.13   109.59   0.00      0.00     123.85  15.77  ?       ?      0.00    15.77  
1 1 1 -8  3   23 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  3   24 o 4  109.51  19.38  375.77    117.41   375.77   117.41   0.00      0.00     109.51  19.38  ?       ?      0.00    19.38  
1 1 1 -8  3   25 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  3   26 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  4   1  o 5  134.69  14.18  529.21    108.01   565.48   152.85   493.04    152.66   138.28  19.82  128.62  21.43  9.66    29.19  
1 1 1 -8  4   2  o 9  327.34  34.09  3199.73   631.21   3210.24  892.83   3189.23   892.49   321.01  50.08  319.85  50.26  1.16    70.96  
1 1 1 -8  4   3  o 15 210.20  21.59  1296.27   256.86   1318.07  363.78   1274.60   362.74   209.61  31.18  205.91  31.70  3.70    44.47  
1 1 1 -8  4   4  o 1  480.80  51.73  7137.88   1405.24  7324.59  1987.47  6951.22   1987.16  468.82  76.48  454.43  79.04  14.39   109.99 
1 1 1 -8  4   5  o 2  238.82  24.70  1678.00   333.80   1472.17  471.71   1884.43   472.41   219.59  38.84  250.77  33.66  -31.19  51.40  
1 1 1 -8  4   6  o 9  552.70  60.84  9614.77   1898.56  9081.61  2684.94  10147.95  2684.99  506.26  95.89  542.39  89.34  -36.13  131.06 
1 1 1 -8  4   7  o 15 424.80  69.37  5861.42   1633.43  0.00     0.00     5861.42   1633.43  ?       ?      424.80  69.37  0.00    69.37  
1 1 1 -8  4   8  x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  4   9  o 14 225.28  34.26  1531.55   429.08   0.00     0.00     1531.55   429.08   ?       ?      225.28  34.26  0.00    34.26  
1 1 1 -8  4   10 o 12 182.86  27.81  1002.22   282.74   0.00     0.00     1002.22   282.74   ?       ?      182.86  27.81  0.00    27.81  
1 1 1 -8  4   11 o 8  246.28  25.56  1797.80   356.09   1759.05  503.54   1836.56   503.65   239.21  37.93  244.91  36.97  -5.70   52.97  
1 1 1 -8  4   12 o 7  283.32  29.92  2408.33   479.29   2147.40  677.65   2669.52   678.00   259.29  47.27  292.94  41.48  -33.65  62.88  
1 1 1 -8  4   13 o 3  296.18  47.67  2805.14   783.04   2805.14  783.04   0.00      0.00     296.18  47.67  ?       ?      0.00    47.67  
1 1 1 -8  4   14 o 19 127.38  20.14  484.29    142.41   484.29   142.41   0.00      0.00     127.38  20.14  ?       ?      0.00    20.14  
1 1 1 -8  4   15 o 18 121.50  19.59  440.52    132.01   440.52   132.01   0.00      0.00     121.50  19.59  ?       ?      0.00    19.59  
1 1 1 -8  4   16 o 4  216.42  22.78  1388.31   278.81   1303.68  394.03   1473.16   394.55   205.51  34.63  219.70  32.24  -14.18  47.31  
1 1 1 -8  4   17 o 15 151.94  16.60  680.03    142.40   588.07   200.40   773.81    202.37   138.55  26.15  160.57  22.58  -22.02  34.55  
1 1 1 -8  4   18 o 5  89.06   11.04  232.98    55.22    190.67   78.52    274.37    77.67    79.15   17.72  96.04   14.54  -16.89  22.93  
1 1 1 -8  4   19 o 5  344.25  70.99  4868.53   1356.31  0.00     0.00     4868.53   1356.31  ?       ?      344.25  70.99  0.00    70.99  
1 1 1 -8  4   20 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  4   21 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  4   22 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  4   23 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  4   24 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  4   25 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  4   26 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  5   1  o 17 482.66  82.02  7863.97   2191.48  7863.97  2191.48  0.00      0.00     482.66  82.02  ?       ?      0.00    82.02  
1 1 1 -8  5   2  o 3  94.91   10.85  262.62    58.06    254.30   81.91    271.01    82.31    92.55   16.00  95.70   15.51  -3.15   22.28  
1 1 1 -8  5   3  o 10 181.98  18.69  968.22    192.50   1017.06  272.56   919.61    271.91   184.95  26.42  175.34  27.95  9.62    38.46  
1 1 1 -8  5   4  o 4  103.39  11.21  311.27    65.46    326.18   92.63    296.40    92.52    105.14  15.84  99.97   16.71  5.17    23.02  
1 1 1 -8  5   5  o 13 304.84  31.57  2756.45   544.43   2770.50  769.78   2742.39   770.09   300.35  46.12  298.67  46.42  1.68    65.44  
1 1 1 -8  5   6  f 0  734.56  88.02  18469.62  3637.89  18322.89 5144.75  18616.35  5144.77  655.33  140.94 663.04  139.59 -7.71   198.37 
1 1 1 -8  5   7  o 18 553.02  101.38 11128.08  3100.08  11128.08 3100.08  0.00      0.00     553.02  101.38 ?       ?      0.00    101.38 
1 1 1 -8  5   8  o 12 51.02   15.43  75.63     49.03    75.63    49.03    0.00      0.00     51.02   15.43  ?       ?      0.00    15.43  
1 1 1 -8  5   9  o 3  393.59  65.02  5086.38   1417.87  0.00     0.00     5086.38   1417.87  ?       ?      393.59  65.02  0.00    65.02  
1 1 1 -8  5   10 o 9  405.38  69.19  5570.53   1552.46  0.00     0.00     5570.53   1552.46  ?       ?      405.38  69.19  0.00    69.19  
1 1 1 -8  5   11 o 9  186.81  28.62  1055.00   297.17   1055.00  297.17   0.00      0.00     186.81  28.62  ?       ?      0.00    28.62  
1 1 1 -8  5   12 o 7  366.99  39.58  4159.62   820.62   4062.12  1160.38  4257.17   1160.68  347.40  60.38  357.24  58.63  -9.84   84.16  
1 1 1 -8  5   13 o 11 214.42  33.14  1408.03   394.82   1408.03  394.82   0.00      0.00     214.42  33.14  ?       ?      0.00    33.14  
1 1 1 -8  5   14 o 19 102.02  16.90  309.91    95.52    309.91   95.52    0.00      0.00     102.02  16.90  ?       ?      0.00    16.90  
1 1 1 -8  5   15 o 2  196.01  20.45  1133.51   226.75   1124.44  319.06   1142.76   322.32   192.36  29.86  193.94  29.91  -1.57   42.27  
1 1 1 -8  5   16 o 4  298.81  31.67  2712.84   535.05   2738.58  756.43   2687.07   756.93   291.24  46.83  288.05  47.42  3.19    66.65  
1 1 1 -8  5   17 o 13 324.99  35.69  3301.30   654.95   3074.12  925.94   3528.79   926.54   296.52  56.46  322.59  51.78  -26.06  76.61  
1 1 1 -8  5   18 o 18 300.69  32.62  2835.18   554.12   3010.67  783.46   2659.53   783.83   296.79  47.59  274.92  51.56  21.87   70.17  
1 1 1 -8  5   19 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  5   20 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  5   21 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  5   22 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  5   23 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  5   24 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  5   25 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  5   26 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  6   1  o 19 376.80  59.82  4484.47   1250.78  4484.47  1250.78  0.00      0.00     376.80  59.82  ?       ?      0.00    59.82  
1 1 1 -8  6   2  o 3  354.28  55.77  3931.52   1096.81  3931.52  1096.81  0.00      0.00     354.28  55.77  ?       ?      0.00    55.77  
1 1 1 -8  6   3  o 17 193.22  19.97  1092.81   218.34   1034.48  308.09   1151.68   309.48   185.71  29.91  196.60  28.23  -10.88  41.13  
1 1 1 -8  6   4  f 0  232.85  24.01  1593.64   316.36   1495.33  446.90   1692.39   447.90   222.17  36.29  237.42  33.82  -15.25  49.61  
1 1 1 -8  6   5  o 15 536.04  58.77  9028.55   1778.91  8862.69  2515.68  9194.44   2515.83  503.51  90.35  515.08  88.26  -11.58  126.31 
1 1 1 -8  6   6  f 0  562.41  62.63  10090.90  1987.92  9943.27  2811.28  10238.54  2811.41  524.34  96.97  534.23  95.16  -9.89   135.86 
1 1 1 -8  6   7  o 11 201.23  20.81  1188.54   236.89   1198.93  334.64   1178.10   335.38   199.77  30.12  197.89  30.50  1.89    42.86  
1 1 1 -8  6   8  o 8  232.66  24.07  1598.35   316.84   1550.63  447.72   1646.22   448.43   225.42  35.79  232.83  34.60  -7.41   49.78  
1 1 1 -8  6   9  o 11 275.20  28.65  2259.86   445.97   2101.97  630.30   2418.17   631.11   258.88  43.98  279.76  40.47  -20.89  59.77  
1 1 1 -8  6   10 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  6   11 o 5  248.60  39.13  1926.61   540.04   0.00     0.00     1926.61   540.04   ?       ?      248.60  39.13  0.00    39.13  
1 1 1 -8  6   12 o 8  89.45   11.58  234.77    58.09    218.24   80.25    252.96    84.18    85.21   17.00  91.98   16.55  -6.77   23.73  
1 1 1 -8  6   13 o 6  227.63  23.62  1536.66   304.19   1455.21  430.20   1618.10   430.18   217.09  35.76  230.08  33.56  -12.98  49.04  
1 1 1 -8  6   14 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  6   15 o 3  142.26  22.20  607.41    175.38   607.41   175.38   0.00      0.00     142.26  22.20  ?       ?      0.00    22.20  
1 1 1 -8  6   16 o 13 199.60  31.32  1232.86   347.11   0.00     0.00     1232.86   347.11   ?       ?      199.60  31.32  0.00    31.32  
1 1 1 -8  6   17 o 3  371.69  42.71  4536.39   894.85   4603.74  1265.28  4468.99   1265.74  346.77  65.97  339.81  67.27  6.96    94.22  
1 1 1 -8  6   18 o 6  163.96  17.38  800.53    161.08   920.76   228.02   680.76    227.58   173.55  23.49  146.93  28.00  26.62   36.55  
1 1 1 -8  6   19 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  6   20 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  6   21 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  6   22 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  6   23 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  6   24 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  6   25 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  6   26 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  7   1  o 16 208.17  21.47  1270.94   252.93   1195.42  357.87   1346.29   357.51   199.14  32.42  212.21  30.20  -13.08  44.30  
1 1 1 -8  7   2  o 6  137.07  21.30  557.91    162.16   557.91   162.16   0.00      0.00     137.07  21.30  ?       ?      0.00    21.30  
1 1 1 -8  7   3  o 12 154.02  23.58  705.98    201.84   705.98   201.84   0.00      0.00     154.02  23.58  ?       ?      0.00    23.58  
1 1 1 -8  7   4  o 6  308.84  32.14  2843.66   561.43   2558.77  793.66   3128.99   794.30   285.34  50.29  318.93  44.60  -33.59  67.22  
1 1 1 -8  7   5  o 16 500.29  55.13  7903.48   1557.15  7588.43  2202.04  8218.58   2202.25  461.94  86.21  485.56  81.92  -23.62  118.92 
1 1 1 -8  7   6  f 0  425.02  45.86  5591.52   1101.23  5102.24  1557.11  6081.14   1557.65  385.62  73.01  428.37  65.41  -42.75  98.03  
1 1 1 -8  7   7  o 4  280.41  29.23  2348.22   463.57   2130.51  655.32   2566.29   655.85   259.98  45.57  288.27  40.77  -28.29  61.14  
1 1 1 -8  7   8  o 3  393.30  42.50  4794.52   944.28   4586.79  1335.27  5002.33   1335.55  366.88  65.82  386.50  62.31  -19.62  90.64  
1 1 1 -8  7   9  o 2  187.10  19.59  1031.59   207.30   1084.36  292.44   978.29    293.90   189.54  27.69  179.24  29.60  10.30   40.53  
1 1 1 -8  7   10 o 1  255.88  40.50  2051.39   575.09   0.00     0.00     2051.39   575.09   ?       ?      255.88  40.50  0.00    40.50  
1 1 1 -8  7   11 o 17 391.78  69.20  5377.36   1499.42  0.00     0.00     5377.36   1499.42  ?       ?      391.78  69.20  0.00    69.20  
1 1 1 -8  7   12 o 3  313.25  51.10  3175.94   887.33   0.00     0.00     3175.94   887.33   ?       ?      313.25  51.10  0.00    51.10  
1 1 1 -8  7   13 o 13 177.40  18.67  926.49    187.30   867.55   263.88   986.32    265.89   168.95  28.20  180.97  26.37  -12.02  38.61  
1 1 1 -8  7   14 o 8  194.20  20.43  1115.37   224.32   1135.26  316.38   1095.26   318.10   192.99  29.49  189.20  30.31  3.80    42.29  
1 1 1 -8  7   15 o 12 252.81  41.01  2050.58   574.83   2050.58  574.83   0.00      0.00     252.81  41.01  ?       ?      0.00    41.01  
1 1 1 -8  7   16 o 12 240.20  25.60  1751.76   347.61   1747.97  492.71   1755.51   490.49   232.58  38.23  233.29  37.93  -0.71   53.85  
1 1 1 -8  7   17 f 0  49.98   13.59  75.26     40.01    -19.30   67.93    125.49    49.51    36.89   16.31  64.39   13.81  -27.50  21.37  
1 1 1 -8  7   18 o 10 139.03  15.36  574.40    120.53   728.15   175.61   437.47    165.72   154.96  20.22  117.74  25.27  37.22   32.37  
1 1 1 -8  7   19 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  7   20 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  7   21 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  7   22 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  7   23 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  7   24 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  7   25 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  8   1  o 3  258.50  26.89  1982.14   393.17   2016.01  556.23   1948.32   555.82   256.33  39.03  251.59  39.81  4.74    55.75  
1 1 1 -8  8   2  o 16 350.65  37.07  3724.19   734.88   3663.94  1039.30  3784.44   1039.27  337.34  55.60  343.65  54.50  -6.31   77.86  
1 1 1 -8  8   3  o 11 139.88  21.98  583.97    170.69   583.97   170.69   0.00      0.00     139.88  21.98  ?       ?      0.00    21.98  
1 1 1 -8  8   4  o 10 145.89  22.81  636.32    184.76   636.32   184.76   0.00      0.00     145.89  22.81  ?       ?      0.00    22.81  
1 1 1 -8  8   5  o 3  290.07  30.41  2523.92   498.89   2462.84  705.36   2585.07   705.73   279.38  45.55  287.05  44.25  -7.68   63.50  
1 1 1 -8  8   6  o 15 173.03  18.24  879.99    178.47   855.32   251.46   905.04    253.35   168.28  26.94  173.40  26.27  -5.12   37.63  
1 1 1 -8  8   7  o 16 205.89  21.54  1253.06   250.78   1248.75  354.30   1257.39   355.02   202.31  31.53  203.04  31.48  -0.73   44.56  
1 1 1 -8  8   8  o 19 461.73  52.06  6886.29   1355.87  6659.32  1917.34  7113.32   1917.62  421.73  82.15  440.35  78.75  -18.62  113.80 
1 1 1 -8  8   9  o 16 133.40  14.98  521.93    112.75   503.02   158.77   541.17    160.13   129.32  22.19  134.42  21.47  -5.10   30.88  
1 1 1 -8  8   10 o 10 164.02  17.49  790.49    162.11   708.90   228.99   872.48    229.54   152.76  27.11  170.75  24.09  -17.99  36.26  
1 1 1 -8  8   11 o 7  410.50  44.91  5291.28   1041.13  5102.87  1472.26  5479.75   1472.49  381.53  69.79  398.70  66.69  -17.16  96.53  
1 1 1 -8  8   12 o 12 205.19  32.14  1289.50   366.20   0.00     0.00     1289.50   366.20   ?       ?      205.19  32.14  0.00    32.14  
1 1 1 -8  8   13 o 8  251.15  40.12  1992.11   558.95   0.00     0.00     1992.11   558.95   ?       ?      251.15  40.12  0.00    40.12  
1 1 1 -8  8   14 o 12 172.08  18.77  877.86    182.38   992.67   261.98   769.90    254.04   180.65  26.01  157.56  29.16  23.09   39.08  
1 1 1 -8  8   15 f 0  157.35  17.20  734.44    152.85   698.45   220.30   767.85    212.26   150.18  26.52  158.59  24.07  -8.41   35.82  
1 1 1 -8  8   16 o 3  91.48   21.01  259.05    108.02   259.05   108.02   0.00      0.00     91.48   21.01  ?       ?      0.00    21.01  
1 1 1 -8  8   17 o 9  94.59   14.00  267.26    73.74    268.36   121.59   266.61    92.74    92.48   23.00  93.41   17.95  -0.93   29.17  
1 1 1 -8  8   18 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  8   19 o 10 58.16   15.56  103.92    52.95    0.00     0.00     103.92    52.95    ?       ?      58.16   15.56  0.00    15.56  
1 1 1 -8  8   20 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  8   21 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  8   22 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  8   23 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  8   24 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  8   25 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  9   1  o 3  372.27  62.93  4646.46   1296.89  0.00     0.00     4646.46   1296.89  ?       ?      372.27  62.93  0.00    62.93  
1 1 1 -8  9   2  o 15 180.33  28.05  982.41    280.90   0.00     0.00     982.41    280.90   ?       ?      180.33  28.05  0.00    28.05  
1 1 1 -8  9   3  o 7  309.65  32.91  2897.93   576.11   3013.72  816.12   2782.92   813.37   307.78  47.74  294.24  49.94  13.54   69.08  
1 1 1 -8  9   4  o 7  295.04  31.00  2620.23   517.18   2437.36  731.27   2803.24   731.53   275.98  47.89  298.65  43.98  -22.67  65.03  
1 1 1 -8  9   5  o 6  254.58  40.21  2020.54   568.22   2020.54  568.22   0.00      0.00     254.58  40.21  ?       ?      0.00    40.21  
1 1 1 -8  9   6  o 17 110.06  20.17  364.04    122.75   364.04   122.75   0.00      0.00     110.06  20.17  ?       ?      0.00    20.17  
1 1 1 -8  9   7  o 17 218.21  22.90  1409.78   282.60   1346.54  400.25   1472.65   399.05   209.27  34.52  219.78  32.62  -10.52  47.49  
1 1 1 -8  9   8  o 16 342.37  57.02  3867.43   1081.39  0.00     0.00     3867.43   1081.39  ?       ?      342.37  57.02  0.00    57.02  
1 1 1 -8  9   9  o 3  146.03  17.58  628.51    144.45   821.08   211.93   461.42    197.40   165.90  22.86  122.40  28.61  43.50   36.62  
1 1 1 -8  9   10 o 3  167.24  18.69  824.62    176.41   863.69   255.77   789.18    243.63   168.81  27.33  161.21  27.30  7.60    38.63  
1 1 1 -8  9   11 o 16 297.28  31.73  2684.31   533.07   2718.99  755.85   2649.99   751.93   290.26  46.96  286.18  47.43  4.08    66.75  
1 1 1 -8  9   12 o 17 211.56  22.58  1335.47   270.00   1285.26  385.56   1383.78   378.21   202.66  34.37  211.47  32.17  -8.81   47.07  
1 1 1 -8  9   13 o 8  182.56  29.16  1032.09   295.31   0.00     0.00     1032.09   295.31   ?       ?      182.56  29.16  0.00    29.16  
1 1 1 -8  9   14 o 17 108.91  19.38  360.31    116.74   0.00     0.00     360.31    116.74   ?       ?      108.91  19.38  0.00    19.38  
1 1 1 -8  9   15 o 5  91.82   14.46  252.32    73.68    233.96   123.34   262.50    91.87    86.58   23.99  92.80   17.89  -6.22   29.93  
1 1 1 -8  9   16 o 3  140.76  16.87  593.28    133.61   617.43   206.26   575.82    175.39   139.60  26.71  136.21  23.27  3.40    35.42  
1 1 1 -8  9   17 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  9   18 o 2  158.75  35.43  877.14    314.71   877.14   314.71   0.00      0.00     158.75  35.43  ?       ?      0.00    35.43  
1 1 1 -8  9   19 o 18 134.18  36.34  656.00    286.76   656.00   286.76   0.00      0.00     134.18  36.34  ?       ?      0.00    36.34  
1 1 1 -8  9   20 o 14 46.71   10.28  66.32     26.81    0.00     0.00     66.32     26.81    ?       ?      46.71   10.28  0.00    10.28  
1 1 1 -8  9   21 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  9   22 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  9   23 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  9   24 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  10  1  o 17 374.98  40.13  4303.92   850.49   4277.03  1203.37  4330.75   1202.20  360.58  60.26  363.28  59.72  -2.70   84.84  
1 1 1 -8  10  2  o 19 365.50  60.94  4414.36   1233.59  0.00     0.00     4414.36   1233.59  ?       ?      365.50  60.94  0.00    60.94  
1 1 1 -8  10  3  o 3  222.97  34.89  1521.00   431.91   0.00     0.00     1521.00   431.91   ?       ?      222.97  34.89  0.00    34.89  
1 1 1 -8  10  4  o 7  234.66  25.15  1635.11   333.50   1800.63  477.55   1477.53   465.95   242.69  35.31  218.13  38.62  24.56   52.33  
1 1 1 -8  10  5  o 12 257.21  27.28  1973.04   396.60   2053.59  564.26   1894.39   557.56   257.47  39.43  246.46  40.84  11.01   56.77  
1 1 1 -8  10  6  o 19 324.94  53.66  3434.81   966.09   3434.81  966.09   0.00      0.00     324.94  53.66  ?       ?      0.00    53.66  
1 1 1 -8  10  7  o 6  234.11  37.78  1700.74   490.45   1700.74  490.45   0.00      0.00     234.11  37.78  ?       ?      0.00    37.78  
1 1 1 -8  10  8  o 12 177.15  19.57  926.77    195.74   827.38   284.37   1016.27   269.85   163.76  31.39  183.64  26.35  -19.88  40.98  
1 1 1 -8  10  9  o 11 213.47  22.94  1356.28   276.67   1218.17  395.35   1488.82   387.30   197.08  36.28  220.49  31.49  -23.41  48.04  
1 1 1 -8  10  10 f 0  200.07  21.65  1192.44   244.71   1156.57  350.60   1226.50   341.71   192.61  32.89  199.37  30.85  -6.76   45.09  
1 1 1 -8  10  11 o 6  162.84  28.13  820.44    253.44   820.44   253.44   0.00      0.00     162.84  28.13  ?       ?      0.00    28.13  
1 1 1 -8  10  12 o 8  212.86  23.11  1368.33   277.88   1305.61  396.78   1428.70   389.28   201.36  35.63  212.40  33.00  -11.04  48.56  
1 1 1 -8  10  13 o 2  111.98  15.51  374.13    97.00    386.11   154.26   366.29    124.76   110.97  24.84  109.28  20.64  1.69    32.30  
1 1 1 -8  10  14 o 11 293.42  34.04  2779.63   562.72   2496.39  799.62   3057.52   792.05   255.06  56.14  291.89  49.00  -36.84  74.52  
1 1 1 -8  10  15 o 2  288.14  57.86  3305.36   923.81   0.00     0.00     3305.36   923.81   ?       ?      288.14  57.86  0.00    57.86  
1 1 1 -8  10  16 o 5  108.54  19.77  364.66    118.62   0.00     0.00     364.66    118.62   ?       ?      108.54  19.77  0.00    19.77  
1 1 1 -8  10  17 o 12 118.02  18.10  427.77    118.72   566.72   250.35   387.46    134.84   127.56  33.69  110.57  22.02  16.99   40.25  
1 1 1 -8  10  18 o 7  62.60   29.03  -123.84   248.69   -123.84  248.69   0.00      0.00     62.60   29.03  ?       ?      0.00    29.03  
1 1 1 -8  10  19 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  10  20 o 16 56.78   10.14  97.37     31.85    39.95    388.24   97.76     31.96    81.87   37.33  56.90   10.16  24.97   38.69  
1 1 1 -8  10  21 o 5  117.53  13.05  418.30    86.57    422.28   413.33   418.11    88.53    100.85  42.31  117.35  13.38  -16.50  44.38  
1 1 1 -8  10  22 o 4  51.26   11.43  81.22     32.77    0.00     0.00     81.22     32.77    ?       ?      51.26   11.43  0.00    11.43  
1 1 1 -8  10  23 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  11  1  o 6  217.31  34.11  1448.36   411.54   0.00     0.00     1448.36   411.54   ?       ?      217.31  34.11  0.00    34.11  
1 1 1 -8  11  2  o 10 241.30  25.77  1735.05   351.41   1761.11  502.96   1710.20   491.18   238.20  38.06  234.82  37.71  3.38    53.58  
1 1 1 -8  11  3  o 6  219.00  23.51  1424.33   290.93   1383.56  418.41   1462.49   404.80   211.36  35.76  218.42  33.34  -7.07   48.89  
1 1 1 -8  11  4  o 7  81.08   20.06  199.60    92.83    0.00     0.00     199.60    92.83    ?       ?      81.08   20.06  0.00    20.06  
1 1 1 -8  11  5  o 4  160.02  25.68  775.60    227.94   0.00     0.00     775.60    227.94   ?       ?      160.02  25.68  0.00    25.68  
1 1 1 -8  11  6  o 12 226.41  24.35  1533.18   311.52   1411.97  447.34   1647.31   434.08   211.16  38.31  230.72  33.77  -19.56  51.07  
1 1 1 -8  11  7  o 5  425.52  49.10  5966.39   1177.39  6186.87  1667.39  5747.13   1662.79  401.73  75.06  382.36  78.39  19.37   108.53 
1 1 1 -8  11  8  o 16 219.29  36.57  1528.55   444.18   1528.55  444.18   0.00      0.00     219.29  36.57  ?       ?      0.00    36.57  
1 1 1 -8  11  9  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  11  10 o 13 108.31  15.55  349.87    93.93    399.46   154.93   321.04    118.12   113.26  24.54  102.27  20.83  10.99   32.19  
1 1 1 -8  11  11 o 17 106.72  14.94  339.47    89.01    322.37   153.70   348.10    109.19   101.03  26.26  107.12  18.42  -6.09   32.08  
1 1 1 -8  11  12 o 13 87.26   14.55  228.69    70.32    119.73   146.54   261.28    80.15    70.34   26.56  93.15   15.54  -22.81  30.77  
1 1 1 -8  11  13 o 12 64.33   16.32  126.87    60.34    141.56   152.87   124.16    65.67    73.59   27.26  63.68   17.45  9.91    32.37  
1 1 1 -8  11  14 o 6  149.33  18.14  674.60    152.34   805.93   247.25   594.24    193.41   158.16  28.27  136.69  25.59  21.47   38.13  
1 1 1 -8  11  15 o 14 202.56  23.49  1282.99   268.08   1312.49  400.33   1259.01   360.96   193.64  37.37  192.65  33.87  0.99    50.44  
1 1 1 -8  11  16 o 7  100.10  17.65  309.81    97.71    169.77   257.46   333.37    105.61   83.83   34.10  103.60  18.43  -19.78  38.76  
1 1 1 -8  11  17 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  11  18 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  11  19 o 13 235.75  23.40  1812.55   312.51   0.00     0.00     1812.55   312.51   ?       ?      235.75  23.40  0.00    23.40  
1 1 1 -8  11  20 o 9  65.74   10.62  130.72    38.72    0.00     0.00     130.72    38.72    ?       ?      65.74   10.62  0.00    10.62  
1 1 1 -8  11  21 o 10 66.42   16.43  142.20    62.28    0.00     0.00     142.20    62.28    ?       ?      66.42   16.43  0.00    16.43  
1 1 1 -8  11  22 o 18 54.07   14.35  93.31     45.29    0.00     0.00     93.31     45.29    ?       ?      54.07   14.35  0.00    14.35  
1 1 1 -8  12  1  o 4  45.55   18.22  30.91     72.17    10.41    135.76   38.99     85.21    56.60   24.02  49.78   19.84  6.82    31.16  
1 1 1 -8  12  2  o 17 214.64  23.55  1382.80   285.41   1479.14  412.03   1293.94   395.73   217.15  34.18  202.24  35.37  14.91   49.19  
1 1 1 -8  12  3  o 15 117.64  17.07  412.62    111.90   462.37   180.74   381.68    142.50   122.00  26.56  111.52  23.02  10.49   35.15  
1 1 1 -8  12  4  o 4  117.75  16.29  412.36    107.17   244.41   173.22   516.53    136.41   90.40   29.26  131.41  18.60  -41.01  34.67  
1 1 1 -8  12  5  o 16 130.46  17.22  506.90    125.81   519.21   195.43   498.19    164.42   128.94  27.26  127.50  23.32  1.44    35.87  
1 1 1 -8  12  6  o 2  311.22  57.20  3514.01   984.30   0.00     0.00     3514.01   984.30   ?       ?      311.22  57.20  0.00    57.20  
1 1 1 -8  12  7  o 3  84.98   20.70  222.74    100.02   0.00     0.00     222.74    100.02   ?       ?      84.98   20.70  0.00    20.70  
1 1 1 -8  12  8  o 13 104.89  16.11  329.81    93.90    202.96   159.30   397.35    116.24   83.13   28.10  114.71  18.26  -31.58  33.51  
1 1 1 -8  12  9  o 2  108.35  16.91  353.50    101.73   353.22   173.75   353.65    125.48   105.21  28.20  107.10  21.16  -1.89   35.25  
1 1 1 -8  12  10 o 5  121.72  29.27  478.55    201.99   478.55   201.99   0.00      0.00     121.72  29.27  ?       ?      0.00    29.27  
1 1 1 -8  12  11 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  12  12 o 10 136.17  18.49  563.62    140.78   486.63   235.51   606.42    175.60   120.04  33.11  139.47  22.71  -19.43  40.15  
1 1 1 -8  12  13 o 18 171.64  29.46  966.38    279.81   0.00     0.00     966.38    279.81   ?       ?      171.64  29.46  0.00    29.46  
1 1 1 -8  12  14 o 19 93.58   17.65  271.30    91.34    160.84   217.43   294.97    100.65   80.02   31.75  97.27   18.70  -17.25  36.85  
1 1 1 -8  12  15 o 8  100.33  18.32  314.25    101.61   243.99   293.58   323.81    108.30   91.38   36.69  101.46  19.30  -10.08  41.45  
1 1 1 -8  12  16 o 8  92.13   37.84  253.34    320.85   253.34   320.85   0.00      0.00     92.13   37.84  ?       ?      0.00    37.84  
1 1 1 -8  12  17 o 4  152.12  26.86  783.51    225.99   0.00     0.00     783.51    225.99   ?       ?      152.12  26.86  0.00    26.86  
1 1 1 -8  12  18 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  12  19 o 3  102.28  19.26  339.59    108.96   0.00     0.00     339.59    108.96   ?       ?      102.28  19.26  0.00    19.26  
1 1 1 -8  12  20 o 1  124.84  22.96  533.67    158.49   0.00     0.00     533.67    158.49   ?       ?      124.84  22.96  0.00    22.96  
1 1 1 -8  12  21 o 9  91.87   12.56  260.31    64.53    0.00     0.00     260.31    64.53    ?       ?      91.87   12.56  0.00    12.56  
1 1 1 -8  13  1  o 6  55.52   19.90  78.82     80.56    174.81   148.84   39.05     95.80    78.59   27.15  51.81   20.90  26.77   34.26  
1 1 1 -8  13  2  o 3  190.60  21.53  1094.09   231.43   1082.42  335.47   1104.69   319.69   184.09  32.95  187.16  30.83  -3.07   45.13  
1 1 1 -8  13  3  o 9  81.52   19.30  204.25    88.90    371.96   153.77   120.04    108.96   108.98  25.10  66.34   23.21  42.63   34.18  
1 1 1 -8  13  4  o 1  111.02  22.35  381.01    137.51   0.00     0.00     381.01    137.51   ?       ?      111.02  22.35  0.00    22.35  
1 1 1 -8  13  5  o 14 53.55   19.41  71.99     76.89    151.18   146.76   42.04     90.27    74.74   26.86  50.99   20.39  23.75   33.72  
1 1 1 -8  13  6  o 12 150.60  18.59  681.92    157.30   704.82   237.65   664.06    209.85   148.75  28.87  145.57  26.07  3.19    38.90  
1 1 1 -8  13  7  o 12 184.44  21.41  1034.41   222.47   1165.33  333.08   928.96    298.92   190.07  31.64  169.11  31.96  20.96   44.97  
1 1 1 -8  13  8  o 19 99.13   21.34  306.53    117.85   0.00     0.00     306.53    117.85   ?       ?      99.13   21.34  0.00    21.34  
1 1 1 -8  13  9  o 5  55.72   20.21  80.10     83.36    0.00     0.00     80.10     83.36    ?       ?      55.72   20.21  0.00    20.21  
1 1 1 -8  13  10 o 2  129.22  19.68  513.64    141.41   558.65   266.78   496.05    166.77   126.89  35.33  124.96  24.12  1.93    42.78  
1 1 1 -8  13  11 o 13 159.52  20.64  786.63    184.56   881.35   301.88   730.09    233.23   160.08  33.91  149.15  28.27  10.92   44.15  
1 1 1 -8  13  12 o 12 147.29  20.22  674.02    166.45   631.71   284.02   696.16    205.43   132.10  36.33  146.74  25.30  -14.64  44.27  
1 1 1 -8  13  13 o 9  80.69   33.09  152.97    244.74   152.97   244.74   0.00      0.00     80.69   33.09  ?       ?      0.00    33.09  
1 1 1 -8  13  14 o 11 72.70   33.16  -43.47    306.39   -43.47   306.39   0.00      0.00     72.70   33.16  ?       ?      0.00    33.16  
1 1 1 -8  13  15 o 11 70.33   33.21  -174.05   351.39   -174.05  351.39   0.00      0.00     70.33   33.21  ?       ?      0.00    33.21  
1 1 1 -8  13  16 f 0  92.60   19.89  277.87    102.60   232.91   355.79   281.95    107.15   89.38   38.44  92.93   20.62  -3.55   43.62  
1 1 1 -8  13  17 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  13  18 o 14 100.76  17.99  327.31    100.26   0.00     0.00     327.31    100.26   ?       ?      100.76  17.99  0.00    17.99  
1 1 1 -8  13  19 o 18 54.70   12.40  93.77     38.04    0.00     0.00     93.77     38.04    ?       ?      54.70   12.40  0.00    12.40  
1 1 1 -8  13  20 o 15 53.95   12.94  92.22     39.55    -259.30  754.17   93.19     39.61    78.11   39.15  54.25   12.91  23.87   41.23  
1 1 1 -8  14  1  o 11 147.81  30.05  706.78    246.25   706.78   246.25   0.00      0.00     147.81  30.05  ?       ?      0.00    30.05  
1 1 1 -8  14  2  o 11 146.26  30.57  696.26    248.44   696.26   248.44   0.00      0.00     146.26  30.57  ?       ?      0.00    30.57  
1 1 1 -8  14  3  o 2  90.85   19.02  254.98    96.04    331.81   169.87   218.88    116.43   101.34  28.18  83.47   23.37  17.87   36.61  
1 1 1 -8  14  4  o 10 176.04  21.40  948.84    211.81   875.61   321.11   1005.25   281.81   160.57  35.75  177.11  28.70  -16.54  45.85  
1 1 1 -8  14  5  o 17 119.49  18.97  437.09    125.77   379.22   233.84   460.64    149.19   106.74  33.94  121.43  22.22  -14.69  40.56  
1 1 1 -8  14  6  o 9  230.53  27.28  1690.10   354.00   1654.76  521.08   1720.40   482.42   212.46  44.17  221.78  39.33  -9.32   59.14  
1 1 1 -8  14  7  o 17 97.85   22.15  303.86    121.55   0.00     0.00     303.86    121.55   ?       ?      97.85   22.15  0.00    22.15  
1 1 1 -8  14  8  o 7  168.31  22.16  883.97    208.87   795.71   342.48   936.23    263.55   147.20  39.65  169.40  28.08  -22.20  48.59  
1 1 1 -8  14  9  o 8  35.77   16.43  -50.17    77.11    -28.23   210.04   -53.59    82.90    63.51   28.34  37.06   17.03  26.45   33.06  
1 1 1 -8  14  10 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  14  11 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  14  12 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  14  13 o 19 124.45  44.13  681.59    394.98   681.59   394.98   0.00      0.00     124.45  44.13  ?       ?      0.00    44.13  
1 1 1 -8  14  14 o 1  86.35   38.60  148.50    391.59   148.50   391.59   0.00      0.00     86.35   38.60  ?       ?      0.00    38.60  
1 1 1 -8  14  15 o 16 102.62  42.51  464.30    409.46   464.30   409.46   0.00      0.00     102.62  42.51  ?       ?      0.00    42.51  
1 1 1 -8  14  16 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  14  17 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  14  18 o 8  37.09   13.63  35.82     38.10    0.00     0.00     35.82     38.10    ?       ?      37.09   13.63  0.00    13.63  
1 1 1 -8  15  1  o 16 85.04   31.63  207.66    206.14   207.66   206.14   0.00      0.00     85.04   31.63  ?       ?      0.00    31.63  
1 1 1 -8  15  2  o 1  59.08   20.82  96.52     87.81    45.44    226.59   105.54    95.25    71.70   30.75  61.53   21.69  10.17   37.63  
1 1 1 -8  15  3  o 2  185.02  40.53  1241.80   418.52   1241.80  418.52   0.00      0.00     185.02  40.53  ?       ?      0.00    40.53  
1 1 1 -8  15  4  o 2  226.28  48.94  2025.11   617.26   2025.11  617.26   0.00      0.00     226.28  48.94  ?       ?      0.00    48.94  
1 1 1 -8  15  5  o 4  176.55  41.93  1170.36   418.63   1170.36  418.63   0.00      0.00     176.55  41.93  ?       ?      0.00    41.93  
1 1 1 -8  15  6  o 18 57.98   21.11  89.90     91.06    204.06   267.14   74.90     96.86    87.41   35.03  56.31   21.51  31.10   41.11  
1 1 1 -8  15  7  o 11 109.06  20.81  376.79    125.53   434.50   260.45   359.33    143.27   109.79  35.90  104.83  24.28  4.96    43.34  
1 1 1 -8  15  8  o 19 147.03  22.03  686.68    180.21   335.86   310.71   864.51    221.22   99.40   38.39  163.66  24.28  -64.26  45.42  
1 1 1 -8  15  9  o 15 106.84  37.15  425.82    278.90   425.82   278.90   0.00      0.00     106.84  37.15  ?       ?      0.00    37.15  
1 1 1 -8  15  10 o 19 54.09   20.40  74.04     86.37    49.70    269.14   76.83     91.20    73.82   32.55  55.23   20.93  18.59   38.70  
1 1 1 -8  15  11 o 13 45.08   19.05  17.55     84.73    129.05   346.49   10.45     87.39    83.57   36.89  44.74   19.14  38.82   41.56  
1 1 1 -8  15  12 o 8  145.51  24.43  709.28    196.84   697.72   444.82   712.09    219.51   119.38  45.98  142.92  27.75  -23.55  53.71  
1 1 1 -8  15  13 o 10 127.66  26.14  567.92    185.10   0.00     0.00     567.92    185.10   ?       ?      127.66  26.14  0.00    26.14  
1 1 1 -8  15  14 o 17 152.03  30.86  869.53    260.14   0.00     0.00     869.53    260.14   ?       ?      152.03  30.86  0.00    30.86  
1 1 1 -8  15  15 o 18 51.37   20.33  63.35     88.86    -746.70  688.42   77.08     89.61    72.59   36.52  53.61   20.64  18.97   41.95  
1 1 1 -8  15  16 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -8  16  1  o 6  84.08   23.81  229.50    120.15   0.00     0.00     229.50    120.15   ?       ?      84.08   23.81  0.00    23.81  
1 1 1 -8  16  2  o 8  58.93   22.69  82.37     108.35   0.00     0.00     82.37     108.35   ?       ?      58.93   22.69  0.00    22.69  
1 1 1 -8  16  3  o 11 189.59  25.47  1165.63   270.19   1143.48  436.16   1179.43   344.19   168.39  44.47  183.00  34.01  -14.61  55.99  
1 1 1 -8  16  4  o 1  82.16   22.75  219.69    110.99   223.95   299.42   219.01    119.50   89.61   36.65  81.85   23.93  7.76    43.77  
1 1 1 -8  16  5  o 7  139.41  22.32  623.08    172.61   543.20   322.01   655.29    204.47   117.58  39.95  140.29  26.36  -22.72  47.86  
1 1 1 -8  16  6  o 6  189.40  47.94  1562.39   521.68   1562.39  521.68   0.00      0.00     189.40  47.94  ?       ?      0.00    47.94  
1 1 1 -8  16  7  o 3  103.78  38.67  415.03    308.40   415.03   308.40   0.00      0.00     103.78  38.67  ?       ?      0.00    38.67  
1 1 1 -8  16  8  o 3  190.04  27.77  1235.96   294.02   1032.71  471.17   1365.59   376.28   145.77  48.31  190.43  35.73  -44.66  60.09  
1 1 1 -8  16  9  o 10 92.55   22.78  287.60    120.20   437.20   354.73   268.20    127.76   102.55  40.60  88.58   24.37  13.97   47.35  
1 1 1 -8  16  10 o 17 132.62  24.49  597.96    179.58   513.67   438.45   614.95    196.85   104.86  43.76  132.54  26.80  -27.68  51.31  
1 1 1 -8  16  11 o 10 41.32   18.78  -36.44    97.13    -248.62  434.45   -25.28    99.66    71.04   34.42  42.94   19.31  28.10   39.47  
1 1 1 -8  16  12 o 14 161.78  34.24  1041.08   308.03   0.00     0.00     1041.08   308.03   ?       ?      161.78  34.24  0.00    34.24  
1 1 1 -8  16  13 o 2  132.46  26.93  636.29    197.77   773.92   703.18   624.46    206.09   103.70  48.33  129.50  28.50  -25.80  56.10  
1 1 1 -8  17  1  o 18 111.66  23.91  413.05    148.66   385.32   342.29   419.50    165.04   101.71  40.00  111.08  26.29  -9.37   47.87  
1 1 1 -8  17  2  o 16 56.41   22.67  65.10     112.29   406.83   316.40   15.86     120.11   102.88  38.99  51.89   22.32  50.99   44.92  
1 1 1 -8  17  3  o 3  99.64   22.84  329.16    127.84   176.97   304.48   361.73    140.86   84.10   35.85  103.85  24.10  -19.75  43.19  
1 1 1 -8  17  4  o 16 71.73   23.81  166.75    114.39   0.00     0.00     166.75    114.39   ?       ?      71.73   23.81  0.00    23.81  
1 1 1 -8  17  5  o 19 52.34   21.79  40.71     108.42   0.00     0.00     40.71     108.42   ?       ?      52.34   21.79  0.00    21.79  
1 1 1 -8  17  6  o 1  74.27   24.31  183.90    119.38   229.04   348.01   177.88    127.09   87.68   37.86  73.42   25.10  14.26   45.42  
1 1 1 -8  17  7  o 6  165.82  34.59  1058.96   318.58   0.00     0.00     1058.96   318.58   ?       ?      165.82  34.59  0.00    34.59  
1 1 1 -7  -17 1  o 14 68.21   25.10  123.52    129.28   123.52   129.28   0.00      0.00     68.21   25.10  ?       ?      0.00    25.10  
1 1 1 -7  -17 2  o 8  72.03   24.59  153.07    121.98   153.07   121.98   0.00      0.00     72.03   24.59  ?       ?      0.00    24.59  
1 1 1 -7  -17 3  o 14 53.71   17.92  82.53     64.78    40.81    115.23   101.80    78.33    55.14   22.67  59.22   19.70  -4.09   30.03  
1 1 1 -7  -17 4  o 14 130.03  16.47  509.23    120.21   522.54   182.81   499.09    159.57   127.73  25.82  126.11  22.88  1.62    34.50  
1 1 1 -7  -16 1  o 10 191.87  20.32  1111.82   220.41   1120.36  307.02   1102.74   316.62   187.76  29.45  185.43  30.83  2.33    42.63  
1 1 1 -7  -16 2  o 6  98.93   16.19  295.29    88.76    226.57   139.98   341.50    114.78   85.36   26.12  105.49  19.68  -20.12  32.71  
1 1 1 -7  -16 3  o 17 249.00  44.37  2169.15   610.94   0.00     0.00     2169.15   610.94   ?       ?      249.00  44.37  0.00    44.37  
1 1 1 -7  -16 4  o 10 144.44  26.13  657.16    208.70   657.16   208.70   0.00      0.00     144.44  26.13  ?       ?      0.00    26.13  
1 1 1 -7  -16 5  o 10 96.24   25.17  294.21    140.60   294.21   140.60   0.00      0.00     96.24   25.17  ?       ?      0.00    25.17  
1 1 1 -7  -16 6  o 12 49.27   21.05  5.90      105.49   5.90     105.49   0.00      0.00     49.27   21.05  ?       ?      0.00    21.05  
1 1 1 -7  -16 7  o 18 170.85  30.23  944.54    285.64   944.54   285.64   0.00      0.00     170.85  30.23  ?       ?      0.00    30.23  
1 1 1 -7  -16 8  o 4  58.65   22.96  69.96     112.34   69.96    112.34   0.00      0.00     58.65   22.96  ?       ?      0.00    22.96  
1 1 1 -7  -15 1  o 17 188.70  20.75  1069.99   221.09   1004.73  304.25   1143.00   321.82   178.16  30.87  190.49  30.46  -12.33  43.36  
1 1 1 -7  -15 2  o 11 150.99  26.23  708.45    219.12   708.45   219.12   0.00      0.00     150.99  26.23  ?       ?      0.00    26.23  
1 1 1 -7  -15 3  o 10 326.63  33.52  3377.04   619.55   3161.23  789.60   3722.73   999.36   303.28  46.86  317.82  56.86  -14.54  73.68  
1 1 1 -7  -15 4  o 17 182.66  20.42  1002.68   210.47   950.34   301.72   1052.30   293.75   172.64  31.61  183.31  28.87  -10.67  42.81  
1 1 1 -7  -15 5  f 0  93.66   15.41  263.28    79.95    287.96   127.80   247.41    102.49   96.06   23.40  89.55   20.39  6.52    31.04  
1 1 1 -7  -15 6  o 4  67.98   16.30  141.06    62.80    109.55   105.05   158.59    78.33    64.07   22.76  71.89   18.78  -7.82   29.50  
1 1 1 -7  -15 7  o 18 167.86  18.47  843.20    175.05   852.49   248.94   834.11    246.21   165.05  27.22  163.21  27.24  1.83    38.51  
1 1 1 -7  -15 8  o 1  51.59   21.00  36.12     97.65    36.12    97.65    0.00      0.00     51.59   21.00  ?       ?      0.00    21.00  
1 1 1 -7  -15 9  o 5  60.05   19.11  106.14    74.15    0.00     0.00     106.14    74.15    ?       ?      60.05   19.11  0.00    19.11  
1 1 1 -7  -15 10 o 7  75.58   16.09  174.54    67.65    149.32   115.54   187.69    83.45    71.39   23.93  77.89   18.87  -6.50   30.47  
1 1 1 -7  -15 11 o 18 273.33  28.92  2361.32   446.98   2257.31  598.25   2492.75   672.48   254.67  42.41  263.82  46.08  -9.15   62.63  
1 1 1 -7  -14 1  o 8  215.06  23.25  1386.46   282.44   1362.98  401.51   1409.46   397.39   207.96  34.87  212.11  33.77  -4.15   48.54  
1 1 1 -7  -14 2  o 11 256.59  28.35  2006.49   410.60   1698.33  582.93   2309.94   578.46   225.17  46.63  269.30  38.51  -44.14  60.48  
1 1 1 -7  -14 3  o 15 233.16  22.00  1622.98   290.97   1704.47  388.91   1519.35   438.55   235.57  29.40  218.65  36.20  16.92   46.64  
1 1 1 -7  -14 4  o 7  220.39  21.99  1453.00   274.52   1378.98  369.24   1544.48   410.48   210.30  31.56  221.85  33.25  -11.55  45.85  
1 1 1 -7  -14 5  o 19 207.34  22.66  1292.64   265.32   1222.83  377.69   1360.66   372.79   195.82  34.88  208.23  32.23  -12.42  47.49  
1 1 1 -7  -14 6  o 13 100.87  15.16  303.29    85.09    405.08   131.76   230.45    111.45   115.39  20.65  86.41   22.31  28.98   30.40  
1 1 1 -7  -14 7  o 15 62.25   16.69  117.50    60.88    100.00   105.21   126.31    74.65    62.72   22.71  64.78   18.91  -2.06   29.55  
1 1 1 -7  -14 8  x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  -14 9  o 18 62.08   17.43  116.66    64.65    135.13   103.79   104.95    82.65    68.44   22.67  60.80   20.24  7.64    30.39  
1 1 1 -7  -14 10 o 3  135.72  16.91  549.58    128.89   399.76   185.36   689.85    179.35   111.96  28.71  150.75  21.32  -38.79  35.76  
1 1 1 -7  -14 11 o 10 216.87  22.92  1429.22   281.03   1383.10  385.96   1481.26   409.99   207.04  33.63  213.72  34.60  -6.68   48.25  
1 1 1 -7  -14 12 o 2  102.31  14.95  313.20    85.21    228.52   131.17   375.03    112.08   85.54   25.09  111.17  18.19  -25.63  30.99  
1 1 1 -7  -14 13 o 10 184.71  20.25  1032.69   211.18   983.21   296.55   1083.61   300.79   174.62  30.70  184.28  29.42  -9.66   42.52  
1 1 1 -7  -13 1  o 5  327.89  55.61  3606.43   1009.36  0.00     0.00     3606.43   1009.36  ?       ?      327.89  55.61  0.00    55.61  
1 1 1 -7  -13 2  o 17 197.97  31.56  1205.24   346.69   0.00     0.00     1205.24   346.69   ?       ?      197.97  31.56  0.00    31.56  
1 1 1 -7  -13 3  o 15 152.19  25.24  702.58    212.79   0.00     0.00     702.58    212.79   ?       ?      152.19  25.24  0.00    25.24  
1 1 1 -7  -13 4  o 8  290.25  33.52  2586.08   548.30   2890.60  909.23   2412.06   687.33   291.18  56.43  273.12  45.43  18.06   72.45  
1 1 1 -7  -13 5  o 12 169.98  25.12  873.90    237.73   1165.89  686.73   834.14    253.40   183.19  58.15  165.11  27.71  18.07   64.42  
1 1 1 -7  -13 6  o 7  173.47  26.50  916.15    255.50   575.73   677.25   972.64    275.89   144.16  56.40  178.33  27.86  -34.18  62.90  
1 1 1 -7  -13 7  o 5  165.41  60.52  925.07    749.60   925.07   749.60   0.00      0.00     165.41  60.52  ?       ?      0.00    60.52  
1 1 1 -7  -13 8  o 12 43.14   17.40  25.32     66.32    0.00     0.00     25.32     66.32    ?       ?      43.14   17.40  0.00    17.40  
1 1 1 -7  -13 9  o 16 341.75  38.91  3741.10   749.76   3550.72  1061.46  3930.67   1059.18  310.11  61.80  331.26  57.80  -21.14  84.61  
1 1 1 -7  -13 10 o 4  93.78   14.84  262.48    77.21    226.94   116.50   290.31    103.10   85.76   23.14  97.69   19.07  -11.93  29.98  
1 1 1 -7  -13 11 o 2  63.43   16.76  122.23    61.95    122.52   99.39    122.05    79.23    65.87   22.20  64.09   19.66  1.78    29.65  
1 1 1 -7  -13 12 o 12 142.76  16.47  605.53    132.49   600.49   191.52   610.16    183.47   139.29  24.86  140.95  23.50  -1.66   34.21  
1 1 1 -7  -13 13 o 11 269.48  31.15  2287.01   473.04   2009.60  671.08   2560.97   666.89   235.80  51.06  274.30  43.83  -38.51  67.29  
1 1 1 -7  -13 14 o 13 118.09  16.25  417.61    107.22   313.09   155.32   512.77    148.20   99.28   26.68  129.60  20.61  -30.31  33.71  
1 1 1 -7  -13 15 o 15 45.69   20.19  -24.38    103.96   -24.38   103.96   0.00      0.00     45.69   20.19  ?       ?      0.00    20.19  
1 1 1 -7  -12 1  o 2  131.35  16.56  507.37    122.11   356.49   177.46   643.06    168.29   108.07  28.28  147.33  20.45  -39.26  34.90  
1 1 1 -7  -12 2  o 3  184.16  20.00  998.01    208.08   1000.48  295.06   995.57    293.50   181.95  29.24  181.52  29.15  0.43    41.29  
1 1 1 -7  -12 3  o 11 243.13  25.85  1756.37   355.28   1625.56  503.92   1885.66   500.96   228.62  39.84  248.16  36.23  -19.54  53.85  
1 1 1 -7  -12 4  o 1  229.62  23.86  1563.00   309.99   1386.85  404.20   1814.58   483.06   212.60  34.28  243.20  35.66  -30.60  49.47  
1 1 1 -7  -12 5  f 0  318.95  29.31  3049.17   530.60   2973.07  667.43   3179.88   874.69   310.40  38.26  313.70  50.27  -3.29   63.18  
1 1 1 -7  -12 6  o 6  208.90  22.38  1294.69   264.20   1241.15  375.68   1347.08   371.62   200.44  33.85  209.80  31.86  -9.36   46.49  
1 1 1 -7  -12 7  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  -12 8  f 0  97.56   14.49  281.91    78.72    273.08   117.74   289.05    105.85   94.55   22.09  97.76   19.55  -3.21   29.50  
1 1 1 -7  -12 9  o 18 519.10  67.93  9731.80   1975.83  9545.48  2834.43  9907.91   2755.72  437.64  112.28 458.57  106.70 -20.93  154.89 
1 1 1 -7  -12 10 o 1  348.11  38.78  3826.46   761.73   4616.54  1253.80  3364.22   959.01   358.07  63.31  312.12  55.56  45.95   84.23  
1 1 1 -7  -12 11 o 3  211.75  30.14  1386.25   356.09   1492.28  875.38   1365.22   389.79   197.29  65.87  208.30  33.75  -11.01  74.01  
1 1 1 -7  -12 12 o 19 173.57  25.68  922.03    248.12   1373.77  818.50   876.32    260.37   189.08  63.70  168.20  27.95  20.88   69.56  
1 1 1 -7  -12 13 o 11 167.50  27.08  868.18    251.48   0.00     0.00     868.18    251.48   ?       ?      167.50  27.08  0.00    27.08  
1 1 1 -7  -12 14 f 0  137.07  23.33  577.00    177.02   1141.58  912.10   554.91    180.45   170.92  65.84  133.99  24.36  36.93   70.20  
1 1 1 -7  -12 15 o 8  124.55  15.98  462.34    111.61   520.19   165.22   413.79    151.36   129.90  23.00  115.33  23.66  14.57   32.99  
1 1 1 -7  -12 16 o 8  173.39  28.50  950.56    273.83   950.56   273.83   0.00      0.00     173.39  28.50  ?       ?      0.00    28.50  
1 1 1 -7  -12 17 o 16 211.61  31.06  1439.94   366.14   1439.94  366.14   0.00      0.00     211.61  31.06  ?       ?      0.00    31.06  
1 1 1 -7  -11 1  o 5  496.11  87.78  8633.78   2408.42  8633.78  2408.42  0.00      0.00     496.11  87.78  ?       ?      0.00    87.78  
1 1 1 -7  -11 2  o 16 165.02  27.93  818.33    255.19   818.33   255.19   0.00      0.00     165.02  27.93  ?       ?      0.00    27.93  
1 1 1 -7  -11 3  o 8  187.74  30.46  1060.74   317.02   1060.74  317.02   0.00      0.00     187.74  30.46  ?       ?      0.00    30.46  
1 1 1 -7  -11 4  o 16 176.05  28.80  931.39    281.02   931.39   281.02   0.00      0.00     176.05  28.80  ?       ?      0.00    28.80  
1 1 1 -7  -11 5  o 6  340.85  54.63  3685.77   1032.86  3685.77  1032.86  0.00      0.00     340.85  54.63  ?       ?      0.00    54.63  
1 1 1 -7  -11 6  o 5  212.05  33.41  1365.54   393.22   1365.54  393.22   0.00      0.00     212.05  33.41  ?       ?      0.00    33.41  
1 1 1 -7  -11 7  x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  -11 8  o 1  118.14  22.59  421.79    147.59   421.79   147.59   0.00      0.00     118.14  22.59  ?       ?      0.00    22.59  
1 1 1 -7  -11 9  o 14 84.56   20.96  217.39    101.23   217.39   101.23   0.00      0.00     84.56   20.96  ?       ?      0.00    20.96  
1 1 1 -7  -11 10 o 2  300.84  49.72  2952.64   828.63   2952.64  828.63   0.00      0.00     300.84  49.72  ?       ?      0.00    49.72  
1 1 1 -7  -11 11 o 3  183.57  19.12  995.65    198.57   951.34   273.81   1044.82   288.39   176.60  27.94  185.22  27.99  -8.62   39.55  
1 1 1 -7  -11 12 o 3  191.08  19.93  1082.99   215.38   1006.62  293.92   1171.56   316.52   180.84  29.32  195.47  29.09  -14.63  41.30  
1 1 1 -7  -11 13 o 2  66.89   16.51  135.81    62.99    94.92    92.18    171.65    86.28    60.28   21.33  75.03   19.76  -14.74  29.07  
1 1 1 -7  -11 14 o 14 194.73  21.67  1137.57   238.16   1091.32  342.72   1180.75   331.18   185.43  33.43  194.43  30.69  -9.00   45.38  
1 1 1 -7  -11 15 o 3  226.62  22.06  1542.72   283.38   1658.99  385.73   1406.40   417.69   231.05  29.77  208.81  36.15  22.24   46.83  
1 1 1 -7  -11 16 o 15 182.40  67.54  1387.96   938.34   1387.96  938.34   0.00      0.00     182.40  67.54  ?       ?      0.00    67.54  
1 1 1 -7  -11 17 o 1  279.87  86.14  4127.46   1519.02  4127.46  1519.02  0.00      0.00     279.87  86.14  ?       ?      0.00    86.14  
1 1 1 -7  -11 18 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  -11 19 o 18 130.58  58.90  364.05    934.77   364.05   934.77   0.00      0.00     130.58  58.90  ?       ?      0.00    58.90  
1 1 1 -7  -10 1  o 14 466.77  50.80  6793.89   1339.33  6851.20  1894.37  6736.61   1893.81  447.84  76.43  443.28  77.23  4.55    108.65 
1 1 1 -7  -10 2  o 7  594.07  68.36  11602.63  2288.96  11303.35 3237.13  11901.90  3237.02  538.57  108.46 557.81  104.94 -19.24  150.91 
1 1 1 -7  -10 3  o 8  98.26   14.73  284.86    80.54    284.40   115.00   285.31    112.82   97.08   21.23  97.29   20.83  -0.21   29.74  
1 1 1 -7  -10 4  o 2  304.05  47.64  2868.11   804.31   0.00     0.00     2868.11   804.31   ?       ?      304.05  47.64  0.00    47.64  
1 1 1 -7  -10 5  o 7  667.34  77.69  14847.38  2920.87  15195.64 4130.94  14499.19  4130.52  619.99  120.41 599.99  124.02 20.00   172.86 
1 1 1 -7  -10 6  x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  -10 7  f 0  265.49  41.26  2154.00   608.39   0.00     0.00     2154.00   608.39   ?       ?      265.49  41.26  0.00    41.26  
1 1 1 -7  -10 8  o 7  449.28  48.40  6231.20   1228.71  6283.00  1738.02  6179.44   1737.31  433.60  72.37  429.35  73.10  4.25    102.87 
1 1 1 -7  -10 9  o 17 292.74  26.99  2538.15   448.39   2398.17  567.74   2770.22   731.03   281.15  36.00  298.79  43.93  -17.64  56.80  
1 1 1 -7  -10 10 o 7  89.49   13.97  236.98    69.43    199.29   102.37   269.08    94.48    81.18   21.59  94.71   18.03  -13.53  28.13  
1 1 1 -7  -10 11 o 16 143.09  15.41  600.39    124.61   671.96   174.83   526.47    177.67   150.24  20.83  131.78  24.38  18.46   32.07  
1 1 1 -7  -10 12 o 9  121.47  22.10  445.87    148.44   445.87   148.44   0.00      0.00     121.47  22.10  ?       ?      0.00    22.10  
1 1 1 -7  -10 13 o 5  276.93  45.88  2487.34   703.87   2487.34  703.87   0.00      0.00     276.93  45.88  ?       ?      0.00    45.88  
1 1 1 -7  -10 14 o 10 132.81  25.87  542.65    190.12   542.65   190.12   0.00      0.00     132.81  25.87  ?       ?      0.00    25.87  
1 1 1 -7  -10 15 o 5  252.83  42.75  2098.57   598.36   2098.57  598.36   0.00      0.00     252.83  42.75  ?       ?      0.00    42.75  
1 1 1 -7  -10 16 o 13 136.53  25.08  575.65    189.36   575.65   189.36   0.00      0.00     136.53  25.08  ?       ?      0.00    25.08  
1 1 1 -7  -10 17 o 2  199.66  33.30  1273.09   368.21   1273.09  368.21   0.00      0.00     199.66  33.30  ?       ?      0.00    33.30  
1 1 1 -7  -10 18 o 11 230.83  39.43  1774.45   503.70   1774.45  503.70   0.00      0.00     230.83  39.43  ?       ?      0.00    39.43  
1 1 1 -7  -10 19 o 18 162.06  26.85  826.04    241.07   826.04   241.07   0.00      0.00     162.06  26.85  ?       ?      0.00    26.85  
1 1 1 -7  -10 20 o 6  124.76  23.75  488.77    163.91   488.77   163.91   0.00      0.00     124.76  23.75  ?       ?      0.00    23.75  
1 1 1 -7  -9  1  o 2  88.61   12.61  230.74    62.35    271.17   92.21    196.69    84.62    95.38   17.49  80.85   18.62  14.53   25.54  
1 1 1 -7  -9  2  f 0  597.51  67.42  11512.69  2272.28  10995.74 3213.53  12029.62  3213.46  541.92  107.09 574.69  101.09 -32.77  147.27 
1 1 1 -7  -9  3  o 18 419.37  44.72  5363.87   1060.02  5071.28  1499.15  5656.41   1499.04  392.57  69.04  418.28  64.50  -25.71  94.48  
1 1 1 -7  -9  4  o 18 244.72  25.49  1767.67   352.90   1640.25  499.61   1894.55   498.54   231.47  38.98  250.30  35.71  -18.84  52.86  
1 1 1 -7  -9  5  o 4  150.91  16.58  666.50    141.27   766.88   200.76   568.04    198.83   160.86  22.34  137.18  26.20  23.68   34.44  
1 1 1 -7  -9  6  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  -9  7  o 13 566.26  63.48  10255.12  2027.99  9640.14  2868.00  10870.11  2868.03  511.28  101.30 552.25  93.82  -40.98  138.07 
1 1 1 -7  -9  8  o 11 438.34  46.35  5861.97   1148.74  6601.07  1625.07  5123.79   1624.05  453.87  64.16  391.76  74.94  62.11   98.65  
1 1 1 -7  -9  9  o 18 673.62  78.88  15152.72  2992.41  14636.41 4231.97  15669.01  4231.85  600.29  126.79 629.69  121.47 -29.41  175.59 
1 1 1 -7  -9  10 o 12 183.45  20.05  987.68    207.69   771.09   294.37   1202.39   293.08   158.74  33.36  201.27  25.97  -42.53  42.28  
1 1 1 -7  -9  11 o 9  239.52  22.07  1686.04   300.09   1731.00  389.27   1620.18   471.14   240.82  28.72  230.07  36.92  10.75   46.78  
1 1 1 -7  -9  12 o 8  87.96   13.95  229.15    68.07    267.97   100.79   196.58    92.31    94.28   19.27  80.57   20.04  13.72   27.80  
1 1 1 -7  -9  13 o 8  569.04  63.02  11012.90  2024.31  12056.36 2898.10  10018.76  2828.77  544.62  96.21  480.42  105.47 64.20   142.76 
1 1 1 -7  -9  14 o 19 500.14  41.75  7837.36   1187.69  8216.05  1464.51  7109.78   2029.97  501.39  51.62  423.43  86.44  77.96   100.68 
1 1 1 -7  -9  15 o 11 392.59  31.37  4692.71   701.01   5053.87  880.75   4068.49   1157.91  401.68  38.67  339.53  61.68  62.15   72.80  
1 1 1 -7  -9  16 o 9  232.79  22.24  1618.42   293.60   1688.80  393.83   1530.37   440.53   234.27  29.97  219.57  36.21  14.69   47.00  
1 1 1 -7  -9  17 o 13 99.32   22.20  304.26    123.37   304.26   123.37   0.00      0.00     99.32   22.20  ?       ?      0.00    22.20  
1 1 1 -7  -9  18 o 13 211.42  28.17  1385.30   333.43   1385.30  333.43   0.00      0.00     211.42  28.17  ?       ?      0.00    28.17  
1 1 1 -7  -9  19 o 11 194.54  32.70  1214.85   352.30   1214.85  352.30   0.00      0.00     194.54  32.70  ?       ?      0.00    32.70  
1 1 1 -7  -9  20 o 3  133.98  24.25  560.03    179.65   560.03   179.65   0.00      0.00     133.98  24.25  ?       ?      0.00    24.25  
1 1 1 -7  -9  21 o 5  253.61  47.39  2358.91   664.59   2358.91  664.59   0.00      0.00     253.61  47.39  ?       ?      0.00    47.39  
1 1 1 -7  -9  22 o 18 175.96  30.54  1011.39   297.29   1011.39  297.29   0.00      0.00     175.96  30.54  ?       ?      0.00    30.54  
1 1 1 -7  -8  1  o 17 266.11  27.29  2082.31   410.98   2224.40  581.92   1940.90   580.52   272.14  38.31  252.94  41.41  19.20   56.41  
1 1 1 -7  -8  2  o 17 744.08  85.92  18295.43  3602.62  18379.76 5094.95  18211.11  5094.81  686.48  134.10 682.16  134.88 4.33    190.20 
1 1 1 -7  -8  3  o 19 494.03  52.68  7462.18   1471.14  7384.92  2080.64  7539.42   2080.37  474.25  79.22  480.03  78.18  -5.78   111.30 
1 1 1 -7  -8  4  o 5  632.40  70.81  12808.43  2526.45  12239.03 3572.94  13377.84  3572.94  576.52  111.99 610.52  105.77 -34.00  154.05 
1 1 1 -7  -8  5  o 17 563.14  102.80 11488.73  3200.94  11488.73 3200.94  0.00      0.00     563.14  102.80 ?       ?      0.00    102.80 
1 1 1 -7  -8  6  o 15 603.16  119.53 14332.19  3992.46  0.00     0.00     14332.19  3992.46  ?       ?      603.16  119.53 0.00    119.53 
1 1 1 -7  -8  7  o 19 242.29  25.11  1731.31   344.17   1787.76  486.95   1674.96   486.50   242.96  36.00  234.56  37.38  8.40    51.90  
1 1 1 -7  -8  8  o 15 338.82  35.52  3444.43   680.56   3476.74  962.71   3412.16   962.21   332.52  52.15  329.06  52.72  3.46    74.15  
1 1 1 -7  -8  9  o 14 470.87  50.95  6864.04   1355.41  6683.96  1916.92  7044.09   1916.77  444.29  78.00  458.49  75.45  -14.21  108.52 
1 1 1 -7  -8  10 o 5  761.29  94.13  20420.20  4026.30  20072.93 5694.03  20767.46  5694.06  660.07  153.22 677.72  150.30 -17.65  214.63 
1 1 1 -7  -8  11 o 14 497.46  86.84  8570.51   2389.71  0.00     0.00     8570.51   2389.71  ?       ?      497.46  86.84  0.00    86.84  
1 1 1 -7  -8  12 o 5  407.62  34.40  4960.17   797.36   4868.84  986.24   5132.54   1354.88  399.18  43.75  399.17  61.07  0.01    75.12  
1 1 1 -7  -8  13 o 5  426.79  34.77  5479.65   844.55   5710.89  1047.59  5050.32   1427.42  430.70  42.94  387.44  66.58  43.26   79.22  
1 1 1 -7  -8  14 o 14 388.16  32.47  4543.92   716.89   4621.40  892.83   4403.30   1202.73  386.15  40.90  362.45  59.89  23.70   72.52  
1 1 1 -7  -8  15 o 12 250.97  26.00  1884.64   369.22   2089.83  525.72   1684.91   518.67   259.71  36.25  230.60  40.67  29.11   54.48  
1 1 1 -7  -8  16 o 13 448.63  53.98  6741.91   1362.34  6100.65  1927.47  7382.08   1925.81  381.06  89.62  435.68  79.94  -54.62  120.10 
1 1 1 -7  -8  17 o 14 190.19  19.41  1073.32   209.00   1088.59  286.19   1055.87   305.93   188.71  27.20  184.68  29.88  4.03    40.41  
1 1 1 -7  -8  18 f 0  75.21   21.94  171.77    100.55   171.77   100.55   0.00      0.00     75.21   21.94  ?       ?      0.00    21.94  
1 1 1 -7  -8  19 o 2  124.88  23.39  481.18    161.55   481.18   161.55   0.00      0.00     124.88  23.39  ?       ?      0.00    23.39  
1 1 1 -7  -8  20 o 19 224.68  29.57  1586.43   372.15   1586.43  372.15   0.00      0.00     224.68  29.57  ?       ?      0.00    29.57  
1 1 1 -7  -8  21 o 19 119.22  21.97  440.14    144.80   440.14   144.80   0.00      0.00     119.22  21.97  ?       ?      0.00    21.97  
1 1 1 -7  -8  22 o 7  121.59  21.96  460.53    147.68   460.53   147.68   0.00      0.00     121.59  21.96  ?       ?      0.00    21.96  
1 1 1 -7  -8  23 o 1  215.70  24.37  1454.01   296.53   1454.01  296.53   0.00      0.00     215.70  24.37  ?       ?      0.00    24.37  
1 1 1 -7  -7  1  o 19 698.94  143.06 19915.08  5546.64  0.00     0.00     19915.08  5546.64  ?       ?      698.94  143.06 0.00    143.06 
1 1 1 -7  -7  2  o 8  453.65  73.49  6632.50   1848.52  0.00     0.00     6632.50   1848.52  ?       ?      453.65  73.49  0.00    73.49  
1 1 1 -7  -7  3  o 17 284.07  43.26  2445.05   683.26   0.00     0.00     2445.05   683.26   ?       ?      284.07  43.26  0.00    43.26  
1 1 1 -7  -7  4  o 2  189.33  28.66  1066.85   301.71   0.00     0.00     1066.85   301.71   ?       ?      189.33  28.66  0.00    28.66  
1 1 1 -7  -7  5  x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  -7  6  o 7  455.11  74.01  6699.69   1867.35  0.00     0.00     6699.69   1867.35  ?       ?      455.11  74.01  0.00    74.01  
1 1 1 -7  -7  7  f 0  208.29  31.68  1299.79   366.89   0.00     0.00     1299.79   366.89   ?       ?      208.29  31.68  0.00    31.68  
1 1 1 -7  -7  8  o 10 345.87  54.62  3756.92   1048.56  0.00     0.00     3756.92   1048.56  ?       ?      345.87  54.62  0.00    54.62  
1 1 1 -7  -7  9  f 0  277.00  42.94  2359.18   660.74   0.00     0.00     2359.18   660.74   ?       ?      277.00  42.94  0.00    42.94  
1 1 1 -7  -7  10 o 10 505.15  61.21  8176.94   1738.77  7372.10  2473.46  8963.21   2444.77  443.26  99.64  503.56  87.76  -60.30  132.77 
1 1 1 -7  -7  11 o 3  420.36  37.12  5292.97   886.44   6670.55  1294.19  4075.55   1216.64  465.29  49.20  355.53  61.86  109.76  79.03  
1 1 1 -7  -7  12 o 12 490.48  85.21  8289.00   2312.21  0.00     0.00     8289.00   2312.21  ?       ?      490.48  85.21  0.00    85.21  
1 1 1 -7  -7  13 o 1  43.75   20.45  -123.39   127.38   -3973.58 627.23   42.23     130.09   ?       ?      59.65   24.25  0.00    24.25  
1 1 1 -7  -7  14 o 4  205.49  20.47  1240.27   238.28   1165.06  319.66   1334.31   357.45   196.80  29.18  210.46  30.47  -13.66  42.19  
1 1 1 -7  -7  15 o 5  488.58  46.40  7501.13   1285.93  7017.12  1581.57  8445.25   2208.89  457.94  61.73  476.56  83.80  -18.62  104.08 
1 1 1 -7  -7  16 o 3  215.50  23.08  1381.57   281.03   1360.49  400.44   1402.04   394.51   209.48  34.50  213.22  33.32  -3.75   47.96  
1 1 1 -7  -7  17 o 4  93.83   15.62  262.67    81.19    221.27   123.23   294.43    107.93   85.27   24.11  98.57   19.76  -13.30  31.17  
1 1 1 -7  -7  18 o 17 352.10  38.56  3928.59   766.64   3928.59  766.64   0.00      0.00     352.10  38.56  ?       ?      0.00    38.56  
1 1 1 -7  -7  19 o 11 187.40  30.69  1101.45   318.72   1101.45  318.72   0.00      0.00     187.40  30.69  ?       ?      0.00    30.69  
1 1 1 -7  -7  20 o 16 153.29  24.13  722.57    205.32   722.57   205.32   0.00      0.00     153.29  24.13  ?       ?      0.00    24.13  
1 1 1 -7  -7  21 o 11 334.42  37.02  3661.63   698.81   3661.63  698.81   0.00      0.00     334.42  37.02  ?       ?      0.00    37.02  
1 1 1 -7  -7  22 o 17 114.72  20.83  406.24    132.10   406.24   132.10   0.00      0.00     114.72  20.83  ?       ?      0.00    20.83  
1 1 1 -7  -7  23 o 16 309.73  30.42  3097.74   533.84   3097.74  533.84   0.00      0.00     309.73  30.42  ?       ?      0.00    30.42  
1 1 1 -7  -7  24 o 13 112.08  22.82  398.37    141.85   398.37   141.85   0.00      0.00     112.08  22.82  ?       ?      0.00    22.82  
1 1 1 -7  -6  1  o 1  236.64  24.42  1647.87   326.92   1603.98  462.67   1691.64   462.01   230.13  36.22  236.84  35.04  -6.71   50.39  
1 1 1 -7  -6  2  o 14 523.29  56.95  8529.77   1683.26  8298.55  2380.50  8760.98   2380.47  491.56  87.57  508.03  84.60  -16.46  121.76 
1 1 1 -7  -6  3  o 6  245.60  25.31  1773.03   351.71   1726.04  497.63   1819.93   497.16   239.02  37.50  245.93  36.30  -6.91   52.19  
1 1 1 -7  -6  4  o 3  547.40  94.66  10291.80  2866.98  10291.80 2866.98  0.00      0.00     547.40  94.66  ?       ?      0.00    94.66  
1 1 1 -7  -6  5  o 5  371.25  58.01  4287.98   1195.82  0.00     0.00     4287.98   1195.82  ?       ?      371.25  58.01  0.00    58.01  
1 1 1 -7  -6  6  f 0  267.72  27.59  2107.13   417.97   1824.46  590.38   2391.20   591.83   244.54  43.66  282.76  37.37  -38.22  57.47  
1 1 1 -7  -6  7  o 9  549.47  59.25  9317.38   1839.39  8393.65  2601.09  10241.40  2601.50  495.77  94.85  558.11  83.78  -62.34  126.55 
1 1 1 -7  -6  8  f 0  463.88  49.36  6536.82   1294.27  5220.50  1829.96  7854.33   1830.79  394.62  83.39  499.11  65.47  -104.50 106.03 
1 1 1 -7  -6  9  o 16 350.45  36.80  3670.41   729.32   2994.54  1030.87  4347.69   1031.95  305.93  60.84  376.38  48.92  -70.44  78.07  
1 1 1 -7  -6  10 o 7  543.01  60.16  9343.69   1843.82  8989.89  2607.60  9697.47   2607.52  500.86  94.15  525.35  89.68  -24.49  130.02 
1 1 1 -7  -6  11 o 1  503.81  55.61  8000.75   1581.62  7489.31  2236.39  8512.52   2237.10  458.43  88.18  496.45  81.31  -38.02  119.94 
1 1 1 -7  -6  12 o 19 126.52  16.38  470.48    116.20   413.57   166.13   524.99    162.60   116.78  25.50  132.62  22.14  -15.84  33.77  
1 1 1 -7  -6  13 o 14 406.94  34.98  4938.36   809.24   5070.58  1003.15  4692.01   1369.33  408.34  43.46  380.03  65.11  28.31   78.28  
1 1 1 -7  -6  14 o 19 146.35  17.26  628.08    142.22   894.20   199.54   353.29    202.77   174.40  20.31  108.22  31.03  66.18   37.09  
1 1 1 -7  -6  15 o 10 500.67  49.00  7804.29   1390.36  8944.54  2004.94  6747.97   1929.75  517.39  69.24  439.14  79.47  78.24   105.40 
1 1 1 -7  -6  16 o 13 451.75  46.67  6424.79   1192.93  7092.85  1728.48  5817.14   1648.48  453.39  68.55  404.95  73.62  48.45   100.59 
1 1 1 -7  -6  17 o 4  324.01  35.92  3236.76   656.97   3510.36  1018.07  3041.53   859.99   321.84  57.20  303.81  51.12  18.03   76.72  
1 1 1 -7  -6  18 o 4  280.34  62.19  2811.57   974.72   2811.57  974.72   0.00      0.00     280.34  62.19  ?       ?      0.00    62.19  
1 1 1 -7  -6  19 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  -6  20 o 10 199.66  58.25  1512.27   708.82   1512.27  708.82   0.00      0.00     199.66  58.25  ?       ?      0.00    58.25  
1 1 1 -7  -6  21 o 14 347.41  34.90  3872.93   686.58   3872.93  686.58   0.00      0.00     347.41  34.90  ?       ?      0.00    34.90  
1 1 1 -7  -6  22 o 1  135.51  21.83  564.62    164.05   564.62   164.05   0.00      0.00     135.51  21.83  ?       ?      0.00    21.83  
1 1 1 -7  -6  23 o 3  67.79   20.66  140.04    87.66    140.04   87.66    0.00      0.00     67.79   20.66  ?       ?      0.00    20.66  
1 1 1 -7  -6  24 o 5  48.58   19.09  45.35     77.93    45.35    77.93    0.00      0.00     48.58   19.09  ?       ?      0.00    19.09  
1 1 1 -7  -5  1  o 18 370.02  60.66  4462.29   1243.88  4462.29  1243.88  0.00      0.00     370.02  60.66  ?       ?      0.00    60.66  
1 1 1 -7  -5  2  o 14 292.11  45.60  2651.04   739.74   2651.04  739.74   0.00      0.00     292.11  45.60  ?       ?      0.00    45.60  
1 1 1 -7  -5  3  o 13 219.32  33.29  1452.02   405.98   1452.02  405.98   0.00      0.00     219.32  33.29  ?       ?      0.00    33.29  
1 1 1 -7  -5  4  x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  -5  5  x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  -5  6  o 17 612.35  112.75 13705.61  3817.40  13705.61 3817.40  0.00      0.00     612.35  112.75 ?       ?      0.00    112.75 
1 1 1 -7  -5  7  o 6  255.53  38.65  1966.82   549.21   1966.82  549.21   0.00      0.00     255.53  38.65  ?       ?      0.00    38.65  
1 1 1 -7  -5  8  o 5  768.89  172.17 26607.81  7409.90  26607.81 7409.90  0.00      0.00     768.89  172.17 ?       ?      0.00    172.17 
1 1 1 -7  -5  9  o 5  227.77  34.30  1554.38   434.64   1554.38  434.64   0.00      0.00     227.77  34.30  ?       ?      0.00    34.30  
1 1 1 -7  -5  10 o 13 194.16  29.19  1125.12   315.35   1125.12  315.35   0.00      0.00     194.16  29.19  ?       ?      0.00    29.19  
1 1 1 -7  -5  11 o 9  575.98  110.17 12600.07  3509.97  12600.07 3509.97  0.00      0.00     575.98  110.17 ?       ?      0.00    110.17 
1 1 1 -7  -5  12 o 7  175.08  27.23  918.62    264.84   918.62   264.84   0.00      0.00     175.08  27.23  ?       ?      0.00    27.23  
1 1 1 -7  -5  13 o 10 153.18  24.61  701.75    209.05   701.75   209.05   0.00      0.00     153.18  24.61  ?       ?      0.00    24.61  
1 1 1 -7  -5  14 o 8  387.47  63.17  4859.51   1356.70  4859.51  1356.70  0.00      0.00     387.47  63.17  ?       ?      0.00    63.17  
1 1 1 -7  -5  15 o 17 148.65  25.02  661.97    205.98   661.97   205.98   0.00      0.00     148.65  25.02  ?       ?      0.00    25.02  
1 1 1 -7  -5  16 o 2  226.78  35.36  1568.40   445.37   1568.40  445.37   0.00      0.00     226.78  35.36  ?       ?      0.00    35.36  
1 1 1 -7  -5  17 o 8  278.31  24.24  2294.46   383.40   2354.97  490.90   2199.82   613.91   279.23  31.15  264.71  41.78  14.53   52.12  
1 1 1 -7  -5  18 o 14 201.77  19.48  1201.98   222.83   1205.67  297.00   1197.22   337.04   199.76  26.56  197.44  30.74  2.32    40.62  
1 1 1 -7  -5  19 o 16 346.06  73.04  4596.82   1405.42  4596.82  1405.42  0.00      0.00     346.06  73.04  ?       ?      0.00    73.04  
1 1 1 -7  -5  20 o 11 239.10  26.84  1742.85   362.00   1742.85  362.00   0.00      0.00     239.10  26.84  ?       ?      0.00    26.84  
1 1 1 -7  -5  21 o 9  178.48  23.92  973.36    238.92   973.36   238.92   0.00      0.00     178.48  23.92  ?       ?      0.00    23.92  
1 1 1 -7  -5  22 o 1  116.42  42.33  429.89    365.92   429.89   365.92   0.00      0.00     116.42  42.33  ?       ?      0.00    42.33  
1 1 1 -7  -5  23 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  -5  24 o 19 116.19  41.41  466.05    348.12   466.05   348.12   0.00      0.00     116.19  41.41  ?       ?      0.00    41.41  
1 1 1 -7  -5  25 f 0  214.04  49.29  1831.85   593.16   1831.85  593.16   0.00      0.00     214.04  49.29  ?       ?      0.00    49.29  
1 1 1 -7  -4  1  o 2  184.26  27.99  1023.22   286.74   1023.22  286.74   0.00      0.00     184.26  27.99  ?       ?      0.00    27.99  
1 1 1 -7  -4  2  o 12 189.40  19.66  1054.51   210.68   909.40   297.63   1200.26   298.28   172.65  31.18  200.38  26.59  -27.73  40.97  
1 1 1 -7  -4  3  o 1  253.84  39.26  1982.96   553.69   1982.96  553.69   0.00      0.00     253.84  39.26  ?       ?      0.00    39.26  
1 1 1 -7  -4  4  x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  -4  5  o 13 656.52  78.28  14618.33  2892.30  13394.74 4090.25  15842.01  4090.41  556.65  130.31 628.27  117.74 -71.63  175.62 
1 1 1 -7  -4  6  o 9  493.57  53.86  7569.76   1501.37  6686.69  2123.09  8453.09   2123.41  437.81  87.54  504.38  75.67  -66.57  115.71 
1 1 1 -7  -4  7  o 18 501.18  54.11  7745.37   1532.18  7236.47  2166.81  8254.30   2166.85  462.49  84.73  500.12  78.02  -37.63  115.18 
1 1 1 -7  -4  8  o 12 169.90  17.40  842.17    167.33   830.98   236.55   853.37    236.72   167.24  25.44  169.61  25.07  -2.36   35.71  
1 1 1 -7  -4  9  o 17 543.14  58.65  9104.99   1799.81  8217.88  2545.23  9992.22   2545.41  490.57  93.80  551.14  83.03  -60.57  125.26 
1 1 1 -7  -4  10 o 2  106.19  11.33  328.15    68.00    261.21   95.94    395.71    96.39    93.47   18.54  116.25  14.78  -22.78  23.70  
1 1 1 -7  -4  11 o 1  493.65  52.88  7486.80   1475.34  7465.84  2086.56  7507.76   2086.32  474.65  79.38  476.23  79.09  -1.58   112.05 
1 1 1 -7  -4  12 o 12 787.30  101.08 22599.82  4463.36  21412.95 6312.16  23786.67  6312.12  645.05  168.61 703.03  160.01 -57.97  232.45 
1 1 1 -7  -4  13 o 9  149.44  16.14  653.35    136.29   690.16   191.31   615.41    194.20   152.34  22.56  143.24  24.50  9.10    33.30  
1 1 1 -7  -4  14 o 14 348.29  26.31  3574.46   522.07   3763.55  648.08   3224.95   881.10   355.22  32.13  320.50  49.48  34.72   59.00  
1 1 1 -7  -4  15 o 11 173.01  19.41  878.83    189.49   663.14   251.67   1161.17   287.94   147.45  30.73  197.65  26.01  -50.20  40.26  
1 1 1 -7  -4  16 o 13 519.93  36.76  8100.27   1090.18  9073.43  1345.03  6236.62   1861.31  546.09  43.26  425.12  79.18  120.96  90.23  
1 1 1 -7  -4  17 o 13 342.19  30.27  3494.99   588.50   3311.49  734.98   3822.79   982.36   328.53  39.78  346.64  50.88  -18.10  64.58  
1 1 1 -7  -4  18 o 11 201.79  31.75  1248.13   355.62   1248.13  355.62   0.00      0.00     201.79  31.75  ?       ?      0.00    31.75  
1 1 1 -7  -4  19 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  -4  20 f 0  198.74  31.87  1232.48   351.37   1232.48  351.37   0.00      0.00     198.74  31.87  ?       ?      0.00    31.87  
1 1 1 -7  -4  21 o 1  128.09  22.30  501.83    158.05   501.83   158.05   0.00      0.00     128.09  22.30  ?       ?      0.00    22.30  
1 1 1 -7  -4  22 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  -4  23 o 11 268.56  27.74  2259.31   421.46   2259.31  421.46   0.00      0.00     268.56  27.74  ?       ?      0.00    27.74  
1 1 1 -7  -4  24 o 13 72.18   20.50  161.72    88.93    161.72   88.93    0.00      0.00     72.18   20.50  ?       ?      0.00    20.50  
1 1 1 -7  -4  25 o 16 119.00  22.14  446.49    145.66   446.49   145.66   0.00      0.00     119.00  22.14  ?       ?      0.00    22.14  
1 1 1 -7  -4  26 o 5  78.30   19.63  194.17    88.04    194.17   88.04    0.00      0.00     78.30   19.63  ?       ?      0.00    19.63  
1 1 1 -7  -3  1  o 8  122.03  12.70  434.76    87.68    419.66   124.08   449.81    123.91   118.67  18.84  123.12  18.07  -4.45   26.11  
1 1 1 -7  -3  2  o 10 78.45   8.77   179.37    38.82    145.67   55.19    212.39    54.62    69.71   14.27  85.04   11.48  -15.33  18.32  
1 1 1 -7  -3  3  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  -3  4  o 16 546.81  119.35 13073.15  3641.07  0.00     0.00     13073.15  3641.07  ?       ?      546.81  119.35 0.00    119.35 
1 1 1 -7  -3  5  o 18 470.54  52.02  6990.14   1381.87  6611.51  1954.27  7368.77   1954.24  430.46  82.08  460.64  76.59  -30.18  112.26 
1 1 1 -7  -3  6  o 8  122.95  18.61  448.01    127.24   0.00     0.00     448.01    127.24   ?       ?      122.95  18.61  0.00    18.61  
1 1 1 -7  -3  7  o 15 563.97  63.22  10192.89  2011.48  9845.83  2844.68  10539.95  2844.65  517.52  99.36  540.77  95.10  -23.25  137.54 
1 1 1 -7  -3  8  o 9  478.79  51.51  7049.48   1393.57  6689.74  1970.79  7409.22   1970.81  446.77  79.77  474.58  74.81  -27.81  109.36 
1 1 1 -7  -3  9  o 3  400.80  42.19  4828.07   956.22   4460.58  1352.26  5195.62   1352.35  373.80  65.40  407.32  59.60  -33.52  88.48  
1 1 1 -7  -3  10 o 1  674.37  131.57 17631.65  4910.56  17631.65 4910.56  0.00      0.00     674.37  131.57 ?       ?      0.00    131.57 
1 1 1 -7  -3  11 o 16 318.92  33.05  3013.31   596.29   2857.63  843.52   3168.82   843.04   304.57  49.98  322.27  46.95  -17.70  68.57  
1 1 1 -7  -3  12 o 18 381.28  40.05  4366.45   863.43   4145.04  1221.22  4587.75   1220.94  361.25  61.06  382.47  57.38  -21.22  83.79  
1 1 1 -7  -3  13 o 9  302.51  31.60  2725.55   540.60   2559.96  764.77   2890.93   764.27   286.42  48.22  306.33  44.78  -19.91  65.81  
1 1 1 -7  -3  14 o 10 99.12   12.56  287.86    69.89    228.16   99.74    345.45    97.96    86.88   20.36  108.08  16.30  -21.20  26.08  
1 1 1 -7  -3  15 o 12 208.63  20.40  1277.35   241.26   1026.82  310.76   1657.44   382.77   184.25  30.44  235.60  28.91  -51.35  41.98  
1 1 1 -7  -3  16 o 16 436.39  42.20  5797.18   1043.90  5247.27  1285.95  6859.77   1787.57  405.96  56.73  453.23  71.04  -47.27  90.91  
1 1 1 -7  -3  17 o 10 44.67   15.59  51.35     49.13    86.46    80.10    30.17     62.21    57.44   19.91  43.17   17.03  14.27   26.20  
1 1 1 -7  -3  18 o 6  327.07  31.34  3217.35   581.21   2666.55  720.09   4246.86   984.47   290.85  44.54  365.77  48.05  -74.92  65.52  
1 1 1 -7  -3  19 o 8  315.50  33.31  3049.67   594.26   3049.67  594.26   0.00      0.00     315.50  33.31  ?       ?      0.00    33.31  
1 1 1 -7  -3  20 o 14 272.73  27.33  2252.61   422.16   2252.61  422.16   0.00      0.00     272.73  27.33  ?       ?      0.00    27.33  
1 1 1 -7  -3  21 o 3  252.82  27.71  1956.96   395.57   1956.96  395.57   0.00      0.00     252.82  27.71  ?       ?      0.00    27.71  
1 1 1 -7  -3  22 o 3  175.20  20.03  923.18    197.82   923.18   197.82   0.00      0.00     175.20  20.03  ?       ?      0.00    20.03  
1 1 1 -7  -3  23 o 10 153.87  19.55  716.82    168.81   716.82   168.81   0.00      0.00     153.87  19.55  ?       ?      0.00    19.55  
1 1 1 -7  -3  24 o 6  157.13  26.96  786.89    234.43   786.89   234.43   0.00      0.00     157.13  26.96  ?       ?      0.00    26.96  
1 1 1 -7  -3  25 o 5  83.31   21.38  219.74    102.73   219.74   102.73   0.00      0.00     83.31   21.38  ?       ?      0.00    21.38  
1 1 1 -7  -3  26 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  -2  1  o 2  260.32  27.08  2023.97   398.71   2061.90  563.99   1986.08   563.74   257.44  39.41  252.15  40.30  5.29    56.37  
1 1 1 -7  -2  2  o 4  373.10  63.98  4740.02   1320.94  4740.02  1320.94  0.00      0.00     373.10  63.98  ?       ?      0.00    63.98  
1 1 1 -7  -2  3  x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  -2  4  o 3  419.81  74.94  6244.80   1739.74  0.00     0.00     6244.80   1739.74  ?       ?      419.81  74.94  0.00    74.94  
1 1 1 -7  -2  5  o 15 601.50  72.99  12513.48  2468.82  12202.25 3491.47  12824.69  3491.42  525.73  118.53 545.72  115.08 -20.00  165.20 
1 1 1 -7  -2  6  f 0  199.98  20.55  1176.38   232.55   1177.72  328.98   1175.04   328.77   197.50  29.95  197.27  29.97  0.24    42.38  
1 1 1 -7  -2  7  o 17 409.21  44.00  5144.02   1017.37  4892.25  1438.78  5395.78   1438.78  382.60  68.00  405.35  63.95  -22.76  93.34  
1 1 1 -7  -2  8  o 15 170.58  17.57  850.97    169.62   784.34   239.96   917.51    239.79   161.70  26.79  175.76  24.42  -14.06  36.25  
1 1 1 -7  -2  9  o 2  437.50  46.53  5827.34   1150.69  5621.05  1627.35  6033.61   1627.30  414.82  70.88  432.18  67.82  -17.36  98.10  
1 1 1 -7  -2  10 o 17 299.79  30.79  2657.25   522.41   2796.33  739.19   2518.46   738.41   303.33  43.71  286.57  46.48  16.76   63.80  
1 1 1 -7  -2  11 o 9  606.16  66.59  11593.70  2279.10  11877.41 3223.27  11310.04  3222.99  583.15  99.87  565.61  103.06 17.54   143.51 
1 1 1 -7  -2  12 o 7  620.19  69.39  12274.64  2428.03  11628.56 3433.82  12920.67  3433.70  563.68  110.07 602.95  102.89 -39.27  150.67 
1 1 1 -7  -2  13 o 9  108.49  12.29  343.44    75.22    338.67   108.96   347.79    103.96   106.68  18.46  108.36  17.29  -1.68   25.30  
1 1 1 -7  -2  14 o 15 225.47  23.11  1497.54   294.96   1632.97  417.82   1362.99   416.45   232.94  32.10  211.34  35.59  21.60   47.93  
1 1 1 -7  -2  15 o 5  119.60  14.18  419.02    95.49    284.40   127.51   590.96    144.11   96.77   23.24  141.59  18.15  -44.82  29.49  
1 1 1 -7  -2  16 o 16 201.05  18.11  1181.50   206.83   1154.09  269.80   1220.55   322.11   197.26  24.34  201.76  28.61  -4.50   37.57  
1 1 1 -7  -2  17 o 10 829.95  68.63  22762.95  3240.58  23827.60 3971.47  20641.93  5605.58  820.58  85.56  636.48  154.90 184.10  176.96 
1 1 1 -7  -2  18 o 11 207.95  22.70  1278.35   266.56   1083.51  378.15   1470.79   375.81   187.00  36.54  220.84  30.45  -33.84  47.56  
1 1 1 -7  -2  19 o 14 286.63  31.11  2491.89   503.77   2491.89  503.77   0.00      0.00     286.63  31.11  ?       ?      0.00    31.11  
1 1 1 -7  -2  20 o 14 282.54  29.07  2429.51   464.73   2429.51  464.73   0.00      0.00     282.54  29.07  ?       ?      0.00    29.07  
1 1 1 -7  -2  21 o 10 59.36   18.64  102.84    70.75    102.84   70.75    0.00      0.00     59.36   18.64  ?       ?      0.00    18.64  
1 1 1 -7  -2  22 o 7  113.78  33.78  417.88    236.65   417.88   236.65   0.00      0.00     113.78  33.78  ?       ?      0.00    33.78  
1 1 1 -7  -2  23 o 5  229.33  39.53  1781.89   501.59   1781.89  501.59   0.00      0.00     229.33  39.53  ?       ?      0.00    39.53  
1 1 1 -7  -2  24 o 18 115.06  20.56  409.47    130.80   409.47   130.80   0.00      0.00     115.06  20.56  ?       ?      0.00    20.56  
1 1 1 -7  -2  25 o 11 97.91   17.09  293.60    92.57    293.60   92.57    0.00      0.00     97.91   17.09  ?       ?      0.00    17.09  
1 1 1 -7  -2  26 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  -2  27 o 14 54.89   18.61  87.91     69.89    87.91    69.89    0.00      0.00     54.89   18.61  ?       ?      0.00    18.61  
1 1 1 -7  -1  1  o 2  596.33  74.45  12657.39  2493.29  12617.16 3526.09  12697.62  3526.00  518.70  120.69 521.32  120.27 -2.62   170.39 
1 1 1 -7  -1  2  x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  -1  3  o 10 160.11  24.23  769.52    215.73   0.00     0.00     769.52    215.73   ?       ?      160.11  24.23  0.00    24.23  
1 1 1 -7  -1  4  o 4  405.43  44.41  5149.05   1016.80  5030.40  1438.02  5267.69   1437.93  380.44  68.36  391.38  66.37  -10.94  95.27  
1 1 1 -7  -1  5  x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  -1  6  o 9  633.65  79.27  14311.14  2820.69  14175.69 3989.10  14446.59  3989.01  547.85  128.99 556.12  127.65 -8.27   181.48 
1 1 1 -7  -1  7  o 5  191.68  19.66  1079.37   213.31   1085.61  301.79   1073.14   301.56   189.89  28.57  188.72  28.74  1.17    40.52  
1 1 1 -7  -1  8  o 15 676.48  83.18  16024.46  3162.38  15674.47 4472.32  16374.45  4472.24  587.12  135.45 607.13  132.08 -20.01  189.19 
1 1 1 -7  -1  9  o 10 459.11  50.16  6514.35   1300.57  5711.86  1839.13  7317.12   1839.45  407.13  81.54  471.97  70.01  -64.84  107.47 
1 1 1 -7  -1  10 o 6  716.61  172.85 25237.06  7027.90  0.00     0.00     25237.06  7027.90  ?       ?      716.61  172.85 0.00    172.85 
1 1 1 -7  -1  11 o 12 400.10  63.78  5080.75   1415.76  0.00     0.00     5080.75   1415.76  ?       ?      400.10  63.78  0.00    63.78  
1 1 1 -7  -1  12 o 5  293.97  45.07  2638.91   736.30   0.00     0.00     2638.91   736.30   ?       ?      293.97  45.07  0.00    45.07  
1 1 1 -7  -1  13 o 18 204.36  30.87  1251.09   350.90   0.00     0.00     1251.09   350.90   ?       ?      204.36  30.87  0.00    30.87  
1 1 1 -7  -1  14 o 6  202.55  30.78  1234.60   346.62   0.00     0.00     1234.60   346.62   ?       ?      202.55  30.78  0.00    30.78  
1 1 1 -7  -1  15 o 6  372.06  62.98  4581.15   1297.24  4581.15  1297.24  0.00      0.00     372.06  62.98  ?       ?      0.00    62.98  
1 1 1 -7  -1  16 o 13 305.25  30.11  2782.60   520.71   3240.88  779.19   2412.77   699.96   323.51  43.02  277.25  45.56  46.26   62.66  
1 1 1 -7  -1  17 o 1  512.12  97.85  9950.46   2771.87  0.00     0.00     9950.46   2771.87  ?       ?      512.12  97.85  0.00    97.85  
1 1 1 -7  -1  18 o 13 321.19  51.58  3290.20   918.90   0.00     0.00     3290.20   918.90   ?       ?      321.19  51.58  0.00    51.58  
1 1 1 -7  -1  19 o 7  376.06  67.66  4952.14   1406.85  4952.14  1406.85  0.00      0.00     376.06  67.66  ?       ?      0.00    67.66  
1 1 1 -7  -1  20 o 6  167.09  36.28  890.59    338.03   890.59   338.03   0.00      0.00     167.09  36.28  ?       ?      0.00    36.28  
1 1 1 -7  -1  21 o 10 263.64  27.96  2122.86   416.68   2122.86  416.68   0.00      0.00     263.64  27.96  ?       ?      0.00    27.96  
1 1 1 -7  -1  22 o 15 87.52   16.90  232.26    81.84    232.26   81.84    0.00      0.00     87.52   16.90  ?       ?      0.00    16.90  
1 1 1 -7  -1  23 f 0  176.98  29.09  995.58    285.28   995.58   285.28   0.00      0.00     176.98  29.09  ?       ?      0.00    29.09  
1 1 1 -7  -1  24 o 13 153.22  17.47  706.69    150.92   706.69   150.92   0.00      0.00     153.22  17.47  ?       ?      0.00    17.47  
1 1 1 -7  -1  25 o 10 180.37  17.87  983.80    182.62   983.80   182.62   0.00      0.00     180.37  17.87  ?       ?      0.00    17.87  
1 1 1 -7  -1  26 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  -1  27 o 17 76.14   17.13  182.17    73.07    182.17   73.07    0.00      0.00     76.14   17.13  ?       ?      0.00    17.13  
1 1 1 -7  0   1  o 2  99.83   10.50  290.56    59.30    284.63   84.32    296.36    83.42    97.91   15.52  100.06  14.98  -2.14   21.57  
1 1 1 -7  0   2  x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  0   3  o 12 528.99  62.24  9423.99   1854.04  9566.27  2622.08  9281.72   2621.94  485.35  97.50  475.02  99.35  10.34   139.20 
1 1 1 -7  0   4  o 14 187.30  28.57  1062.99   297.45   1062.99  297.45   0.00      0.00     187.30  28.57  ?       ?      0.00    28.57  
1 1 1 -7  0   5  o 19 197.06  20.30  1144.96   226.36   1143.16  320.23   1146.75   320.00   194.07  29.69  194.41  29.61  -0.34   41.93  
1 1 1 -7  0   6  o 3  537.43  123.94 13449.99  3745.83  0.00     0.00     13449.99  3745.83  ?       ?      537.43  123.94 0.00    123.94 
1 1 1 -7  0   7  o 14 119.54  18.06  424.07    120.08   0.00     0.00     424.07    120.08   ?       ?      119.54  18.06  0.00    18.06  
1 1 1 -7  0   8  o 14 477.66  87.66  8312.27   2315.24  0.00     0.00     8312.27   2315.24  ?       ?      477.66  87.66  0.00    87.66  
1 1 1 -7  0   9  o 6  411.41  68.60  5610.14   1563.05  0.00     0.00     5610.14   1563.05  ?       ?      411.41  68.60  0.00    68.60  
1 1 1 -7  0   10 o 1  315.16  49.05  3079.05   858.64   0.00     0.00     3079.05   858.64   ?       ?      315.16  49.05  0.00    49.05  
1 1 1 -7  0   11 o 9  137.62  14.56  552.26    113.30   544.55   161.68   559.69    158.81   135.42  21.52  137.48  20.77  -2.06   29.91  
1 1 1 -7  0   12 o 6  637.31  124.13 15719.99  4377.91  0.00     0.00     15719.99  4377.91  ?       ?      637.31  124.13 0.00    124.13 
1 1 1 -7  0   13 o 15 503.07  54.51  7837.86   1549.10  7629.98  2190.90  8045.69   2190.61  474.46  83.48  489.82  80.71  -15.36  116.12 
1 1 1 -7  0   14 o 16 441.00  47.52  5991.29   1184.14  5852.48  1674.79  6130.05   1674.45  418.16  72.39  429.83  70.29  -11.67  100.90 
1 1 1 -7  0   15 o 2  289.13  30.18  2497.51   493.53   2485.17  698.38   2509.82   697.53   282.15  44.60  283.74  44.27  -1.58   62.84  
1 1 1 -7  0   16 o 4  305.26  22.62  2738.99   393.63   2960.32  488.75   2330.41   664.07   315.79  27.23  272.72  43.91  43.07   51.66  
1 1 1 -7  0   17 o 17 216.62  19.41  1374.71   238.76   1397.78  306.30   1338.99   381.18   217.01  25.05  209.96  32.69  7.05    41.18  
1 1 1 -7  0   18 o 8  239.56  34.35  1745.13   458.87   1682.03  649.43   1808.05   648.44   228.15  50.88  237.53  49.18  -9.38   70.76  
1 1 1 -7  0   19 o 4  169.43  20.89  851.30    198.87   851.30   198.87   0.00      0.00     169.43  20.89  ?       ?      0.00    20.89  
1 1 1 -7  0   20 o 3  382.84  37.26  4572.33   808.55   4572.33  808.55   0.00      0.00     382.84  37.26  ?       ?      0.00    37.26  
1 1 1 -7  0   21 o 16 98.22   18.77  292.64    101.99   292.64   101.99   0.00      0.00     98.22   18.77  ?       ?      0.00    18.77  
1 1 1 -7  0   22 f 0  201.65  19.24  1212.98   220.00   1212.98  220.00   0.00      0.00     201.65  19.24  ?       ?      0.00    19.24  
1 1 1 -7  0   23 o 14 95.97   26.16  292.44    148.01   292.44   148.01   0.00      0.00     95.97   26.16  ?       ?      0.00    26.16  
1 1 1 -7  0   24 f 0  89.87   24.27  257.26    128.09   257.26   128.09   0.00      0.00     89.87   24.27  ?       ?      0.00    24.27  
1 1 1 -7  0   25 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  0   26 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  0   27 o 15 58.94   21.81  93.46     97.81    93.46    97.81    0.00      0.00     58.94   21.81  ?       ?      0.00    21.81  
1 1 1 -7  0   28 o 6  187.34  19.51  1102.58   206.74   1102.58  206.74   0.00      0.00     187.34  19.51  ?       ?      0.00    19.51  
1 1 1 -7  1   1  o 15 78.41   12.74  182.17    55.38    182.17   55.38    0.00      0.00     78.41   12.74  ?       ?      0.00    12.74  
1 1 1 -7  1   2  o 11 232.84  36.16  1675.44   467.63   0.00     0.00     1675.44   467.63   ?       ?      232.84  36.16  0.00    36.16  
1 1 1 -7  1   3  o 9  136.25  14.03  542.94    108.15   546.75   153.09   539.15    152.81   135.39  20.32  134.40  20.45  0.99    28.83  
1 1 1 -7  1   4  o 3  390.41  42.56  4760.85   938.43   4722.19  1327.19  4799.51   1327.10  370.44  64.77  374.14  64.09  -3.70   91.12  
1 1 1 -7  1   5  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  1   6  o 3  385.65  66.65  5104.92   1422.24  0.00     0.00     5104.92   1422.24  ?       ?      385.65  66.65  0.00    66.65  
1 1 1 -7  1   7  o 6  493.97  98.13  9638.95   2684.65  0.00     0.00     9638.95   2684.65  ?       ?      493.97  98.13  0.00    98.13  
1 1 1 -7  1   8  o 16 89.18   14.63  235.83    72.30    0.00     0.00     235.83    72.30    ?       ?      89.18   14.63  0.00    14.63  
1 1 1 -7  1   9  o 13 161.31  16.52  760.80    150.80   818.93   213.42   702.82    213.12   166.08  23.00  153.13  25.11  12.95   34.05  
1 1 1 -7  1   10 o 8  719.64  86.93  17904.74  3518.72  18189.87 4976.30  17619.62  4976.15  648.77  137.87 633.46  140.52 15.32   196.86 
1 1 1 -7  1   11 o 9  414.06  43.36  5186.16   1015.30  5410.81  1436.04  4961.63   1435.67  412.20  62.66  392.32  66.09  19.88   91.07  
1 1 1 -7  1   12 o 19 285.52  29.51  2409.54   476.71   2375.55  674.31   2443.51   674.03   278.89  43.54  283.21  42.79  -4.32   61.05  
1 1 1 -7  1   13 o 15 86.57   15.68  222.97    75.07    222.97   75.07    0.00      0.00     86.57   15.68  ?       ?      0.00    15.68  
1 1 1 -7  1   14 o 10 376.50  61.11  4574.93   1275.51  4574.93  1275.51  0.00      0.00     376.50  61.11  ?       ?      0.00    61.11  
1 1 1 -7  1   15 o 2  114.59  18.81  391.08    119.47   391.08   119.47   0.00      0.00     114.59  18.81  ?       ?      0.00    18.81  
1 1 1 -7  1   16 o 18 347.84  57.56  3976.69   1109.23  3976.69  1109.23  0.00      0.00     347.84  57.56  ?       ?      0.00    57.56  
1 1 1 -7  1   17 o 4  204.43  31.57  1268.57   358.58   1268.57  358.58   0.00      0.00     204.43  31.57  ?       ?      0.00    31.57  
1 1 1 -7  1   18 o 3  246.23  38.42  1869.01   525.32   1869.01  525.32   0.00      0.00     246.23  38.42  ?       ?      0.00    38.42  
1 1 1 -7  1   19 o 7  90.25   18.15  245.29    90.79    245.29   90.79    0.00      0.00     90.25   18.15  ?       ?      0.00    18.15  
1 1 1 -7  1   20 o 17 300.72  50.74  3023.96   844.89   3023.96  844.89   0.00      0.00     300.72  50.74  ?       ?      0.00    50.74  
1 1 1 -7  1   21 o 16 279.21  47.90  2647.03   740.12   2647.03  740.12   0.00      0.00     279.21  47.90  ?       ?      0.00    47.90  
1 1 1 -7  1   22 o 16 85.98   17.74  225.41    84.67    225.41   84.67    0.00      0.00     85.98   17.74  ?       ?      0.00    17.74  
1 1 1 -7  1   23 o 15 98.89   18.51  299.19    101.22   299.19   101.22   0.00      0.00     98.89   18.51  ?       ?      0.00    18.51  
1 1 1 -7  1   24 f 0  215.63  23.28  1439.79   283.58   1439.79  283.58   0.00      0.00     215.63  23.28  ?       ?      0.00    23.28  
1 1 1 -7  1   25 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  1   26 o 7  143.79  15.96  626.06    129.54   626.06   129.54   0.00      0.00     143.79  15.96  ?       ?      0.00    15.96  
1 1 1 -7  1   27 o 7  120.61  13.66  438.44    92.90    438.44   92.90    0.00      0.00     120.61  13.66  ?       ?      0.00    13.66  
1 1 1 -7  1   28 o 17 72.49   12.11  159.84    48.61    159.84   48.61    0.00      0.00     72.49   12.11  ?       ?      0.00    12.11  
1 1 1 -7  2   1  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  2   2  o 3  77.70   8.74   176.03    38.32    172.31   55.02    179.55    53.41    76.15   13.06  77.89   12.36  -1.75   17.98  
1 1 1 -7  2   3  o 16 292.67  30.80  2585.72   509.71   2599.84  720.91   2571.59   720.79   285.64  45.49  283.88  45.79  1.76    64.54  
1 1 1 -7  2   4  o 16 62.97   7.61   115.74    26.96    108.93   38.75    122.13    37.54    60.43   11.59  64.25   10.54  -3.82   15.67  
1 1 1 -7  2   5  o 5  382.36  66.47  5046.46   1406.01  0.00     0.00     5046.46   1406.01  ?       ?      382.36  66.47  0.00    66.47  
1 1 1 -7  2   6  o 16 172.72  26.16  897.95    251.26   0.00     0.00     897.95    251.26   ?       ?      172.72  26.16  0.00    26.16  
1 1 1 -7  2   7  o 10 131.05  19.73  510.84    143.83   0.00     0.00     510.84    143.83   ?       ?      131.05  19.73  0.00    19.73  
1 1 1 -7  2   8  o 19 161.19  16.65  760.64    151.85   772.65   214.77   748.63    214.72   160.82  24.00  158.14  24.44  2.68    34.25  
1 1 1 -7  2   9  o 14 543.71  61.32  9535.84   1880.75  9393.25  2659.79  9678.43   2659.77  503.12  95.58  513.06  93.76  -9.94   133.89 
1 1 1 -7  2   10 o 14 303.43  31.35  2737.73   538.31   2803.89  761.41   2671.61   761.15   301.65  45.37  293.74  46.70  7.91    65.11  
1 1 1 -7  2   11 o 6  126.01  19.36  470.22    135.60   470.22   135.60   0.00      0.00     126.01  19.36  ?       ?      0.00    19.36  
1 1 1 -7  2   12 o 3  108.50  17.07  348.26    102.83   348.26   102.83   0.00      0.00     108.50  17.07  ?       ?      0.00    17.07  
1 1 1 -7  2   13 o 13 482.00  82.57  7906.53   2202.45  7906.53  2202.45  0.00      0.00     482.00  82.57  ?       ?      0.00    82.57  
1 1 1 -7  2   14 o 5  278.53  28.77  2303.50   453.46   2331.36  641.48   2275.68   641.10   275.30  41.91  271.69  42.50  3.62    59.69  
1 1 1 -7  2   15 f 0  32.02   11.21  26.11     25.40    51.60    41.46    10.80     32.14    43.32   14.33  29.89   12.09  13.43   18.75  
1 1 1 -7  2   16 o 15 302.07  32.94  2760.29   561.91   2459.65  794.92   3060.53   794.39   274.76  52.31  311.26  45.83  -36.50  69.54  
1 1 1 -7  2   17 f 0  84.18   11.11  207.85    52.38    200.43   71.81    216.30    76.57    81.81   15.86  84.99   16.29  -3.18   22.73  
1 1 1 -7  2   18 o 8  611.62  30.60  11142.53  1071.14  18514.04 1532.33  4098.40   1497.91  785.41  34.07  335.34  79.10  450.07  86.12  
1 1 1 -7  2   19 o 14 228.42  23.57  1549.34   304.59   1549.34  304.59   0.00      0.00     228.42  23.57  ?       ?      0.00    23.57  
1 1 1 -7  2   20 o 3  174.89  21.09  913.01    207.46   913.01   207.46   0.00      0.00     174.89  21.09  ?       ?      0.00    21.09  
1 1 1 -7  2   21 o 5  139.92  14.78  577.18    116.89   577.18   116.89   0.00      0.00     139.92  14.78  ?       ?      0.00    14.78  
1 1 1 -7  2   22 o 11 41.97   15.95  37.21     53.04    37.21    53.04    0.00      0.00     41.97   15.95  ?       ?      0.00    15.95  
1 1 1 -7  2   23 o 14 227.97  24.23  1601.26   312.30   1601.26  312.30   0.00      0.00     227.97  24.23  ?       ?      0.00    24.23  
1 1 1 -7  2   24 o 6  172.44  28.95  965.98    276.47   965.98   276.47   0.00      0.00     172.44  28.95  ?       ?      0.00    28.95  
1 1 1 -7  2   25 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  2   26 f 0  103.41  11.70  318.24    68.24    318.24   68.24    0.00      0.00     103.41  11.70  ?       ?      0.00    11.70  
1 1 1 -7  2   27 o 14 166.67  29.96  965.43    276.15   965.43   276.15   0.00      0.00     166.67  29.96  ?       ?      0.00    29.96  
1 1 1 -7  2   28 o 18 81.77   18.06  214.50    82.51    214.50   82.51    0.00      0.00     81.77   18.06  ?       ?      0.00    18.06  
1 1 1 -7  3   1  o 6  180.96  27.59  991.06    277.60   0.00     0.00     991.06    277.60   ?       ?      180.96  27.59  0.00    27.59  
1 1 1 -7  3   2  o 3  52.86   7.50   81.98     22.11    66.26    32.36    95.75     30.28    47.00   11.97  56.87   9.62   -9.87   15.35  
1 1 1 -7  3   3  o 8  418.14  76.88  6379.54   1777.42  6379.54  1777.42  0.00      0.00     418.14  76.88  ?       ?      0.00    76.88  
1 1 1 -7  3   4  o 17 371.90  40.12  4280.01   843.00   4318.78  1192.27  4241.26   1192.11  358.58  60.04  354.72  60.72  3.86    85.40  
1 1 1 -7  3   5  o 17 387.31  67.35  5179.72   1443.16  0.00     0.00     5179.72   1443.16  ?       ?      387.31  67.35  0.00    67.35  
1 1 1 -7  3   6  x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  3   7  o 18 189.93  19.62  1060.67   210.81   1012.05  297.76   1109.52   298.49   182.83  29.36  192.07  27.89  -9.24   40.49  
1 1 1 -7  3   8  o 7  169.53  17.46  841.85    167.54   872.95   237.37   810.98    236.50   170.96  24.92  164.40  25.92  6.56    35.95  
1 1 1 -7  3   9  o 1  296.05  46.19  2723.16   759.47   0.00     0.00     2723.16   759.47   ?       ?      296.05  46.19  0.00    46.19  
1 1 1 -7  3   10 o 5  508.59  90.09  9097.46   2534.08  9097.46  2534.08  0.00      0.00     508.59  90.09  ?       ?      0.00    90.09  
1 1 1 -7  3   11 o 19 503.43  87.40  8739.44   2434.38  8739.44  2434.38  0.00      0.00     503.43  87.40  ?       ?      0.00    87.40  
1 1 1 -7  3   12 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  3   13 o 11 314.35  49.11  3073.84   857.19   3073.84  857.19   0.00      0.00     314.35  49.11  ?       ?      0.00    49.11  
1 1 1 -7  3   14 o 1  318.61  33.44  3047.53   602.56   3005.56  852.31   3089.47   851.97   308.53  49.82  313.36  48.96  -4.82   69.85  
1 1 1 -7  3   15 o 12 113.04  17.80  379.88    111.69   0.00     0.00     379.88    111.69   ?       ?      113.04  17.80  0.00    17.80  
1 1 1 -7  3   16 o 15 166.68  17.67  816.45    166.47   753.33   235.90   879.05    234.95   157.59  27.05  171.24  24.61  -13.65  36.57  
1 1 1 -7  3   17 o 10 403.66  45.87  5110.95   1044.02  4589.54  1476.59  5632.18   1476.35  359.27  74.06  407.44  65.33  -48.18  98.75  
1 1 1 -7  3   18 o 11 365.09  42.59  4144.52   875.90   3549.00  1238.88  4739.71   1238.53  317.94  69.79  378.33  58.95  -60.39  91.36  
1 1 1 -7  3   19 o 1  228.14  35.66  1614.63   451.80   1614.63  451.80   0.00      0.00     228.14  35.66  ?       ?      0.00    35.66  
1 1 1 -7  3   20 o 16 228.68  36.55  1657.85   463.67   1657.85  463.67   0.00      0.00     228.68  36.55  ?       ?      0.00    36.55  
1 1 1 -7  3   21 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  3   22 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  3   23 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  3   24 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  3   25 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  3   26 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  3   27 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  3   28 o 4  77.58   16.43  191.16    70.90    191.16   70.90    0.00      0.00     77.58   16.43  ?       ?      0.00    16.43  
1 1 1 -7  4   1  o 2  185.08  28.25  1036.65   290.61   0.00     0.00     1036.65   290.61   ?       ?      185.08  28.25  0.00    28.25  
1 1 1 -7  4   2  o 16 275.05  28.78  2268.27   447.68   2254.65  633.18   2281.88   633.06   267.74  42.62  269.55  42.30  -1.81   60.05  
1 1 1 -7  4   3  o 4  144.09  21.91  620.60    175.51   620.60   175.51   0.00      0.00     144.09  21.91  ?       ?      0.00    21.91  
1 1 1 -7  4   4  o 12 122.12  12.71  435.40    87.82    443.02   124.77   427.92    123.64   122.11  18.37  119.92  18.56  2.18    26.11  
1 1 1 -7  4   5  f 0  444.11  81.72  7203.64   2006.76  0.00     0.00     7203.64   2006.76  ?       ?      444.11  81.72  0.00    81.72  
1 1 1 -7  4   6  o 1  330.35  53.58  3520.58   981.28   0.00     0.00     3520.58   981.28   ?       ?      330.35  53.58  0.00    53.58  
1 1 1 -7  4   7  o 11 502.54  96.27  9608.16   2676.28  0.00     0.00     9608.16   2676.28  ?       ?      502.54  96.27  0.00    96.27  
1 1 1 -7  4   8  o 3  397.83  42.34  4834.96   952.18   4894.71  1346.63  4775.22   1346.53  387.19  62.73  381.66  63.70  5.53    89.40  
1 1 1 -7  4   9  o 15 556.31  61.96  9891.51   1945.20  10311.93 2750.98  9471.12   2750.87  537.05  92.57  508.53  97.78  28.52   134.65 
1 1 1 -7  4   10 o 12 178.69  26.92  952.84    267.55   952.84   267.55   0.00      0.00     178.69  26.92  ?       ?      0.00    26.92  
1 1 1 -7  4   11 o 4  544.96  98.77  10685.41  2976.08  10685.41 2976.08  0.00      0.00     544.96  98.77  ?       ?      0.00    98.77  
1 1 1 -7  4   12 o 8  200.84  30.32  1209.56   338.67   1209.56  338.67   0.00      0.00     200.84  30.32  ?       ?      0.00    30.32  
1 1 1 -7  4   13 o 15 254.56  39.08  1981.02   552.89   1981.02  552.89   0.00      0.00     254.56  39.08  ?       ?      0.00    39.08  
1 1 1 -7  4   14 o 13 79.74   9.46   185.64    42.46    182.34   58.93    189.20    61.24    78.34   13.60  79.79   13.87  -1.45   19.43  
1 1 1 -7  4   15 o 6  234.58  36.42  1698.60   474.57   0.00     0.00     1698.60   474.57   ?       ?      234.58  36.42  0.00    36.42  
1 1 1 -7  4   16 o 1  139.20  21.45  579.50    165.93   0.00     0.00     579.50    165.93   ?       ?      139.20  21.45  0.00    21.45  
1 1 1 -7  4   17 o 18 332.83  54.75  3623.65   1009.80  0.00     0.00     3623.65   1009.80  ?       ?      332.83  54.75  0.00    54.75  
1 1 1 -7  4   18 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  4   19 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  4   20 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  4   21 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  4   22 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  4   23 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  4   24 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  4   25 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  4   26 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  4   27 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  4   28 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  5   1  o 14 336.61  55.09  3686.23   1027.81  0.00     0.00     3686.23   1027.81  ?       ?      336.61  55.09  0.00    55.09  
1 1 1 -7  5   2  o 2  357.40  59.42  4220.35   1176.40  0.00     0.00     4220.35   1176.40  ?       ?      357.40  59.42  0.00    59.42  
1 1 1 -7  5   3  o 11 351.01  57.92  4041.21   1126.49  0.00     0.00     4041.21   1126.49  ?       ?      351.01  57.92  0.00    57.92  
1 1 1 -7  5   4  o 19 531.23  111.38 11804.03  3287.80  0.00     0.00     11804.03  3287.80  ?       ?      531.23  111.38 0.00    111.38 
1 1 1 -7  5   5  o 16 223.29  34.19  1518.21   424.27   0.00     0.00     1518.21   424.27   ?       ?      223.29  34.19  0.00    34.19  
1 1 1 -7  5   6  o 14 343.51  55.43  3787.10   1055.93  0.00     0.00     3787.10   1055.93  ?       ?      343.51  55.43  0.00    55.43  
1 1 1 -7  5   7  o 3  164.29  24.93  805.69    227.73   0.00     0.00     805.69    227.73   ?       ?      164.29  24.93  0.00    24.93  
1 1 1 -7  5   8  f 0  399.85  42.34  4856.66   957.18   4784.33  1353.56  4929.01   1353.77  384.30  63.57  390.95  62.42  -6.64   89.09  
1 1 1 -7  5   9  o 9  502.44  54.60  7868.40   1549.64  8113.22  2191.49  7623.56   2191.55  488.74  80.94  470.58  84.22  18.17   116.81 
1 1 1 -7  5   10 o 7  288.87  29.88  2472.57   488.39   2249.54  690.54   2695.80   690.84   269.63  46.28  297.64  41.56  -28.01  62.20  
1 1 1 -7  5   11 o 1  667.46  155.35 20972.00  5840.29  20972.00 5840.29  0.00      0.00     667.46  155.35 ?       ?      0.00    155.35 
1 1 1 -7  5   12 o 12 418.26  69.82  5805.42   1617.39  5805.42  1617.39  0.00      0.00     418.26  69.82  ?       ?      0.00    69.82  
1 1 1 -7  5   13 f 0  298.71  31.19  2672.15   526.92   2710.10  745.10   2634.19   745.25   294.24  45.58  289.60  46.39  4.64    65.04  
1 1 1 -7  5   14 o 13 172.52  17.81  874.06    173.84   999.26   245.71   748.58    245.99   183.03  23.96  156.77  28.38  26.26   37.14  
1 1 1 -7  5   15 o 1  120.11  18.96  430.39    126.42   0.00     0.00     430.39    126.42   ?       ?      120.11  18.96  0.00    18.96  
1 1 1 -7  5   16 o 3  156.66  16.26  719.80    144.14   711.34   203.17   728.37    204.54   153.91  23.76  155.82  23.60  -1.91   33.49  
1 1 1 -7  5   17 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  5   18 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  5   19 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  5   20 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  5   21 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  5   22 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  5   23 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  5   24 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  5   25 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  5   26 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  5   27 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  5   28 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  6   1  o 13 212.06  21.91  1323.65   262.88   1207.70  371.86   1439.48   371.67   199.11  33.74  218.87  30.40  -19.76  45.41  
1 1 1 -7  6   2  o 8  692.05  86.49  17072.83  3361.22  17418.71 4753.54  16726.97  4753.43  612.40  138.47 593.07  141.58 19.33   198.04 
1 1 1 -7  6   3  f 0  353.65  57.19  4022.09   1121.45  0.00     0.00     4022.09   1121.45  ?       ?      353.65  57.19  0.00    57.19  
1 1 1 -7  6   4  o 19 518.59  57.57  8554.13   1684.93  8627.64  2382.91  8480.62   2382.80  491.66  87.64  486.32  88.61  5.33    124.63 
1 1 1 -7  6   5  f 0  612.51  133.31 16350.62  4553.84  0.00     0.00     16350.62  4553.84  ?       ?      612.51  133.31 0.00    133.31 
1 1 1 -7  6   6  o 7  468.37  50.57  6791.98   1338.10  6858.70  1892.33  6725.27   1892.38  451.66  75.66  446.36  76.61  5.29    107.67 
1 1 1 -7  6   7  o 7  408.73  66.97  5442.87   1516.93  0.00     0.00     5442.87   1516.93  ?       ?      408.73  66.97  0.00    66.97  
1 1 1 -7  6   8  o 2  401.87  65.31  5220.63   1454.99  0.00     0.00     5220.63   1454.99  ?       ?      401.87  65.31  0.00    65.31  
1 1 1 -7  6   9  o 9  812.53  105.08 24307.22  4786.84  24938.24 6769.62  23676.20  6769.60  705.33  169.34 675.48  173.63 29.85   242.53 
1 1 1 -7  6   10 o 18 415.12  44.07  5247.27   1034.26  5338.22  1462.67  5156.32   1462.67  405.90  64.96  397.84  66.38  8.06    92.88  
1 1 1 -7  6   11 o 10 138.24  21.07  567.72    161.90   567.72   161.90   0.00      0.00     138.24  21.07  ?       ?      0.00    21.07  
1 1 1 -7  6   12 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  6   13 o 11 247.18  25.74  1818.25   359.92   1886.20  508.83   1750.21   509.17   247.37  36.96  237.36  38.70  10.01   53.52  
1 1 1 -7  6   14 o 19 459.41  52.49  6860.80   1359.47  7489.21  1922.62  6232.44   1922.55  452.54  76.75  400.63  86.16  51.91   115.38 
1 1 1 -7  6   15 o 2  214.32  22.43  1361.75   271.89   1462.37  385.43   1262.10   383.58   218.93  31.58  202.06  34.29  16.88   46.62  
1 1 1 -7  6   16 o 8  308.93  32.69  2892.34   570.97   3311.01  808.20   2475.17   806.74   323.78  44.67  274.13  53.18  49.65   69.46  
1 1 1 -7  6   17 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  6   18 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  6   19 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  6   20 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  6   21 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  6   22 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  6   23 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  6   24 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  6   25 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  6   26 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  6   27 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  7   1  o 2  651.82  140.42 18308.00  5099.24  18308.00 5099.24  0.00      0.00     651.82  140.42 ?       ?      0.00    140.42 
1 1 1 -7  7   2  o 11 761.50  94.07  20442.22  4024.99  20152.10 5692.18  20732.35  5692.21  661.43  152.96 676.18  150.52 -14.74  214.60 
1 1 1 -7  7   3  o 4  616.50  69.98  12346.99  2432.74  12643.98 3440.47  12050.02  3440.37  582.56  106.81 564.26  110.16 18.30   153.44 
1 1 1 -7  7   4  o 3  235.81  24.27  1635.90   323.81   1669.36  458.18   1602.50   457.69   235.27  34.99  230.17  35.80  5.11    50.06  
1 1 1 -7  7   5  o 3  432.98  71.58  6160.96   1716.99  6160.96  1716.99  0.00      0.00     432.98  71.58  ?       ?      0.00    71.58  
1 1 1 -7  7   6  o 6  228.96  34.78  1580.92   442.80   1580.92  442.80   0.00      0.00     228.96  34.78  ?       ?      0.00    34.78  
1 1 1 -7  7   7  o 14 234.69  35.74  1664.53   466.34   0.00     0.00     1664.53   466.34   ?       ?      234.69  35.74  0.00    35.74  
1 1 1 -7  7   8  o 13 493.29  53.49  7566.60   1490.64  7495.58  2108.06  7637.61   2108.09  469.00  81.24  474.36  80.28  -5.36   114.21 
1 1 1 -7  7   9  x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  7   10 o 16 256.79  39.66  2023.81   565.85   0.00     0.00     2023.81   565.85   ?       ?      256.79  39.66  0.00    39.66  
1 1 1 -7  7   11 o 8  509.25  101.92 10322.43  2875.36  0.00     0.00     10322.43  2875.36  ?       ?      509.25  101.92 0.00    101.92 
1 1 1 -7  7   12 o 2  426.71  47.31  5761.23   1139.47  6305.73  1611.70  5217.05   1611.22  427.01  68.03  379.15  76.66  47.86   102.50 
1 1 1 -7  7   13 o 17 181.02  28.33  995.51    284.74   995.51   284.74   0.00      0.00     181.02  28.33  ?       ?      0.00    28.33  
1 1 1 -7  7   14 o 13 407.84  74.97  6063.90   1690.59  6063.90  1690.59  0.00      0.00     407.84  74.97  ?       ?      0.00    74.97  
1 1 1 -7  7   15 o 4  473.37  53.68  7300.83   1432.99  8111.84  2027.13  6490.72   2025.99  471.09  77.66  406.06  89.34  65.02   118.38 
1 1 1 -7  7   16 o 9  180.53  18.14  958.67    185.43   1689.58  273.70   338.56    252.10   239.62  20.08  107.12  35.33  132.49  40.64  
1 1 1 -7  7   17 o 9  240.99  38.26  1831.59   511.60   0.00     0.00     1831.59   511.60   ?       ?      240.99  38.26  0.00    38.26  
1 1 1 -7  7   18 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  7   19 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  7   20 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  7   21 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  7   22 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  7   23 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  7   24 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  7   25 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  7   26 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  7   27 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  8   1  o 8  271.49  41.58  2242.89   627.49   2242.89  627.49   0.00      0.00     271.49  41.58  ?       ?      0.00    41.58  
1 1 1 -7  8   2  o 14 327.25  51.03  3321.61   927.33   3321.61  927.33   0.00      0.00     327.25  51.03  ?       ?      0.00    51.03  
1 1 1 -7  8   3  o 3  191.33  19.78  1071.45   214.10   1111.86  303.12   1031.21   302.44   193.10  28.17  185.53  29.37  7.57    40.70  
1 1 1 -7  8   4  o 15 92.66   11.08  250.65    57.78    284.06   83.17    219.48    80.33    98.06   15.27  85.68   16.93  12.38   22.80  
1 1 1 -7  8   5  o 5  129.63  20.44  498.82    147.07   498.82   147.07   0.00      0.00     129.63  20.44  ?       ?      0.00    20.44  
1 1 1 -7  8   6  o 14 182.63  18.98  976.44    196.13   993.38   276.90   959.39    277.83   182.38  27.29  179.00  27.95  3.38    39.06  
1 1 1 -7  8   7  o 10 282.89  43.92  2467.89   690.16   0.00     0.00     2467.89   690.16   ?       ?      282.89  43.92  0.00    43.92  
1 1 1 -7  8   8  o 9  221.86  23.04  1450.70   289.14   1457.78  409.76   1443.68   408.06   219.29  33.62  218.19  33.66  1.10    47.57  
1 1 1 -7  8   9  x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  8   10 o 8  299.79  48.16  2866.83   800.75   0.00     0.00     2866.83   800.75   ?       ?      299.79  48.16  0.00    48.16  
1 1 1 -7  8   11 o 8  245.04  38.51  1871.04   523.88   0.00     0.00     1871.04   523.88   ?       ?      245.04  38.51  0.00    38.51  
1 1 1 -7  8   12 f 0  556.68  68.39  10878.89  2139.54  11854.41 3026.19  9903.91   3025.34  523.74  104.32 456.18  115.45 67.57   155.60 
1 1 1 -7  8   13 o 13 207.91  21.81  1280.34   256.41   1373.24  365.87   1190.67   359.47   212.26  30.94  196.59  33.02  15.67   45.25  
1 1 1 -7  8   14 o 9  159.77  27.87  777.55    246.30   777.55   246.30   0.00      0.00     159.77  27.87  ?       ?      0.00    27.87  
1 1 1 -7  8   15 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  8   16 o 16 216.64  22.98  1400.23   281.38   1506.80  411.67   1306.78   385.48   220.34  33.61  204.74  33.99  15.59   47.80  
1 1 1 -7  8   17 o 17 219.06  35.18  1524.20   427.40   0.00     0.00     1524.20   427.40   ?       ?      219.06  35.18  0.00    35.18  
1 1 1 -7  8   18 o 12 228.34  22.47  1575.79   290.72   1209.59  530.45   1733.01   347.56   183.05  49.36  237.66  25.89  -54.61  55.74  
1 1 1 -7  8   19 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  8   20 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  8   21 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  8   22 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  8   23 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  8   24 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  8   25 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  8   26 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  8   27 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  9   1  o 19 74.41   12.15  163.63    50.12    198.84   76.05    136.60    66.63    81.45   16.82  67.44   17.17  14.01   24.04  
1 1 1 -7  9   2  o 15 282.44  43.77  2455.58   686.74   0.00     0.00     2455.58   686.74   ?       ?      282.44  43.77  0.00    43.77  
1 1 1 -7  9   3  o 7  149.21  23.24  663.45    192.56   663.45   192.56   0.00      0.00     149.21  23.24  ?       ?      0.00    23.24  
1 1 1 -7  9   4  o 1  268.83  41.69  2224.09   622.55   2224.09  622.55   0.00      0.00     268.83  41.69  ?       ?      0.00    41.69  
1 1 1 -7  9   5  o 1  183.35  28.08  1010.15   286.18   0.00     0.00     1010.15   286.18   ?       ?      183.35  28.08  0.00    28.08  
1 1 1 -7  9   6  o 11 431.51  46.92  5799.66   1143.68  5957.29  1618.03  5642.28   1616.78  418.92  69.73  405.38  72.12  13.54   100.32 
1 1 1 -7  9   7  f 0  166.55  17.74  814.26    167.04   843.59   241.03   787.15    231.70   167.55  25.89  161.75  25.82  5.80    36.57  
1 1 1 -7  9   8  o 6  514.69  59.41  8759.22   1723.11  9439.37  2437.47  8079.78   2436.22  497.89  88.52  447.48  97.59  50.41   131.76 
1 1 1 -7  9   9  o 8  340.36  36.31  3549.17   698.53   3979.59  989.37   3121.34   986.38   350.84  50.58  304.40  58.57  46.44   77.39  
1 1 1 -7  9   10 f 0  216.10  22.69  1385.71   277.29   1495.48  395.79   1279.89   388.61   221.16  32.11  203.34  34.52  17.81   47.15  
1 1 1 -7  9   11 o 9  466.85  52.74  7093.71   1388.67  7731.13  1964.90  6457.61   1962.84  458.99  77.32  407.25  86.62  51.74   116.11 
1 1 1 -7  9   12 o 6  307.59  50.28  3068.20   857.23   0.00     0.00     3068.20   857.23   ?       ?      307.59  50.28  0.00    50.28  
1 1 1 -7  9   13 o 7  272.95  43.79  2364.86   662.95   0.00     0.00     2364.86   662.95   ?       ?      272.95  43.79  0.00    43.79  
1 1 1 -7  9   14 o 15 169.02  31.32  883.07    292.66   883.07   292.66   0.00      0.00     169.02  31.32  ?       ?      0.00    31.32  
1 1 1 -7  9   15 o 3  47.20   16.81  56.19     57.35    135.56   166.40   45.49     61.09    75.70   28.36  45.68   17.17  30.02   33.15  
1 1 1 -7  9   16 o 15 126.09  33.39  511.53    245.46   511.53   245.46   0.00      0.00     126.09  33.39  ?       ?      0.00    33.39  
1 1 1 -7  9   17 o 5  168.71  35.95  938.75    337.57   938.75   337.57   0.00      0.00     168.71  35.95  ?       ?      0.00    35.95  
1 1 1 -7  9   18 o 5  196.81  16.80  1152.37   188.01   1197.07  402.39   1139.88   212.65   187.69  38.64  194.67  19.28  -6.98   43.18  
1 1 1 -7  9   19 o 13 326.09  30.64  3422.34   566.84   3366.30  1010.26  3448.09   684.78   276.06  64.86  318.14  38.26  -42.08  75.30  
1 1 1 -7  9   20 f 0  145.47  14.90  633.07    122.70   0.00     0.00     633.07    122.70   ?       ?      145.47  14.90  0.00    14.90  
1 1 1 -7  9   21 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  9   22 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  9   23 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  9   24 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  9   25 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  9   26 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  10  1  o 3  236.24  36.75  1713.23   482.18   0.00     0.00     1713.23   482.18   ?       ?      236.24  36.75  0.00    36.75  
1 1 1 -7  10  2  o 3  456.30  50.46  6592.10   1299.76  6882.95  1838.61  6301.54   1837.68  443.32  74.91  419.44  79.22  23.88   109.03 
1 1 1 -7  10  3  o 13 198.41  20.88  1160.55   234.24   1134.70  333.35   1185.78   329.23   193.14  31.12  197.94  29.91  -4.79   43.16  
1 1 1 -7  10  4  f 0  101.78  14.06  305.19    79.95    265.39   123.86   333.61    104.67   93.37   23.21  105.75  17.88  -12.38  29.30  
1 1 1 -7  10  5  o 8  363.34  61.81  4445.53   1243.10  4445.53  1243.10  0.00      0.00     363.34  61.81  ?       ?      0.00    61.81  
1 1 1 -7  10  6  o 11 251.48  40.22  1976.82   561.15   1976.82  561.15   0.00      0.00     251.48  40.22  ?       ?      0.00    40.22  
1 1 1 -7  10  7  o 9  524.76  61.70  9266.29   1823.13  9651.29  2579.07  8881.75   2577.54  490.54  95.02  462.45  100.01 28.09   137.95 
1 1 1 -7  10  8  o 18 476.45  97.92  9289.16   2588.76  0.00     0.00     9289.16   2588.76  ?       ?      476.45  97.92  0.00    97.92  
1 1 1 -7  10  9  o 13 117.97  15.88  410.78    104.83   475.67   166.12   367.85    135.14   125.24  23.98  110.19  22.13  15.05   32.63  
1 1 1 -7  10  10 o 13 41.21   20.15  -296.00   158.29   -296.00  158.29   0.00      0.00     41.21   20.15  ?       ?      0.00    20.15  
1 1 1 -7  10  11 o 9  349.29  34.50  3715.49   682.78   5226.07  971.70   2242.28   959.60   409.45  41.93  251.84  65.70  157.60  77.94  
1 1 1 -7  10  12 o 13 97.96   12.00  281.38    66.08    -562.65  173.27   425.01    71.48    35.51   17.92  120.93  10.40  -85.43  20.72  
1 1 1 -7  10  13 o 18 225.07  25.04  1520.75   318.09   1396.55  463.51   1631.32   437.34   208.75  40.14  229.05  34.32  -20.30  52.81  
1 1 1 -7  10  14 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  10  15 o 3  176.49  28.05  970.25    274.73   0.00     0.00     970.25    274.73   ?       ?      176.49  28.05  0.00    28.05  
1 1 1 -7  10  16 o 8  257.73  28.46  2074.78   414.04   2197.75  608.69   1968.90   564.84   252.65  43.54  239.73  42.60  12.92   60.92  
1 1 1 -7  10  17 o 13 278.80  31.20  2489.79   490.79   2673.70  722.31   2332.05   668.93   271.15  48.17  253.37  47.74  17.79   67.82  
1 1 1 -7  10  18 o 13 197.23  23.46  1207.87   260.42   1375.30  451.34   1124.31   318.85   196.33  41.35  185.17  31.10  11.17   51.74  
1 1 1 -7  10  19 o 13 194.43  23.85  1191.55   260.63   1469.20  482.29   1077.03   309.75   197.19  43.75  179.30  31.23  17.89   53.75  
1 1 1 -7  10  20 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  10  21 o 16 31.55   12.84  12.90     36.55    0.00     0.00     12.90     36.55    ?       ?      31.55   12.84  0.00    12.84  
1 1 1 -7  10  22 o 16 112.00  12.39  377.21    78.30    0.00     0.00     377.21    78.30    ?       ?      112.00  12.39  0.00    12.39  
1 1 1 -7  10  23 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  10  24 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  10  25 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  11  1  o 7  431.70  47.14  5826.20   1149.34  6014.17  1626.61  5638.79   1624.22  419.44  70.02  403.33  72.83  16.11   101.03 
1 1 1 -7  11  2  o 18 115.60  21.00  401.29    134.20   0.00     0.00     401.29    134.20   ?       ?      115.60  21.00  0.00    21.00  
1 1 1 -7  11  3  o 8  523.62  110.73 11569.06  3224.20  0.00     0.00     11569.06  3224.20  ?       ?      523.62  110.73 0.00    110.73 
1 1 1 -7  11  4  o 6  383.15  65.49  4972.76   1388.74  0.00     0.00     4972.76   1388.74  ?       ?      383.15  65.49  0.00    65.49  
1 1 1 -7  11  5  o 12 159.00  25.88  762.00    228.12   0.00     0.00     762.00    228.12   ?       ?      159.00  25.88  0.00    25.88  
1 1 1 -7  11  6  f 0  114.70  21.72  396.66    137.79   0.00     0.00     396.66    137.79   ?       ?      114.70  21.72  0.00    21.72  
1 1 1 -7  11  7  o 13 543.00  133.31 14794.69  4124.16  14794.69 4124.16  0.00      0.00     543.00  133.31 ?       ?      0.00    133.31 
1 1 1 -7  11  8  o 2  357.90  61.45  4323.71   1217.15  4323.71  1217.15  0.00      0.00     357.90  61.45  ?       ?      0.00    61.45  
1 1 1 -7  11  9  o 12 179.22  21.27  952.83    214.53   529.18   323.56   1285.17   286.58   130.32  39.69  207.51  24.53  -77.19  46.66  
1 1 1 -7  11  10 o 8  264.23  29.03  2108.40   433.12   1938.65  621.14   2269.05   604.25   244.60  45.92  268.31  40.49  -23.71  61.22  
1 1 1 -7  11  11 o 18 159.93  18.85  758.78    169.76   973.74   267.43   613.68    219.71   178.79  26.89  140.82  28.16  37.97   38.94  
1 1 1 -7  11  12 o 1  267.74  29.07  2195.07   439.68   2251.11  632.40   2142.63   611.73   261.55  43.66  255.33  43.28  6.22    61.47  
1 1 1 -7  11  13 o 13 274.79  29.26  2335.27   454.46   2598.21  658.07   2095.54   628.36   279.79  42.29  247.97  45.83  31.81   62.36  
1 1 1 -7  11  14 o 10 291.90  32.54  2708.35   536.08   2853.17  776.46   2576.43   741.06   282.97  49.61  268.27  49.96  14.70   70.40  
1 1 1 -7  11  15 f 0  298.73  32.86  2871.20   554.18   3140.70  802.69   2625.74   766.04   294.45  49.22  265.45  52.13  28.99   71.70  
1 1 1 -7  11  16 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  11  17 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  11  18 o 18 148.77  20.62  688.91    171.41   884.64   419.97   649.79    187.75   148.63  45.20  142.68  23.76  5.95    51.07  
1 1 1 -7  11  19 o 2  84.78   11.28  214.69    53.56    123.38   447.23   216.02    53.94    91.91   41.16  85.03   11.33  6.88    42.69  
1 1 1 -7  11  20 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  11  21 o 17 59.28   15.21  110.50    52.01    0.00     0.00     110.50    52.01    ?       ?      59.28   15.21  0.00    15.21  
1 1 1 -7  11  22 o 1  88.78   10.64  236.45    53.14    0.00     0.00     236.45    53.14    ?       ?      88.78   10.64  0.00    10.64  
1 1 1 -7  11  23 o 2  74.05   10.87  166.57    44.82    0.00     0.00     166.57    44.82    ?       ?      74.05   10.87  0.00    10.87  
1 1 1 -7  11  24 o 8  43.26   16.06  50.38     53.10    0.00     0.00     50.38     53.10    ?       ?      43.26   16.06  0.00    16.06  
1 1 1 -7  12  1  o 4  376.72  40.64  4368.19   864.97   4471.11  1226.23  4266.27   1220.30  367.32  60.24  357.53  61.68  9.79    86.22  
1 1 1 -7  12  2  o 16 134.85  24.21  548.92    180.52   0.00     0.00     548.92    180.52   ?       ?      134.85  24.21  0.00    24.21  
1 1 1 -7  12  3  o 16 282.53  45.28  2524.08   709.60   0.00     0.00     2524.08   709.60   ?       ?      282.53  45.28  0.00    45.28  
1 1 1 -7  12  4  x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  12  5  f 0  318.30  52.66  3314.71   928.64   0.00     0.00     3314.71   928.64   ?       ?      318.30  52.66  0.00    52.66  
1 1 1 -7  12  6  f 0  136.76  23.71  565.60    179.42   0.00     0.00     565.60    179.42   ?       ?      136.76  23.71  0.00    23.71  
1 1 1 -7  12  7  o 15 388.74  42.41  4782.08   931.15   5214.59  1322.61  4357.03   1311.16  387.75  61.47  347.05  68.24  40.70   91.84  
1 1 1 -7  12  8  o 4  151.09  18.97  678.57    160.94   685.70   259.50   674.11    205.16   147.89  31.53  148.82  24.89  -0.93   40.17  
1 1 1 -7  12  9  o 8  348.01  65.90  4500.70   1268.30  4500.70  1268.30  0.00      0.00     348.01  65.90  ?       ?      0.00    65.90  
1 1 1 -7  12  10 o 10 382.79  85.15  6503.41   1822.82  6503.41  1822.82  0.00      0.00     382.79  85.15  ?       ?      0.00    85.15  
1 1 1 -7  12  11 o 13 282.58  31.17  2499.48   497.18   2591.58  714.05   2412.80   692.68   274.31  47.04  264.16  47.42  10.16   66.79  
1 1 1 -7  12  12 o 15 312.86  65.03  3955.30   1129.72  3955.30  1129.72  0.00      0.00     312.86  65.03  ?       ?      0.00    65.03  
1 1 1 -7  12  13 o 6  238.00  47.85  2041.68   631.04   2041.68  631.04   0.00      0.00     238.00  47.85  ?       ?      0.00    47.85  
1 1 1 -7  12  14 o 18 289.00  63.93  3563.98   1032.48  3563.98  1032.48  0.00      0.00     289.00  63.93  ?       ?      0.00    63.93  
1 1 1 -7  12  15 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  12  16 o 12 301.86  39.69  3261.80   671.17   3249.85  988.00   3272.05   914.61   255.75  66.63  268.72  60.72  -12.96  90.15  
1 1 1 -7  12  17 o 14 251.33  25.44  2034.40   362.05   0.00     0.00     2034.40   362.05   ?       ?      251.33  25.44  0.00    25.44  
1 1 1 -7  12  18 o 3  93.75   11.38  262.32    59.99    0.00     0.00     262.32    59.99    ?       ?      93.75   11.38  0.00    11.38  
1 1 1 -7  12  19 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  12  20 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  12  21 o 8  87.83   11.78  234.05    57.92    0.00     0.00     234.05    57.92    ?       ?      87.83   11.78  0.00    11.78  
1 1 1 -7  12  22 o 11 114.14  13.22  400.74    85.04    0.00     0.00     400.74    85.04    ?       ?      114.14  13.22  0.00    13.22  
1 1 1 -7  12  23 o 9  38.87   15.52  30.32     52.26    0.00     0.00     30.32     52.26    ?       ?      38.87   15.52  0.00    15.52  
1 1 1 -7  13  1  o 10 139.61  25.11  595.82    193.87   0.00     0.00     595.82    193.87   ?       ?      139.61  25.11  0.00    25.11  
1 1 1 -7  13  2  o 7  290.86  31.59  2596.88   519.05   2661.82  739.47   2533.80   728.74   284.05  46.99  276.54  47.62  7.51    66.90  
1 1 1 -7  13  3  o 18 187.48  21.37  1049.40   225.91   1129.82  336.56   983.45    304.78   190.40  31.92  177.77  30.99  12.63   44.49  
1 1 1 -7  13  4  o 5  259.97  28.03  2057.53   411.73   2345.93  595.99   1794.23   569.46   270.62  39.53  233.16  44.16  37.46   59.27  
1 1 1 -7  13  5  o 8  123.32  22.71  464.59    154.86   0.00     0.00     464.59    154.86   ?       ?      123.32  22.71  0.00    22.71  
1 1 1 -7  13  6  o 10 199.04  37.67  1283.29   414.66   1283.29  414.66   0.00      0.00     199.04  37.67  ?       ?      0.00    37.67  
1 1 1 -7  13  7  o 4  246.03  41.59  2004.02   566.44   0.00     0.00     2004.02   566.44   ?       ?      246.03  41.59  0.00    41.59  
1 1 1 -7  13  8  o 9  123.68  23.23  471.94    158.86   0.00     0.00     471.94    158.86   ?       ?      123.68  23.23  0.00    23.23  
1 1 1 -7  13  9  o 1  205.11  24.51  1287.72   282.85   1129.06  421.12   1418.12   381.78   182.07  41.25  210.63  32.63  -28.56  52.59  
1 1 1 -7  13  10 o 2  252.67  29.84  2011.17   424.44   1853.08  618.12   2152.19   583.83   226.38  48.99  251.35  41.94  -24.96  64.49  
1 1 1 -7  13  11 o 14 246.42  49.81  2237.63   680.34   2237.63  680.34   0.00      0.00     246.42  49.81  ?       ?      0.00    49.81  
1 1 1 -7  13  12 o 3  85.19   35.79  114.21    296.46   114.21   296.46   0.00      0.00     85.19   35.79  ?       ?      0.00    35.79  
1 1 1 -7  13  13 o 11 141.48  41.42  733.51    357.87   733.51   357.87   0.00      0.00     141.48  41.42  ?       ?      0.00    41.42  
1 1 1 -7  13  14 o 19 113.97  22.07  411.33    139.15   0.00     0.00     411.33    139.15   ?       ?      113.97  22.07  0.00    22.07  
1 1 1 -7  13  15 o 16 171.50  25.04  948.73    239.28   755.62   457.58   1021.41   280.73   133.64  47.49  174.96  28.96  -41.32  55.63  
1 1 1 -7  13  16 o 12 72.68   11.75  159.31    47.35    -141.16  438.29   162.86    47.63    80.06   37.58  73.53   11.67  6.53    39.35  
1 1 1 -7  13  17 o 15 128.40  12.73  494.10    92.61    726.34   503.96   485.98    94.22    123.54  48.55  127.18  13.09  -3.64   50.29  
1 1 1 -7  13  18 o 14 140.95  13.78  601.43    110.07   965.97   607.36   589.05    111.92   129.04  52.42  139.26  14.20  -10.21  54.31  
1 1 1 -7  13  19 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  13  20 o 10 86.68   11.41  227.84    55.41    0.00     0.00     227.84    55.41    ?       ?      86.68   11.41  0.00    11.41  
1 1 1 -7  13  21 f 0  68.84   16.69  155.13    65.26    0.00     0.00     155.13    65.26    ?       ?      68.84   16.69  0.00    16.69  
1 1 1 -7  13  22 o 14 74.10   17.50  183.13    73.24    0.00     0.00     183.13    73.24    ?       ?      74.10   17.50  0.00    17.50  
1 1 1 -7  14  1  o 2  144.14  33.20  669.80    269.08   669.80   269.08   0.00      0.00     144.14  33.20  ?       ?      0.00    33.20  
1 1 1 -7  14  2  o 1  336.44  37.07  3634.67   704.13   4161.23  1005.60  3128.18   986.25   342.96  52.76  286.59  61.77  56.37   81.24  
1 1 1 -7  14  3  o 2  132.55  24.47  543.60    179.35   0.00     0.00     543.60    179.35   ?       ?      132.55  24.47  0.00    24.47  
1 1 1 -7  14  4  o 16 119.62  20.49  436.09    135.64   808.59   254.63   288.51    160.28   160.30  28.73  95.86   27.62  64.45   39.85  
1 1 1 -7  14  5  o 16 388.10  47.83  5241.75   1043.05  5212.05  1482.94  5270.83   1467.37  341.82  77.38  346.57  75.86  -4.75   108.37 
1 1 1 -7  14  6  o 14 261.90  28.80  2142.80   425.85   2359.84  618.70   1947.41   587.04   263.46  42.34  236.73  44.84  26.74   61.67  
1 1 1 -7  14  7  o 18 109.33  22.72  372.77    137.92   0.00     0.00     372.77    137.92   ?       ?      109.33  22.72  0.00    22.72  
1 1 1 -7  14  8  o 6  216.54  25.40  1455.84   309.80   1452.81  461.84   1458.32   417.72   205.06  40.67  209.20  36.09  -4.14   54.37  
1 1 1 -7  14  9  o 10 78.94   22.12  195.01    104.23   0.00     0.00     195.01    104.23   ?       ?      78.94   22.12  0.00    22.12  
1 1 1 -7  14  10 o 15 89.24   22.48  252.65    115.12   0.00     0.00     252.65    115.12   ?       ?      89.24   22.48  0.00    22.48  
1 1 1 -7  14  11 o 15 190.12  33.70  1226.34   354.31   0.00     0.00     1226.34   354.31   ?       ?      190.12  33.70  0.00    33.70  
1 1 1 -7  14  12 o 19 130.83  23.01  544.61    166.54   938.55   426.58   473.77    180.89   153.36  45.31  119.75  26.96  33.61   52.73  
1 1 1 -7  14  13 o 9  140.79  22.82  632.55    178.15   541.38   412.09   653.51    197.57   117.53  44.50  141.65  25.22  -24.11  51.15  
1 1 1 -7  14  14 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  14  15 o 19 116.52  47.56  608.59    502.71   608.59   502.71   0.00      0.00     116.52  47.56  ?       ?      0.00    47.56  
1 1 1 -7  14  16 o 13 112.69  19.79  406.90    123.36   0.00     0.00     406.90    123.36   ?       ?      112.69  19.79  0.00    19.79  
1 1 1 -7  14  17 o 19 66.86   13.51  138.80    50.07    426.64   629.94   136.97    50.23    101.67  46.81  66.37   13.64  35.30   48.75  
1 1 1 -7  14  18 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  14  19 o 16 153.84  16.40  748.43    142.57   0.00     0.00     748.43    142.57   ?       ?      153.84  16.40  0.00    16.40  
1 1 1 -7  14  20 o 5  175.32  18.22  1002.53   180.71   0.00     0.00     1002.53   180.71   ?       ?      175.32  18.22  0.00    18.22  
1 1 1 -7  15  1  o 2  53.99   21.15  56.82     95.33    -57.59   246.76   76.89     103.35   68.26   30.57  58.37   22.24  9.89    37.80  
1 1 1 -7  15  2  o 12 133.21  37.15  607.11    294.73   607.11   294.73   0.00      0.00     133.21  37.15  ?       ?      0.00    37.15  
1 1 1 -7  15  3  o 10 81.75   33.32  128.70    246.31   128.70   246.31   0.00      0.00     81.75   33.32  ?       ?      0.00    33.32  
1 1 1 -7  15  4  o 8  66.12   21.82  128.75    96.17    94.12    221.43   136.80    106.77   75.90   31.33  68.40   23.01  7.50    38.87  
1 1 1 -7  15  5  o 6  148.99  27.11  710.83    223.34   0.00     0.00     710.83    223.34   ?       ?      148.99  27.11  0.00    27.11  
1 1 1 -7  15  6  o 7  115.21  23.94  421.97    153.18   0.00     0.00     421.97    153.18   ?       ?      115.21  23.94  0.00    23.94  
1 1 1 -7  15  7  o 14 254.96  32.71  2162.15   467.76   1903.85  684.80   2388.07   640.44   211.81  55.62  252.72  45.83  -40.90  72.07  
1 1 1 -7  15  8  o 16 301.73  39.34  3231.35   665.13   3155.39  966.26   3299.75   916.94   255.44  65.57  272.09  60.29  -16.65  89.07  
1 1 1 -7  15  9  o 9  149.09  23.69  707.16    195.95   472.81   398.09   782.10    225.11   114.18  43.62  155.34  26.17  -41.16  50.87  
1 1 1 -7  15  10 o 3  122.48  23.40  482.53    158.55   310.64   384.37   517.77    174.04   100.98  41.44  126.12  24.92  -25.14  48.36  
1 1 1 -7  15  11 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  15  12 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  15  13 o 11 62.18   24.01  98.84     121.48   0.00     0.00     98.84     121.48   ?       ?      62.18   24.01  0.00    24.01  
1 1 1 -7  15  14 o 13 126.02  27.53  552.35    193.57   0.00     0.00     552.35    193.57   ?       ?      126.02  27.53  0.00    27.53  
1 1 1 -7  15  15 o 17 87.90   13.42  236.88    65.57    -8.69    583.68   240.02    65.99    87.09   41.60  88.49   13.41  -1.40   43.71  
1 1 1 -7  15  16 o 12 40.83   14.78  44.43     44.55    140.29   644.42   43.97     44.66    89.96   43.17  40.73   14.79  49.23   45.63  
1 1 1 -7  15  17 o 18 98.30   47.40  633.72    798.38   633.72   798.38   0.00      0.00     98.30   47.40  ?       ?      0.00    47.40  
1 1 1 -7  15  18 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  16  1  o 17 100.50  24.71  325.55    141.58   0.00     0.00     325.55    141.58   ?       ?      100.50  24.71  0.00    24.71  
1 1 1 -7  16  2  o 11 61.30   22.42  99.07     102.90   152.80   257.10   88.82     112.29   83.49   34.03  60.93   23.19  22.56   41.19  
1 1 1 -7  16  3  o 11 224.25  42.49  1844.42   526.97   0.00     0.00     1844.42   526.97   ?       ?      224.25  42.49  0.00    42.49  
1 1 1 -7  16  4  o 4  63.38   22.24  114.27    100.15   146.40   272.02   109.23    107.71   83.73   34.66  63.33   22.97  20.40   41.58  
1 1 1 -7  16  5  o 18 94.99   37.51  265.60    302.00   265.60   302.00   0.00      0.00     94.99   37.51  ?       ?      0.00    37.51  
1 1 1 -7  16  6  o 18 143.04  44.76  822.00    408.23   822.00   408.23   0.00      0.00     143.04  44.76  ?       ?      0.00    44.76  
1 1 1 -7  16  7  o 15 248.56  36.05  2192.11   499.44   1827.87  753.83   2477.08   666.77   186.69  61.07  245.85  48.96  -59.16  78.28  
1 1 1 -7  16  8  o 12 82.35   25.95  222.15    137.02   274.57   395.90   215.01    146.04   97.75   41.23  81.37   26.90  16.38   49.23  
1 1 1 -7  16  9  o 14 217.02  46.27  1946.88   558.84   0.00     0.00     1946.88   558.84   ?       ?      217.02  46.27  0.00    46.27  
1 1 1 -7  16  10 o 11 146.77  27.09  728.33    219.86   156.73   584.72   822.46    237.27   97.16   44.86  155.78  27.54  -58.62  52.64  
1 1 1 -7  16  11 o 12 190.90  32.35  1311.65   341.84   1419.40  732.29   1281.63   386.54   147.63  58.37  181.27  38.34  -33.64  69.84  
1 1 1 -7  16  12 o 3  62.26   24.76  94.95     132.44   0.00     0.00     94.95     132.44   ?       ?      62.26   24.76  0.00    24.76  
1 1 1 -7  16  13 o 11 95.76   44.97  291.46    628.19   291.46   628.19   0.00      0.00     95.76   44.97  ?       ?      0.00    44.97  
1 1 1 -7  16  14 f 0  75.28   14.05  177.21    58.47    -344.29  626.22   181.79    58.73    77.98   38.51  76.32   13.92  1.66    40.95  
1 1 1 -7  16  15 o 19 99.19   28.19  373.30    168.03   0.00     0.00     373.30    168.03   ?       ?      99.19   28.19  0.00    28.19  
1 1 1 -7  16  16 o 10 72.73   26.41  188.67    142.38   0.00     0.00     188.67    142.38   ?       ?      72.73   26.41  0.00    26.41  
1 1 1 -7  17  1  o 14 123.25  23.34  489.21    159.07   626.82   335.97   449.44    180.60   127.36  40.70  115.67  27.59  11.69   49.17  
1 1 1 -7  17  2  o 5  111.78  26.21  415.99    165.24   0.00     0.00     415.99    165.24   ?       ?      111.78  26.21  0.00    26.21  
1 1 1 -7  17  3  o 10 80.12   26.46  207.34    141.39   0.00     0.00     207.34    141.39   ?       ?      80.12   26.46  0.00    26.46  
1 1 1 -7  17  4  o 4  174.79  35.05  1102.60   339.45   0.00     0.00     1102.60   339.45   ?       ?      174.79  35.05  0.00    35.05  
1 1 1 -7  17  5  o 4  134.19  29.76  625.20    223.24   0.00     0.00     625.20    223.24   ?       ?      134.19  29.76  0.00    29.76  
1 1 1 -7  17  6  o 1  100.40  26.75  345.18    156.96   70.54    456.34   382.03    167.16   88.26   40.33  105.31  27.39  -17.05  48.76  
1 1 1 -7  17  7  o 5  80.17   37.73  -101.07   446.71   -101.07  446.71   0.00      0.00     80.17   37.73  ?       ?      0.00    37.73  
1 1 1 -7  17  8  o 4  200.76  72.80  3408.83   1081.29  3408.83  1081.29  0.00      0.00     200.76  72.80  ?       ?      0.00    72.80  
1 1 1 -7  17  9  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -7  17  10 o 2  88.77   43.39  -101.15   733.24   -101.15  733.24   0.00      0.00     88.77   43.39  ?       ?      0.00    43.39  
1 1 1 -7  17  11 o 11 84.73   28.16  261.28    160.05   0.00     0.00     261.28    160.05   ?       ?      84.73   28.16  0.00    28.16  
1 1 1 -7  17  12 o 2  162.84  34.37  1060.16   311.20   435.28   833.22   1161.46   335.48   96.54   46.99  168.65  35.76  -72.11  59.05  
1 1 1 -7  18  3  o 15 148.49  28.34  762.72    232.75   759.67   504.37   763.55    262.36   123.82  48.60  144.78  32.38  -20.96  58.40  
1 1 1 -7  18  4  o 18 136.65  28.68  655.08    217.83   767.26   533.40   632.62    238.64   121.82  49.26  131.21  31.98  -9.39   58.73  
1 1 1 -6  -18 1  f 0  75.42   17.44  176.49    74.00    179.31   124.71   174.96    91.93    76.26   24.83  74.67   20.72  1.58    32.34  
1 1 1 -6  -18 2  o 13 121.40  16.84  446.64    114.20   414.89   172.82   471.26    152.16   112.71  27.05  122.40  22.48  -9.70   35.18  
1 1 1 -6  -17 1  o 2  169.50  28.82  917.41    270.39   917.41   270.39   0.00      0.00     169.50  28.82  ?       ?      0.00    28.82  
1 1 1 -6  -17 2  o 10 68.60   23.63  134.11    112.75   134.11   112.75   0.00      0.00     68.60   23.63  ?       ?      0.00    23.63  
1 1 1 -6  -17 3  o 15 68.61   24.08  131.71    117.32   131.71   117.32   0.00      0.00     68.61   24.08  ?       ?      0.00    24.08  
1 1 1 -6  -17 4  o 6  131.16  25.67  545.25    186.35   545.25   186.35   0.00      0.00     131.16  25.67  ?       ?      0.00    25.67  
1 1 1 -6  -17 5  o 19 52.11   21.48  32.46     103.83   32.46    103.83   0.00      0.00     52.11   21.48  ?       ?      0.00    21.48  
1 1 1 -6  -17 6  o 7  99.34   24.04  313.57    135.61   313.57   135.61   0.00      0.00     99.34   24.04  ?       ?      0.00    24.04  
1 1 1 -6  -17 7  o 19 142.29  16.56  607.18    132.71   667.93   197.17   556.86    179.45   145.92  24.40  132.97  24.41  12.95   34.51  
1 1 1 -6  -16 1  o 11 140.47  16.38  586.96    129.61   621.64   187.51   555.23    179.35   142.00  23.85  133.89  24.22  8.11    33.99  
1 1 1 -6  -16 2  o 16 209.37  22.42  1326.65   265.23   1438.89  379.08   1219.02   371.24   212.76  32.03  194.01  34.60  18.75   47.15  
1 1 1 -6  -16 3  o 19 46.99   16.86  55.68     57.84    69.66    100.54   48.76     70.72    57.08   21.89  48.12   18.38  8.95    28.59  
1 1 1 -6  -16 4  o 11 109.22  15.67  356.52    95.45    329.65   142.06   378.63    128.88   102.51  24.48  111.04  20.99  -8.52   32.24  
1 1 1 -6  -16 5  o 17 155.28  17.30  719.06    151.61   766.46   217.71   674.42    211.25   157.40  24.92  147.01  25.98  10.40   36.00  
1 1 1 -6  -16 6  o 19 150.38  17.06  674.57    144.66   708.28   208.59   643.33    200.80   151.11  24.91  143.72  25.26  7.39    35.48  
1 1 1 -6  -16 7  o 6  211.22  32.63  1434.50   382.87   1328.67  1064.48  1450.23   410.33   173.08  69.72  210.64  35.17  -37.56  78.09  
1 1 1 -6  -16 8  o 18 113.35  14.79  382.84    93.93    373.35   141.07   390.40    125.89   109.25  23.21  112.81  20.18  -3.55   30.76  
1 1 1 -6  -16 9  o 7  93.32   23.91  274.95    128.69   274.95   128.69   0.00      0.00     93.32   23.91  ?       ?      0.00    23.91  
1 1 1 -6  -16 10 o 7  77.86   22.88  188.10    109.03   188.10   109.03   0.00      0.00     77.86   22.88  ?       ?      0.00    22.88  
1 1 1 -6  -15 1  o 5  220.84  25.26  1475.34   314.52   1179.11  418.25   1860.85   477.14   190.27  39.58  242.93  35.24  -52.66  53.00  
1 1 1 -6  -15 2  o 15 131.33  15.81  510.28    116.80   589.58   171.66   441.93    159.38   139.46  22.18  119.83  24.01  19.64   32.69  
1 1 1 -6  -15 3  o 5  239.12  22.80  1714.15   309.17   1832.71  412.59   1562.31   466.89   243.60  30.15  220.01  38.36  23.59   48.79  
1 1 1 -6  -15 4  o 3  85.55   14.70  219.11    69.60    286.26   111.05   175.67    89.32    96.66   20.64  75.79   20.17  20.87   28.86  
1 1 1 -6  -15 5  o 3  200.34  21.71  1204.92   245.69   1214.15  350.12   1195.96   344.85   196.22  32.20  194.85  31.93  1.37    45.35  
1 1 1 -6  -15 6  o 2  223.92  22.76  1510.00   288.57   1521.84  392.94   1496.13   425.16   219.98  32.06  216.03  35.52  3.95    47.84  
1 1 1 -6  -15 7  o 16 240.78  23.27  1749.25   317.61   1970.88  428.40   1478.75   473.28   251.67  30.26  211.24  40.50  40.42   50.56  
1 1 1 -6  -15 8  o 12 183.27  19.56  1004.44   202.57   1023.21  282.71   984.64    290.40   181.32  28.07  177.05  29.62  4.27    40.80  
1 1 1 -6  -15 9  o 4  160.19  17.39  763.71    157.38   855.94   227.98   679.77    217.51   166.94  24.52  147.57  26.66  19.37   36.22  
1 1 1 -6  -15 10 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  -15 11 o 8  180.81  19.28  981.59    197.01   1003.73  275.87   958.55    281.43   178.85  27.77  173.94  29.22  4.91    40.31  
1 1 1 -6  -15 12 o 6  42.64   15.88  41.74     52.02    80.62    95.70    25.43     61.97    57.85   21.54  41.82   16.83  16.03   27.34  
1 1 1 -6  -15 13 o 9  65.82   21.95  125.79    97.18    125.79   97.18    0.00      0.00     65.82   21.95  ?       ?      0.00    21.95  
1 1 1 -6  -14 1  o 10 433.86  52.88  6218.33   1289.94  6022.09  1876.04  6394.30   1776.52  386.88  86.63  410.54  78.23  -23.67  116.73 
1 1 1 -6  -14 2  o 14 202.73  29.27  1252.80   330.76   951.06   696.43   1340.68   375.85   169.28  58.71  208.52  32.45  -39.24  67.08  
1 1 1 -6  -14 3  o 9  313.19  52.84  3272.63   916.28   0.00     0.00     3272.63   916.28   ?       ?      313.19  52.84  0.00    52.84  
1 1 1 -6  -14 4  o 2  217.17  21.73  1400.47   267.27   1391.31  356.00   1412.30   404.60   213.38  29.88  213.08  34.24  0.30    45.44  
1 1 1 -6  -14 5  o 18 264.05  28.05  2109.00   418.69   1831.74  537.92   2535.18   666.90   239.43  40.58  281.07  42.67  -41.64  58.89  
1 1 1 -6  -14 6  o 10 149.41  17.11  659.78    144.10   643.99   207.61   674.46    200.18   145.01  25.89  149.02  24.23  -4.01   35.46  
1 1 1 -6  -14 7  o 6  83.75   14.90  210.02    69.02    236.91   105.60   189.97    91.20    87.91   21.18  78.87   20.09  9.05    29.19  
1 1 1 -6  -14 8  f 0  178.05  18.33  939.67    184.68   1022.87  257.47   851.49    265.06   183.44  25.11  165.60  28.93  17.84   38.31  
1 1 1 -6  -14 9  o 15 138.73  24.65  591.35    189.12   591.35   189.12   0.00      0.00     138.73  24.65  ?       ?      0.00    24.65  
1 1 1 -6  -14 10 o 13 50.00   17.99  62.55     65.91    0.00     0.00     62.55     65.91    ?       ?      50.00   17.99  0.00    17.99  
1 1 1 -6  -14 11 o 11 141.82  15.66  595.22    125.41   638.06   179.79   554.62    175.01   144.77  22.35  134.37  23.55  10.41   32.47  
1 1 1 -6  -14 12 o 15 207.47  20.49  1289.96   240.82   1399.69  330.54   1165.81   351.58   212.62  27.74  190.78  33.31  21.84   43.35  
1 1 1 -6  -14 13 o 17 235.09  31.96  1754.36   420.17   1754.36  420.17   0.00      0.00     235.09  31.96  ?       ?      0.00    31.96  
1 1 1 -6  -14 14 o 3  57.82   20.77  86.82     87.75    86.82    87.75    0.00      0.00     57.82   20.77  ?       ?      0.00    20.77  
1 1 1 -6  -14 15 o 13 108.15  22.84  365.82    137.35   365.82   137.35   0.00      0.00     108.15  22.84  ?       ?      0.00    22.84  
1 1 1 -6  -13 1  o 2  56.66   17.72  92.32     64.03    118.64   97.78    72.57     84.71    65.69   22.02  55.55   20.34  10.13   29.97  
1 1 1 -6  -13 2  o 14 251.76  24.36  1873.49   347.64   1874.25  448.82   1872.34   549.61   249.21  32.12  245.77  40.35  3.44    51.58  
1 1 1 -6  -13 3  o 1  156.19  17.08  716.01    150.63   683.23   209.07   751.38    217.20   150.64  25.06  158.23  24.72  -7.59   35.20  
1 1 1 -6  -13 4  o 1  214.48  22.06  1359.62   267.74   1273.39  353.92   1475.00   409.39   204.61  31.11  219.58  33.54  -14.97  45.75  
1 1 1 -6  -13 5  o 16 303.62  28.67  2761.62   493.72   2715.02  624.01   2839.62   807.35   296.76  37.46  296.66  49.12  0.10    61.78  
1 1 1 -6  -13 6  o 18 128.40  21.04  494.60    149.69   884.83   571.50   465.86    155.10   164.68  53.13  124.15  22.60  40.53   57.73  
1 1 1 -6  -13 7  o 10 287.50  46.98  2667.98   748.62   0.00     0.00     2667.98   748.62   ?       ?      287.50  46.98  0.00    46.98  
1 1 1 -6  -13 8  o 9  217.91  33.53  1467.79   406.06   732.96   858.72   1679.42   460.83   160.61  63.30  232.33  35.69  -71.71  72.67  
1 1 1 -6  -13 9  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  -13 10 o 1  225.02  36.21  1597.77   451.83   0.00     0.00     1597.77   451.83   ?       ?      225.02  36.21  0.00    36.21  
1 1 1 -6  -13 11 o 11 362.95  46.71  4366.25   950.63   4130.50  1442.76  4547.13   1263.74  313.35  79.95  349.65  65.36  -36.30  103.27 
1 1 1 -6  -13 12 o 15 95.05   13.57  267.80    71.93    298.47   109.22   244.32    95.59    98.93   19.92  89.47   19.19  9.46    27.66  
1 1 1 -6  -13 13 o 17 119.04  14.47  418.98    96.87    439.41   142.79   401.57    131.85   119.99  21.52  114.81  20.77  5.18    29.91  
1 1 1 -6  -13 14 o 15 126.58  22.69  491.93    158.81   491.93   158.81   0.00      0.00     126.58  22.69  ?       ?      0.00    22.69  
1 1 1 -6  -13 15 o 5  222.34  32.03  1570.03   397.01   1570.03  397.01   0.00      0.00     222.34  32.03  ?       ?      0.00    32.03  
1 1 1 -6  -13 16 o 14 168.87  27.57  896.92    258.06   877.81   266.23   1194.29   1050.26  166.32  28.93  166.97  68.51  -0.66   74.37  
1 1 1 -6  -13 17 o 9  167.00  28.52  887.45    263.62   887.45   263.62   0.00      0.00     167.00  28.52  ?       ?      0.00    28.52  
1 1 1 -6  -12 1  o 11 553.14  104.41 11457.79  3193.81  11457.79 3193.81  0.00      0.00     553.14  104.41 ?       ?      0.00    104.41 
1 1 1 -6  -12 2  o 2  204.98  32.50  1267.08   369.71   1267.08  369.71   0.00      0.00     204.98  32.50  ?       ?      0.00    32.50  
1 1 1 -6  -12 3  o 15 400.84  65.63  5215.91   1457.99  5215.91  1457.99  0.00      0.00     400.84  65.63  ?       ?      0.00    65.63  
1 1 1 -6  -12 4  o 10 229.83  35.92  1601.25   458.40   1601.25  458.40   0.00      0.00     229.83  35.92  ?       ?      0.00    35.92  
1 1 1 -6  -12 5  o 15 71.49   22.96  145.38    106.85   145.38   106.85   0.00      0.00     71.49   22.96  ?       ?      0.00    22.96  
1 1 1 -6  -12 6  o 4  154.08  26.12  714.12    222.76   714.12   222.76   0.00      0.00     154.08  26.12  ?       ?      0.00    26.12  
1 1 1 -6  -12 7  o 11 547.87  63.23  9914.41   1952.38  9977.33  2761.60  9851.53   2760.56  506.19  98.58  501.86  99.34  4.33    139.95 
1 1 1 -6  -12 8  o 19 184.98  27.43  1031.36   282.52   1031.36  282.52   0.00      0.00     184.98  27.43  ?       ?      0.00    27.43  
1 1 1 -6  -12 9  x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  -12 10 o 10 222.29  23.61  1470.26   296.68   1253.59  392.22   1760.03   453.58   200.73  35.33  239.26  33.98  -38.53  49.01  
1 1 1 -6  -12 11 o 18 266.82  26.12  2132.60   394.98   2028.92  509.89   2288.17   624.56   255.69  35.71  268.19  41.94  -12.50  55.08  
1 1 1 -6  -12 12 o 11 183.73  19.44  1000.10   201.95   912.19   275.87   1101.61   296.45   172.19  28.93  189.94  28.03  -17.75  40.28  
1 1 1 -6  -12 13 o 16 243.76  30.42  1828.83   416.48   2091.29  785.86   1726.33   491.12   241.85  57.46  232.46  38.12  9.39    68.95  
1 1 1 -6  -12 14 o 3  160.42  57.33  898.26    667.59   898.26   667.59   0.00      0.00     160.42  57.33  ?       ?      0.00    57.33  
1 1 1 -6  -12 15 o 14 97.88   45.54  -322.73   620.48   -322.73  620.48   0.00      0.00     97.88   45.54  ?       ?      0.00    45.54  
1 1 1 -6  -12 16 o 5  157.14  62.06  875.72    826.88   875.72   826.88   0.00      0.00     157.14  62.06  ?       ?      0.00    62.06  
1 1 1 -6  -12 17 o 5  112.46  25.92  398.99    163.91   398.99   163.91   0.00      0.00     112.46  25.92  ?       ?      0.00    25.92  
1 1 1 -6  -12 18 o 1  291.08  57.09  3270.80   919.87   3270.80  919.87   0.00      0.00     291.08  57.09  ?       ?      0.00    57.09  
1 1 1 -6  -12 19 o 4  60.52   23.75  73.83     120.35   73.83    120.35   0.00      0.00     60.52   23.75  ?       ?      0.00    23.75  
1 1 1 -6  -11 1  o 19 416.49  44.51  5317.53   1047.79  5458.93  1482.17  5176.28   1481.43  407.85  65.52  395.34  67.71  12.51   94.22  
1 1 1 -6  -11 2  o 11 102.45  14.19  308.70    81.20    296.97   115.67   320.10    114.02   99.26   20.96  103.31  19.95  -4.04   28.93  
1 1 1 -6  -11 3  o 16 451.03  39.88  6142.86   1021.90  6091.50  1256.77  6243.07   1755.56  442.81  50.33  430.96  73.60  11.86   89.17  
1 1 1 -6  -11 4  o 6  419.80  36.61  5275.66   873.44   5213.80  1077.92  5393.95   1490.50  412.32  46.34  406.82  66.09  5.49    80.72  
1 1 1 -6  -11 5  o 10 164.22  17.13  788.13    159.11   884.62   216.15   674.00    235.08   173.10  22.27  149.36  28.45  23.74   36.13  
1 1 1 -6  -11 6  o 5  342.46  38.35  3526.19   741.07   2963.41  923.00   4547.09   1243.14  306.69  54.42  378.73  59.11  -72.05  80.34  
1 1 1 -6  -11 7  o 8  258.60  31.66  1994.09   460.27   2247.21  652.26   1743.06   649.58   270.61  43.46  235.45  49.63  35.16   65.96  
1 1 1 -6  -11 8  o 3  240.74  56.20  1865.94   762.46   1865.94  762.46   0.00      0.00     240.74  56.20  ?       ?      0.00    56.20  
1 1 1 -6  -11 9  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  -11 10 o 2  355.86  58.99  4160.04   1162.88  4160.04  1162.88  0.00      0.00     355.86  58.99  ?       ?      0.00    58.99  
1 1 1 -6  -11 11 f 0  138.57  23.57  578.45    180.81   578.45   180.81   0.00      0.00     138.57  23.57  ?       ?      0.00    23.57  
1 1 1 -6  -11 12 f 0  406.55  74.66  6012.93   1678.29  6012.93  1678.29  0.00      0.00     406.55  74.66  ?       ?      0.00    74.66  
1 1 1 -6  -11 13 f 0  201.51  32.10  1251.09   358.89   1251.09  358.89   0.00      0.00     201.51  32.10  ?       ?      0.00    32.10  
1 1 1 -6  -11 14 o 3  92.78   20.61  262.54    106.92   262.54   106.92   0.00      0.00     92.78   20.61  ?       ?      0.00    20.61  
1 1 1 -6  -11 15 o 9  212.74  31.39  1405.52   371.82   1405.52  371.82   0.00      0.00     212.74  31.39  ?       ?      0.00    31.39  
1 1 1 -6  -11 16 o 10 185.25  28.43  1061.98   292.74   1061.98  292.74   0.00      0.00     185.25  28.43  ?       ?      0.00    28.43  
1 1 1 -6  -11 17 o 4  69.82   23.26  139.96    109.19   139.96   109.19   0.00      0.00     69.82   23.26  ?       ?      0.00    23.26  
1 1 1 -6  -11 18 o 5  222.76  58.45  1910.92   756.68   1910.92  756.68   0.00      0.00     222.76  58.45  ?       ?      0.00    58.45  
1 1 1 -6  -11 19 o 5  146.76  53.74  789.55    591.19   789.55   591.19   0.00      0.00     146.76  53.74  ?       ?      0.00    53.74  
1 1 1 -6  -11 20 o 15 131.90  50.64  606.74    538.23   606.74   538.23   0.00      0.00     131.90  50.64  ?       ?      0.00    50.64  
1 1 1 -6  -10 1  o 4  220.19  22.78  1422.09   283.80   1387.88  401.66   1456.20   401.03   214.84  33.67  220.45  32.68  -5.61   46.92  
1 1 1 -6  -10 2  o 16 173.97  18.21  884.78    179.16   1027.00  254.70   745.48    252.07   186.35  24.39  157.27  28.99  29.08   37.89  
1 1 1 -6  -10 3  o 11 284.64  29.49  2398.63   474.86   2427.65  671.99   2369.68   671.13   281.78  42.89  278.11  43.46  3.67    61.06  
1 1 1 -6  -10 4  o 14 111.97  13.37  366.58    84.22    380.69   119.98   352.86    118.25   113.11  19.16  108.71  19.67  4.41    27.46  
1 1 1 -6  -10 5  o 6  441.80  47.36  5998.68   1182.38  6084.68  1672.12  5912.67   1672.15  429.00  70.33  421.79  71.62  7.20    100.38 
1 1 1 -6  -10 6  o 2  396.40  35.13  4696.18   791.14   4639.31  975.15   4805.71   1353.26  389.47  44.41  384.91  63.45  4.56    77.45  
1 1 1 -6  -10 7  o 4  293.53  24.77  2530.13   413.51   2678.53  520.68   2276.66   680.48   300.34  30.63  271.30  45.29  29.04   54.67  
1 1 1 -6  -10 8  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  -10 9  o 1  429.40  32.88  5459.38   804.29   6066.70  999.89   4346.17   1353.74  450.02  39.09  365.78  66.94  84.24   77.52  
1 1 1 -6  -10 10 o 16 612.50  62.96  11930.00  2182.26  10867.71 2681.07  14015.35  3756.44  562.37  85.76  606.92  111.94 -44.55  141.01 
1 1 1 -6  -10 11 o 16 375.18  31.67  4186.68   675.73   4468.31  844.55   3685.64   1126.48  384.40  38.80  336.95  60.46  47.44   71.84  
1 1 1 -6  -10 12 o 13 341.53  30.71  3484.96   595.74   3434.54  747.44   3572.78   986.46   334.75  39.66  333.45  53.33  1.30    66.46  
1 1 1 -6  -10 13 o 17 304.48  32.38  2804.66   557.32   2759.81  788.99   2849.33   787.35   293.12  48.59  298.59  47.53  -5.46   67.97  
1 1 1 -6  -10 14 o 2  149.49  15.34  655.03    129.81   784.38   180.57   516.67    186.75   162.72  19.73  130.02  25.93  32.70   32.58  
1 1 1 -6  -10 15 o 14 253.73  41.12  2048.05   578.48   2048.05  578.48   0.00      0.00     253.73  41.12  ?       ?      0.00    41.12  
1 1 1 -6  -10 16 o 5  304.70  52.56  3156.33   886.13   3156.33  886.13   0.00      0.00     304.70  52.56  ?       ?      0.00    52.56  
1 1 1 -6  -10 17 o 8  246.58  32.10  1894.46   443.56   1807.46  520.99   2123.68   845.63   235.96  39.88  238.10  61.45  -2.14   73.26  
1 1 1 -6  -10 18 o 1  153.78  27.33  735.59    232.42   735.59   232.42   0.00      0.00     153.78  27.33  ?       ?      0.00    27.33  
1 1 1 -6  -10 19 o 15 205.37  31.01  1331.69   354.23   1456.30  381.84   562.46    948.75   214.30  32.02  145.26  62.62  69.03   70.33  
1 1 1 -6  -10 20 o 1  242.70  32.92  1888.65   446.89   1888.65  446.89   0.00      0.00     242.70  32.92  ?       ?      0.00    32.92  
1 1 1 -6  -10 21 o 3  196.69  28.12  1224.11   308.47   1224.11  308.47   0.00      0.00     196.69  28.12  ?       ?      0.00    28.12  
1 1 1 -6  -10 22 o 15 55.80   21.96  60.87     103.14   60.87    103.14   0.00      0.00     55.80   21.96  ?       ?      0.00    21.96  
1 1 1 -6  -9  1  o 2  378.71  39.37  4277.43   843.49   4353.11  1192.98  4201.77   1192.77  374.58  57.30  367.32  58.53  7.26    81.91  
1 1 1 -6  -9  2  o 7  128.33  14.06  480.08    101.86   532.45   145.45   429.67    142.69   134.37  19.42  120.06  21.49  14.31   28.96  
1 1 1 -6  -9  3  o 19 536.13  57.48  8836.69   1741.42  8756.84  2462.82  8916.53   2462.67  513.39  86.65  518.90  85.66  -5.52   121.84 
1 1 1 -6  -9  4  o 6  546.17  58.78  9210.48   1814.01  9405.98  2565.48  9015.00   2565.31  531.07  87.17  517.80  89.54  13.27   124.97 
1 1 1 -6  -9  5  o 14 407.50  42.69  4991.55   983.80   5117.12  1391.39  4866.01   1391.22  403.01  62.14  391.75  64.07  11.26   89.25  
1 1 1 -6  -9  6  o 7  702.79  82.03  16475.79  3247.29  15978.21 4592.35  16973.38  4592.38  628.53  131.51 655.69  126.59 -27.16  182.54 
1 1 1 -6  -9  7  o 10 193.53  20.55  1098.20   224.78   1098.20  224.78   0.00      0.00     193.53  20.55  ?       ?      0.00    20.55  
1 1 1 -6  -9  8  o 4  121.52  20.76  440.38    139.63   0.00     0.00     440.38    139.63   ?       ?      121.52  20.76  0.00    20.76  
1 1 1 -6  -9  9  f 0  200.44  16.79  1169.83   191.42   1411.98  253.83   850.51    291.48   219.66  20.36  167.37  31.49  52.29   37.50  
1 1 1 -6  -9  10 o 19 469.28  40.04  6615.51   1068.42  6790.63  1315.71  6276.44   1830.76  470.11  49.49  433.21  76.41  36.90   91.04  
1 1 1 -6  -9  11 o 6  249.23  44.57  1916.55   614.30   -21.64   1027.81  2993.68   766.21   146.87  64.22  313.19  43.81  -166.32 77.74  
1 1 1 -6  -9  12 o 5  195.73  21.07  1124.39   233.03   1043.05  330.18   1205.11   328.92   185.75  32.13  200.72  29.42  -14.97  43.56  
1 1 1 -6  -9  13 o 5  224.03  23.23  1479.27   294.40   1557.54  417.23   1401.67   415.47   227.08  32.97  214.55  34.93  12.52   48.03  
1 1 1 -6  -9  14 o 15 67.07   16.57  135.60    63.44    132.50   84.36    139.64    96.25    67.12   20.23  69.40   21.74  -2.28   29.69  
1 1 1 -6  -9  15 o 7  163.99  24.23  807.69    221.28   807.69   221.28   0.00      0.00     163.99  24.23  ?       ?      0.00    24.23  
1 1 1 -6  -9  16 o 16 129.61  22.64  507.72    162.33   507.72   162.33   0.00      0.00     129.61  22.64  ?       ?      0.00    22.64  
1 1 1 -6  -9  17 o 11 270.19  31.23  2236.85   475.46   2434.55  556.88   1705.17   913.24   279.53  35.50  213.19  66.98  66.34   75.80  
1 1 1 -6  -9  18 o 6  221.70  33.84  1545.93   417.11   1730.03  483.06   1006.39   826.96   232.60  37.45  168.79  63.23  63.80   73.49  
1 1 1 -6  -9  19 o 15 144.93  24.96  647.04    200.17   647.04   200.17   0.00      0.00     144.93  24.96  ?       ?      0.00    24.96  
1 1 1 -6  -9  20 o 18 229.73  37.25  1722.49   474.42   1975.67  549.33   979.37    941.12   243.60  40.72  162.15  65.48  81.45   77.10  
1 1 1 -6  -9  21 o 10 233.08  40.47  1833.67   521.88   1833.67  521.88   0.00      0.00     233.08  40.47  ?       ?      0.00    40.47  
1 1 1 -6  -9  22 o 13 100.87  23.33  320.80    132.41   328.10   133.58   -90.00    1002.22  102.03  23.32  121.18  56.87  -19.15  61.46  
1 1 1 -6  -9  23 o 1  43.76   18.94  -4.69     87.46    -3.67    87.68    -203.67   1228.04  43.94   18.99  123.60  59.39  -79.66  62.35  
1 1 1 -6  -8  1  o 13 312.83  48.41  3013.21   841.25   0.00     0.00     3013.21   841.25   ?       ?      312.83  48.41  0.00    48.41  
1 1 1 -6  -8  2  o 11 573.19  102.03 11610.69  3234.39  0.00     0.00     11610.69  3234.39  ?       ?      573.19  102.03 0.00    102.03 
1 1 1 -6  -8  3  o 10 360.11  56.17  4027.18   1123.38  0.00     0.00     4027.18   1123.38  ?       ?      360.11  56.17  0.00    56.17  
1 1 1 -6  -8  4  o 17 321.97  49.48  3171.30   885.31   0.00     0.00     3171.30   885.31   ?       ?      321.97  49.48  0.00    49.48  
1 1 1 -6  -8  5  o 1  512.93  84.95  8663.98   2413.96  0.00     0.00     8663.98   2413.96  ?       ?      512.93  84.95  0.00    84.95  
1 1 1 -6  -8  6  f 0  189.17  28.66  1064.79   301.55   0.00     0.00     1064.79   301.55   ?       ?      189.17  28.66  0.00    28.66  
1 1 1 -6  -8  7  x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  -8  8  o 19 442.71  72.22  6357.30   1772.17  0.00     0.00     6357.30   1772.17  ?       ?      442.71  72.22  0.00    72.22  
1 1 1 -6  -8  9  o 7  573.98  107.29 12223.70  3405.23  0.00     0.00     12223.70  3405.23  ?       ?      573.98  107.29 0.00    107.29 
1 1 1 -6  -8  10 o 17 178.10  27.43  949.05    271.43   0.00     0.00     949.05    271.43   ?       ?      178.10  27.43  0.00    27.43  
1 1 1 -6  -8  11 f 0  276.11  22.11  2230.84   347.59   2414.51  444.82   1942.83   557.02   285.90  27.44  252.14  39.80  33.76   48.34  
1 1 1 -6  -8  12 o 11 420.28  36.26  5271.25   866.36   5372.14  1071.77  5081.04   1471.62  420.00  45.16  395.23  67.27  24.77   81.02  
1 1 1 -6  -8  13 o 18 294.46  31.86  2578.25   529.91   2035.70  749.08   3121.72   749.72   253.55  53.17  320.64  41.72  -67.09  67.58  
1 1 1 -6  -8  14 o 15 293.47  26.32  2537.97   438.71   2608.00  562.67   2429.37   700.64   295.10  33.83  280.29  45.07  14.81   56.35  
1 1 1 -6  -8  15 o 3  108.63  14.95  347.59    90.74    318.49   127.62   377.33    129.03   102.54  22.32  112.10  20.82  -9.56   30.52  
1 1 1 -6  -8  16 o 7  222.30  29.83  1495.25   371.03   1495.25  371.03   0.00      0.00     222.30  29.83  ?       ?      0.00    29.83  
1 1 1 -6  -8  17 f 0  358.82  43.05  4071.69   869.07   4071.69  869.07   0.00      0.00     358.82  43.05  ?       ?      0.00    43.05  
1 1 1 -6  -8  18 o 18 122.13  23.31  454.74    157.46   454.74   157.46   0.00      0.00     122.13  23.31  ?       ?      0.00    23.31  
1 1 1 -6  -8  19 f 0  283.62  34.64  2522.10   552.29   2522.10  552.29   0.00      0.00     283.62  34.64  ?       ?      0.00    34.64  
1 1 1 -6  -8  20 o 17 61.67   22.02  99.10     98.46    101.98   99.51    -35.57    681.03   62.29   22.15  112.05  50.43  -49.76  55.08  
1 1 1 -6  -8  21 o 3  144.42  22.38  637.61    179.56   607.54   184.23   1208.47   802.70   140.41  23.70  173.69  62.76  -33.28  67.09  
1 1 1 -6  -8  22 o 13 106.35  41.94  300.52    377.14   300.52   377.14   0.00      0.00     106.35  41.94  ?       ?      0.00    41.94  
1 1 1 -6  -8  23 o 15 100.81  21.20  316.93    118.82   317.48   119.59   274.53    1045.17  100.87  21.32  130.95  60.29  -30.09  63.95  
1 1 1 -6  -8  24 o 3  95.23   22.27  287.05    119.54   287.05   119.54   0.00      0.00     95.23   22.27  ?       ?      0.00    22.27  
1 1 1 -6  -7  1  o 9  610.16  71.61  12454.92  2460.51  11284.73 3479.54  13625.29  3479.83  518.96  119.30 592.43  106.22 -73.47  159.73 
1 1 1 -6  -7  2  o 14 348.93  36.68  3664.03   723.66   3283.00  1023.10  4045.53   1023.72  319.52  57.91  359.49  51.04  -39.97  77.19  
1 1 1 -6  -7  3  o 3  242.87  25.02  1738.26   343.85   1525.24  485.69   1952.32   486.88   223.09  39.36  254.87  34.13  -31.78  52.10  
1 1 1 -6  -7  4  o 3  136.92  14.32  546.54    110.89   487.65   155.13   608.08    158.57   127.88  21.92  143.58  19.76  -15.70  29.51  
1 1 1 -6  -7  5  o 7  319.87  33.06  3033.67   598.36   2824.70  845.89   3242.96   846.52   302.27  50.53  325.97  46.56  -23.70  68.71  
1 1 1 -6  -7  6  o 16 416.61  66.32  5499.28   1532.95  5499.28  1532.95  0.00      0.00     416.61  66.32  ?       ?      0.00    66.32  
1 1 1 -6  -7  7  o 19 464.01  74.95  6920.34   1928.47  0.00     0.00     6920.34   1928.47  ?       ?      464.01  74.95  0.00    74.95  
1 1 1 -6  -7  8  o 10 578.13  62.44  10356.04  2039.58  10987.07 2884.48  9725.08   2884.32  573.93  90.55  533.38  97.80  40.55   133.28 
1 1 1 -6  -7  9  o 7  583.78  63.40  10618.68  2090.73  10942.62 2956.81  10294.76  2956.67  567.78  94.00  547.10  97.73  20.67   135.60 
1 1 1 -6  -7  10 o 13 367.35  40.88  4058.34   847.51   3788.20  1212.40  4316.48   1185.18  344.10  63.72  371.20  57.47  -27.10  85.81  
1 1 1 -6  -7  11 o 13 196.30  23.72  1137.36   261.86   1067.32  430.57   1178.48   329.88   185.44  41.49  198.33  29.90  -12.89  51.14  
1 1 1 -6  -7  12 o 8  216.77  26.92  1395.56   327.80   1332.26  568.25   1427.13   401.30   204.92  48.97  217.42  33.20  -12.50  59.17  
1 1 1 -6  -7  13 o 7  97.18   21.24  284.82    115.15   714.29   461.39   256.29    118.91   152.79  47.55  92.06   22.66  60.73   52.67  
1 1 1 -6  -7  14 o 7  274.39  42.99  2307.40   654.96   0.00     0.00     2307.40   654.96   ?       ?      274.39  42.99  0.00    42.99  
1 1 1 -6  -7  15 o 5  176.00  40.77  962.83    403.86   -2367.40 827.98   2002.53   462.63   80.23   40.33  258.90  31.79  -178.67 51.35  
1 1 1 -6  -7  16 o 13 383.60  71.68  5030.26   1520.44  5030.26  1520.44  0.00      0.00     383.60  71.68  ?       ?      0.00    71.68  
1 1 1 -6  -7  17 f 0  115.15  21.59  399.99    137.49   399.99   137.49   0.00      0.00     115.15  21.59  ?       ?      0.00    21.59  
1 1 1 -6  -7  18 o 14 133.93  22.57  541.15    167.34   637.42   177.19   -253.50   509.06   145.81  21.84  92.69   42.45  53.12   47.74  
1 1 1 -6  -7  19 o 4  84.09   21.90  216.21    106.75   216.21   106.75   0.00      0.00     84.09   21.90  ?       ?      0.00    21.90  
1 1 1 -6  -7  20 o 9  232.91  27.58  1657.50   361.61   1600.32  406.17   1876.06   794.09   226.43  32.15  224.57  60.32  1.85    68.35  
1 1 1 -6  -7  21 o 17 172.75  24.27  912.21    234.02   912.21   234.02   0.00      0.00     172.75  24.27  ?       ?      0.00    24.27  
1 1 1 -6  -7  22 o 10 153.53  23.56  724.72    201.02   724.72   201.02   0.00      0.00     153.53  23.56  ?       ?      0.00    23.56  
1 1 1 -6  -7  23 o 4  156.16  23.39  753.17    203.25   745.23   208.21   914.04    936.94   154.95  24.20  153.11  63.93  1.84    68.36  
1 1 1 -6  -7  24 o 1  188.36  26.18  1118.58   275.47   1118.58  275.47   0.00      0.00     188.36  26.18  ?       ?      0.00    26.18  
1 1 1 -6  -7  25 o 6  190.62  23.54  1135.62   252.13   1135.62  252.13   0.00      0.00     190.62  23.54  ?       ?      0.00    23.54  
1 1 1 -6  -6  1  o 9  248.79  38.62  1911.68   533.65   1911.68  533.65   0.00      0.00     248.79  38.62  ?       ?      0.00    38.62  
1 1 1 -6  -6  2  o 12 385.85  65.19  4997.11   1392.52  4997.11  1392.52  0.00      0.00     385.85  65.19  ?       ?      0.00    65.19  
1 1 1 -6  -6  3  f 0  357.63  58.58  4165.99   1161.15  4165.99  1161.15  0.00      0.00     357.63  58.58  ?       ?      0.00    58.58  
1 1 1 -6  -6  4  o 1  180.86  27.32  980.76    274.81   980.76   274.81   0.00      0.00     180.86  27.32  ?       ?      0.00    27.32  
1 1 1 -6  -6  5  o 6  520.91  96.08  9935.22   2767.44  9935.22  2767.44  0.00      0.00     520.91  96.08  ?       ?      0.00    96.08  
1 1 1 -6  -6  6  x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  -6  7  x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  -6  8  o 13 472.05  77.24  7253.29   2020.74  7253.29  2020.74  0.00      0.00     472.05  77.24  ?       ?      0.00    77.24  
1 1 1 -6  -6  9  o 8  224.83  33.77  1511.42   422.39   1511.42  422.39   0.00      0.00     224.83  33.77  ?       ?      0.00    33.77  
1 1 1 -6  -6  10 f 0  218.13  32.76  1421.50   397.59   1421.50  397.59   0.00      0.00     218.13  32.76  ?       ?      0.00    32.76  
1 1 1 -6  -6  11 o 9  113.55  17.47  380.88    110.22   380.88   110.22   0.00      0.00     113.55  17.47  ?       ?      0.00    17.47  
1 1 1 -6  -6  12 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  -6  13 o 14 24.70   11.88  -73.95    49.35    -34.49   67.15    -120.28   72.76    35.09   15.81  29.17   14.12  5.92    21.20  
1 1 1 -6  -6  14 o 4  152.64  15.38  679.89    132.90   867.80   180.60   457.96    196.27   172.07  18.58  122.54  28.45  49.53   33.98  
1 1 1 -6  -6  15 f 0  182.73  20.77  981.28    213.97   887.01   287.22   1098.83   320.75   171.38  30.30  191.22  30.22  -19.85  42.80  
1 1 1 -6  -6  16 o 7  287.77  27.11  2444.10   442.50   2513.99  568.77   2336.94   704.31   289.33  34.95  274.34  46.37  14.98   58.07  
1 1 1 -6  -6  17 o 8  443.11  43.96  6046.04   1103.43  6046.04  1103.43  0.00      0.00     443.11  43.96  ?       ?      0.00    43.96  
1 1 1 -6  -6  18 o 5  158.44  52.06  800.24    547.52   800.24   547.52   0.00      0.00     158.44  52.06  ?       ?      0.00    52.06  
1 1 1 -6  -6  19 o 12 84.91   37.28  -40.40    349.50   -40.40   349.50   0.00      0.00     84.91   37.28  ?       ?      0.00    37.28  
1 1 1 -6  -6  20 o 11 160.80  42.42  851.61    397.19   851.61   397.19   0.00      0.00     160.80  42.42  ?       ?      0.00    42.42  
1 1 1 -6  -6  21 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  -6  22 o 5  80.29   21.39  199.10    100.35   199.10   100.35   0.00      0.00     80.29   21.39  ?       ?      0.00    21.39  
1 1 1 -6  -6  23 o 16 215.95  27.50  1455.53   333.24   1455.53  333.24   0.00      0.00     215.95  27.50  ?       ?      0.00    27.50  
1 1 1 -6  -6  24 o 2  130.12  19.86  517.40    143.64   505.21   145.52   979.35    895.82   128.33  20.44  153.34  63.13  -25.01  66.36  
1 1 1 -6  -6  25 o 19 192.39  21.87  1141.15   237.28   1094.78  243.83   1969.79   1030.72  187.66  23.12  188.09  70.56  -0.43   74.25  
1 1 1 -6  -6  26 o 6  100.38  20.69  317.27    115.25   319.29   115.82   112.92    1165.36  100.69  20.73  122.00  58.41  -21.30  61.98  
1 1 1 -6  -5  1  o 10 94.92   10.30  262.73    55.24    227.67   76.85    300.22    79.47    87.30   15.92  100.92  14.10  -13.62  21.27  
1 1 1 -6  -5  2  o 13 77.44   9.10   175.04    39.69    125.18   54.22    232.60    58.26    64.48   14.94  89.03   11.68  -24.55  18.96  
1 1 1 -6  -5  3  o 5  204.91  21.18  1238.60   245.50   1162.54  347.16   1314.71   347.24   195.10  32.11  208.53  29.86  -13.43  43.85  
1 1 1 -6  -5  4  o 18 513.47  58.58  8601.24   1695.84  8305.04  2398.25  8897.46   2398.29  465.24  93.05  487.19  89.03  -21.96  128.78 
1 1 1 -6  -5  5  f 0  367.62  60.94  4453.16   1240.99  4453.16  1240.99  0.00      0.00     367.62  60.94  ?       ?      0.00    60.94  
1 1 1 -6  -5  6  x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  -5  7  o 9  523.13  57.87  8679.15   1709.01  8434.82  2416.87  8923.49   2416.93  485.34  90.06  502.89  86.86  -17.56  125.12 
1 1 1 -6  -5  8  o 12 479.55  51.60  7097.17   1398.11  7160.83  1977.22  7033.51   1977.23  463.09  77.08  458.17  77.96  4.92    109.64 
1 1 1 -6  -5  9  o 8  515.84  55.42  8201.76   1615.41  7338.99  2284.35  9064.83   2284.73  463.95  89.00  525.95  78.03  -61.99  118.37 
1 1 1 -6  -5  10 o 10 197.82  17.55  1138.53   197.21   961.99   245.82   1457.28   330.32   180.49  24.35  222.36  26.39  -41.87  35.91  
1 1 1 -6  -5  11 o 15 510.76  36.64  7711.05   1067.15  8134.86  1308.56  6869.53   1843.93  521.34  44.14  463.77  71.56  57.57   84.08  
1 1 1 -6  -5  12 o 12 161.72  15.34  760.85    140.72   636.42   179.97   956.62    225.74   146.61  22.07  180.34  22.28  -33.73  31.36  
1 1 1 -6  -5  13 o 16 155.01  21.16  709.63    183.42   709.63   183.42   0.00      0.00     155.01  21.16  ?       ?      0.00    21.16  
1 1 1 -6  -5  14 o 16 98.77   18.34  291.53    100.15   291.53   100.15   0.00      0.00     98.77   18.34  ?       ?      0.00    18.34  
1 1 1 -6  -5  15 o 14 161.76  25.68  783.34    230.49   783.34   230.49   0.00      0.00     161.76  25.68  ?       ?      0.00    25.68  
1 1 1 -6  -5  16 o 17 216.24  34.22  1415.33   410.72   1415.33  410.72   0.00      0.00     216.24  34.22  ?       ?      0.00    34.22  
1 1 1 -6  -5  17 o 2  422.50  70.91  5938.88   1659.00  5938.88  1659.00  0.00      0.00     422.50  70.91  ?       ?      0.00    70.91  
1 1 1 -6  -5  18 o 10 134.44  24.26  544.74    180.35   544.74   180.35   0.00      0.00     134.44  24.26  ?       ?      0.00    24.26  
1 1 1 -6  -5  19 o 6  138.42  21.58  574.12    165.91   574.12   165.91   0.00      0.00     138.42  21.58  ?       ?      0.00    21.58  
1 1 1 -6  -5  20 o 4  122.07  20.06  447.78    135.68   447.78   135.68   0.00      0.00     122.07  20.06  ?       ?      0.00    20.06  
1 1 1 -6  -5  21 o 1  238.18  34.72  1782.82   460.84   1799.87  577.79   1753.02   763.98   232.99  44.83  219.06  59.31  13.92   74.34  
1 1 1 -6  -5  22 o 16 111.87  20.28  381.24    125.47   383.53   128.34   331.59    596.62   112.09  20.71  122.93  51.15  -10.84  55.18  
1 1 1 -6  -5  23 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  -5  24 o 4  249.94  49.69  2298.95   687.81   2298.95  687.81   0.00      0.00     249.94  49.69  ?       ?      0.00    49.69  
1 1 1 -6  -5  25 o 17 131.06  36.07  592.70    279.93   592.70   279.93   0.00      0.00     131.06  36.07  ?       ?      0.00    36.07  
1 1 1 -6  -5  26 o 1  189.40  40.00  1295.95   421.20   1295.95  421.20   0.00      0.00     189.40  40.00  ?       ?      0.00    40.00  
1 1 1 -6  -4  1  o 7  310.27  32.74  2909.20   574.35   2796.26  812.29   3022.12   812.21   294.95  49.74  308.30  47.41  -13.35  68.71  
1 1 1 -6  -4  2  o 17 265.60  27.73  2108.15   416.56   2023.79  589.14   2192.48   589.06   254.04  41.85  265.61  39.86  -11.57  57.80  
1 1 1 -6  -4  3  o 18 475.72  53.76  7311.43   1442.35  7100.55  2039.79  7522.30   2039.79  435.66  84.61  452.46  81.53  -16.81  117.50 
1 1 1 -6  -4  4  o 18 190.71  19.68  1070.69   212.39   999.40   300.32   1142.03   300.40   181.27  29.90  194.77  27.64  -13.51  40.72  
1 1 1 -6  -4  5  x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  -4  6  o 11 186.54  28.29  1049.58   293.46   0.00     0.00     1049.58   293.46   ?       ?      186.54  28.29  0.00    28.29  
1 1 1 -6  -4  7  o 15 554.73  64.02  10161.50  2001.27  10232.32 2830.23  10090.69  2830.22  512.86  99.72  507.98  100.61 4.88    141.66 
1 1 1 -6  -4  8  o 11 122.44  12.67  436.97    87.75    450.55   124.09   423.37    124.11   123.40  18.05  119.42  18.72  3.99    26.00  
1 1 1 -6  -4  9  o 18 353.22  36.97  3747.71   738.58   3671.17  1044.50  3824.25   1044.53  340.64  55.31  348.56  53.94  -7.92   77.26  
1 1 1 -6  -4  10 o 4  493.87  52.99  7508.06   1478.85  7897.13  2091.47  7119.04   2091.34  489.47  76.97  460.31  82.16  29.17   112.58 
1 1 1 -6  -4  11 o 11 400.48  32.46  4728.34   739.95   4890.96  906.79   4404.27   1280.07  404.83  39.52  373.99  61.78  30.84   73.34  
1 1 1 -6  -4  12 o 2  178.25  18.44  927.55    185.93   1020.48  261.91   833.15    263.99   185.80  25.21  166.83  28.59  18.97   38.12  
1 1 1 -6  -4  13 o 19 201.67  17.32  1182.99   198.53   1202.30  249.99   1150.01   326.70   202.54  21.85  196.25  29.94  6.28    37.07  
1 1 1 -6  -4  14 o 5  435.50  35.03  5643.87   868.41   6136.00  1065.98  4672.70   1497.45  450.98  41.64  375.42  72.10  75.56   83.26  
1 1 1 -6  -4  15 o 11 474.42  45.14  6900.33   1214.54  6545.82  1489.27  7604.32   2098.67  452.35  58.74  467.89  81.07  -15.54  100.11 
1 1 1 -6  -4  16 o 4  180.74  14.92  950.39    153.47   1155.18  202.22   672.20    235.69   198.86  17.91  148.82  28.63  50.03   33.77  
1 1 1 -6  -4  17 o 1  32.14   16.23  -478.96   143.66   -478.96  143.66   0.00      0.00     32.14   16.23  ?       ?      0.00    16.23  
1 1 1 -6  -4  18 o 19 74.94   25.18  154.65    127.89   154.65   127.89   0.00      0.00     74.94   25.18  ?       ?      0.00    25.18  
1 1 1 -6  -4  19 o 11 57.25   20.61  80.76     86.47    80.76    86.47    0.00      0.00     57.25   20.61  ?       ?      0.00    20.61  
1 1 1 -6  -4  20 o 5  152.51  25.11  705.11    212.17   705.11   212.17   0.00      0.00     152.51  25.11  ?       ?      0.00    25.11  
1 1 1 -6  -4  21 o 17 217.61  28.15  1443.74   343.43   1447.67  410.99   1434.66   625.22   214.92  34.48  203.28  53.03  11.63   63.25  
1 1 1 -6  -4  22 o 1  198.22  27.58  1208.30   305.33   1227.44  349.69   1146.89   626.35   197.69  31.90  177.84  55.41  19.85   63.93  
1 1 1 -6  -4  23 o 1  177.04  29.08  986.08    285.32   986.08   285.32   0.00      0.00     177.04  29.08  ?       ?      0.00    29.08  
1 1 1 -6  -4  24 o 10 147.53  18.50  655.71    153.25   631.21   157.20   1125.36   688.33   144.35  19.47  166.39  58.33  -22.04  61.49  
1 1 1 -6  -4  25 o 17 102.36  17.74  319.92    100.44   319.92   100.44   0.00      0.00     102.36  17.74  ?       ?      0.00    17.74  
1 1 1 -6  -4  26 o 2  125.73  18.26  483.15    127.96   473.16   129.39   927.43    862.98   124.21  18.73  143.43  60.71  -19.22  63.53  
1 1 1 -6  -4  27 o 13 103.82  16.50  330.04    95.06    335.15   95.57    -147.62   924.59   104.66  16.45  107.38  51.58  -2.72   54.14  
1 1 1 -6  -3  1  o 4  326.11  34.41  3219.55   634.44   3228.10  897.28   3211.00   897.18   317.24  51.00  316.28  51.16  0.96    72.24  
1 1 1 -6  -3  2  o 9  202.04  20.85  1203.13   238.31   1130.39  337.05   1275.86   337.01   192.57  31.58  205.59  29.39  -13.02  43.14  
1 1 1 -6  -3  3  o 12 146.20  15.04  625.35    124.47   591.29   176.21   659.27    175.83   140.46  22.62  148.84  21.18  -8.38   30.99  
1 1 1 -6  -3  4  f 0  350.42  58.51  4074.95   1135.56  4074.95  1135.56  0.00      0.00     350.42  58.51  ?       ?      0.00    58.51  
1 1 1 -6  -3  5  x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  -3  6  o 8  196.70  20.29  1140.34   225.81   1090.84  319.32   1189.85   319.36   189.34  30.41  198.43  28.88  -9.10   41.94  
1 1 1 -6  -3  7  o 2  346.59  57.39  3954.69   1102.00  3954.69  1102.00  0.00      0.00     346.59  57.39  ?       ?      0.00    57.39  
1 1 1 -6  -3  8  o 19 131.37  13.52  503.77    100.53   452.17   142.00   555.62    142.34   122.93  20.87  137.08  18.57  -14.16  27.93  
1 1 1 -6  -3  9  o 7  427.29  46.12  5651.52   1113.33  5762.98  1574.51  5540.06   1574.47  414.50  68.56  404.82  70.30  9.69    98.20  
1 1 1 -6  -3  10 o 11 283.98  29.38  2393.42   471.97   2370.88  667.48   2415.96   667.46   277.48  43.32  280.36  42.83  -2.88   60.92  
1 1 1 -6  -3  11 f 0  298.95  30.84  2647.09   521.73   2711.90  737.83   2582.27   737.83   297.85  44.51  289.99  45.84  7.86    63.90  
1 1 1 -6  -3  12 o 2  212.83  19.14  1320.10   231.30   1268.51  286.36   1416.92   392.31   207.57  24.50  217.66  32.38  -10.08  40.61  
1 1 1 -6  -3  13 o 15 560.03  52.69  9567.00   1674.10  8937.57  2051.20  10822.72  2897.22  530.34  69.01  563.97  92.71  -33.64  115.57 
1 1 1 -6  -3  14 o 4  332.50  25.85  3237.95   489.57   3688.81  603.09   2366.74   838.33   353.86  29.97  274.06  55.20  79.80   62.81  
1 1 1 -6  -3  15 o 1  249.18  24.90  1829.06   351.48   2228.93  497.75   1431.40   496.38   273.10  32.38  215.09  41.71  58.00   52.80  
1 1 1 -6  -3  16 o 3  177.81  17.99  925.90    181.12   889.07   230.19   985.75    293.47   172.91  23.82  180.76  29.28  -7.85   37.75  
1 1 1 -6  -3  17 o 13 290.42  33.68  2536.81   551.18   2536.81  551.18   0.00      0.00     290.42  33.68  ?       ?      0.00    33.68  
1 1 1 -6  -3  18 o 17 286.44  41.18  2515.64   657.68   2515.64  657.68   0.00      0.00     286.44  41.18  ?       ?      0.00    41.18  
1 1 1 -6  -3  19 o 17 196.85  25.47  1153.80   281.13   1153.80  281.13   0.00      0.00     196.85  25.47  ?       ?      0.00    25.47  
1 1 1 -6  -3  20 o 14 119.28  18.88  424.53    125.00   424.53   125.00   0.00      0.00     119.28  18.88  ?       ?      0.00    18.88  
1 1 1 -6  -3  21 o 19 66.86   18.77  134.62    74.99    134.62   74.99    0.00      0.00     66.86   18.77  ?       ?      0.00    18.77  
1 1 1 -6  -3  22 o 10 112.86  20.61  386.87    128.64   386.87   128.64   0.00      0.00     112.86  20.61  ?       ?      0.00    20.61  
1 1 1 -6  -3  23 o 15 92.20   17.71  258.14    90.32    263.95   91.76    77.43     512.05   93.23   17.79  104.12  45.43  -10.89  48.79  
1 1 1 -6  -3  24 o 4  151.02  19.00  687.84    161.11   687.84   161.11   0.00      0.00     151.02  19.00  ?       ?      0.00    19.00  
1 1 1 -6  -3  25 o 2  64.32   19.23  125.85    76.44    121.56   76.98    431.80    649.76   63.41   19.37  123.78  52.55  -60.37  56.00  
1 1 1 -6  -3  26 o 6  52.22   17.73  76.86     63.42    79.22    63.68    -216.82   710.98   52.78   17.77  100.39  47.36  -47.61  50.58  
1 1 1 -6  -3  27 o 17 39.51   16.31  16.88     60.01    12.32    60.20    756.96    766.83   38.80   16.20  131.30  56.44  -92.50  58.72  
1 1 1 -6  -3  28 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  -2  1  o 9  237.03  24.44  1663.15   327.80   1687.54  463.65   1638.77   463.52   235.00  35.47  231.28  36.09  3.72    50.60  
1 1 1 -6  -2  2  o 12 78.50   8.46   179.37    37.51    178.30   53.01    180.44    53.09    77.67   12.30  78.15   12.23  -0.49   17.35  
1 1 1 -6  -2  3  o 11 97.47   10.19  276.74    56.19    256.19   79.68    297.07    79.26    92.84   15.50  100.39  14.14  -7.55   20.98  
1 1 1 -6  -2  4  x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  -2  5  o 8  146.27  22.02  639.25    179.16   0.00     0.00     639.25    179.16   ?       ?      146.27  22.02  0.00    22.02  
1 1 1 -6  -2  6  o 10 301.80  31.76  2749.44   542.00   2739.67  766.55   2759.21   766.45   293.04  47.17  294.23  46.95  -1.19   66.56  
1 1 1 -6  -2  7  o 11 190.11  28.93  1094.75   305.83   0.00     0.00     1094.75   305.83   ?       ?      190.11  28.93  0.00    28.93  
1 1 1 -6  -2  8  o 3  310.78  50.20  3103.97   865.05   0.00     0.00     3103.97   865.05   ?       ?      310.78  50.20  0.00    50.20  
1 1 1 -6  -2  9  o 6  313.77  50.33  3143.18   875.98   0.00     0.00     3143.18   875.98   ?       ?      313.77  50.33  0.00    50.33  
1 1 1 -6  -2  10 o 1  294.05  46.16  2703.45   753.60   0.00     0.00     2703.45   753.60   ?       ?      294.05  46.16  0.00    46.16  
1 1 1 -6  -2  11 f 0  207.46  31.41  1294.93   362.41   0.00     0.00     1294.93   362.41   ?       ?      207.46  31.41  0.00    31.41  
1 1 1 -6  -2  12 o 18 555.34  99.56  10977.35  3057.38  0.00     0.00     10977.35  3057.38  ?       ?      555.34  99.56  0.00    99.56  
1 1 1 -6  -2  13 f 0  414.97  44.71  5197.60   1048.32  5045.22  1487.88  5347.81   1477.28  396.84  67.74  410.51  64.84  -13.67  93.77  
1 1 1 -6  -2  14 o 17 466.56  51.70  6662.80   1361.56  6344.37  1930.64  6977.89   1920.49  437.42  79.82  462.81  74.84  -25.38  109.42 
1 1 1 -6  -2  15 o 10 106.34  10.86  328.90    65.36    402.84   89.74    245.36    95.39    117.44  13.56  90.40   18.99  27.04   23.33  
1 1 1 -6  -2  16 o 14 188.63  16.81  1038.00   180.18   1079.11  227.39   968.64    295.35   191.52  21.03  179.12  29.77  12.40   36.45  
1 1 1 -6  -2  17 o 6  212.22  22.84  1329.89   273.83   1329.89  273.83   0.00      0.00     212.22  22.84  ?       ?      0.00    22.84  
1 1 1 -6  -2  18 o 4  274.59  33.86  2272.38   522.41   2272.38  522.41   0.00      0.00     274.59  33.86  ?       ?      0.00    33.86  
1 1 1 -6  -2  19 o 15 397.34  37.50  4772.03   845.35   4772.03  845.35   0.00      0.00     397.34  37.50  ?       ?      0.00    37.50  
1 1 1 -6  -2  20 o 12 248.62  30.74  1866.20   429.40   1866.20  429.40   0.00      0.00     248.62  30.74  ?       ?      0.00    30.74  
1 1 1 -6  -2  21 o 1  168.78  20.10  846.37    190.93   846.37   190.93   0.00      0.00     168.78  20.10  ?       ?      0.00    20.10  
1 1 1 -6  -2  22 f 0  143.84  23.82  630.35    189.83   630.35   189.83   0.00      0.00     143.84  23.82  ?       ?      0.00    23.82  
1 1 1 -6  -2  23 o 4  320.19  32.09  3205.27   581.90   3258.02  690.54   3076.08   1080.72  317.14  38.73  275.95  68.53  41.19   78.72  
1 1 1 -6  -2  24 o 16 99.45   15.16  296.38    83.82    302.74   84.90    52.53     525.98   100.52  15.19  102.35  45.30  -1.82   47.78  
1 1 1 -6  -2  25 o 11 58.99   17.01  105.69    60.78    105.69   60.78    0.00      0.00     58.99   17.01  ?       ?      0.00    17.01  
1 1 1 -6  -2  26 o 7  66.84   15.93  137.70    60.25    140.95   60.53    -203.32   619.41   67.64   15.87  95.35   44.73  -27.71  47.46  
1 1 1 -6  -2  27 o 18 134.88  16.91  553.07    128.07   553.07   128.07   0.00      0.00     134.88  16.91  ?       ?      0.00    16.91  
1 1 1 -6  -2  28 o 2  93.68   45.61  -402.50   786.19   0.00     0.00     -402.50   786.19   ?       ?      93.68   45.61  0.00    45.61  
1 1 1 -6  -1  1  o 3  595.06  70.16  11943.70  2350.53  12079.75 3324.20  11807.67  3324.11  543.97  110.23 535.18  111.81 8.79    157.01 
1 1 1 -6  -1  2  o 7  378.08  40.27  4375.38   860.67   4476.97  1217.23  4273.80   1217.10  369.85  59.34  359.94  61.08  9.91    85.16  
1 1 1 -6  -1  3  o 15 405.83  70.20  5658.46   1576.26  0.00     0.00     5658.46   1576.26  ?       ?      405.83  70.20  0.00    70.20  
1 1 1 -6  -1  4  x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  -1  5  o 2  358.91  60.22  4296.38   1196.97  0.00     0.00     4296.38   1196.97  ?       ?      358.91  60.22  0.00    60.22  
1 1 1 -6  -1  6  o 17 361.68  61.35  4408.95   1228.31  0.00     0.00     4408.95   1228.31  ?       ?      361.68  61.35  0.00    61.35  
1 1 1 -6  -1  7  o 11 83.91   12.88  208.12    60.06    0.00     0.00     208.12    60.06    ?       ?      83.91   12.88  0.00    12.88  
1 1 1 -6  -1  8  o 15 343.78  36.63  3617.26   711.72   3688.79  1006.57  3545.73   1006.47  335.64  54.08  327.97  55.43  7.68    77.44  
1 1 1 -6  -1  9  o 8  388.65  41.95  4681.71   921.22   4772.34  1302.85  4591.09   1302.75  376.67  62.44  368.01  63.99  8.66    89.40  
1 1 1 -6  -1  10 o 9  342.80  36.23  3566.96   702.25   3609.20  993.17   3524.72   993.11   334.72  53.49  330.20  54.28  4.53    76.20  
1 1 1 -6  -1  11 o 12 154.95  15.97  701.88    139.99   728.88   198.66   675.25    197.31   156.53  22.78  150.35  23.64  6.18    32.83  
1 1 1 -6  -1  12 o 13 218.23  22.34  1398.54   275.97   1459.71  390.66   1337.59   389.91   220.56  31.77  210.49  33.38  10.07   46.08  
1 1 1 -6  -1  13 o 16 344.33  35.28  3531.16   687.49   4406.42  972.59   2657.12   971.91   380.82  45.38  288.10  60.69  92.73   75.78  
1 1 1 -6  -1  14 o 11 346.38  29.10  3529.21   573.28   3575.71  703.69   3437.43   988.56   346.53  35.89  332.59  53.60  13.93   64.51  
1 1 1 -6  -1  15 o 4  384.49  39.43  4435.98   857.88   5013.35  1213.47  3859.07   1212.99  401.78  53.97  346.93  63.24  54.86   83.14  
1 1 1 -6  -1  16 o 11 279.31  28.72  2314.68   453.92   2404.37  642.19   2225.14   641.68   280.14  41.16  268.51  43.09  11.62   59.59  
1 1 1 -6  -1  17 o 7  225.28  37.43  1561.36   467.02   1561.36  467.02   0.00      0.00     225.28  37.43  ?       ?      0.00    37.43  
1 1 1 -6  -1  18 o 15 316.58  52.53  3210.81   921.18   3210.81  921.18   0.00      0.00     316.58  52.53  ?       ?      0.00    52.53  
1 1 1 -6  -1  19 o 17 329.76  55.38  3499.59   1011.20  3499.59  1011.20  0.00      0.00     329.76  55.38  ?       ?      0.00    55.38  
1 1 1 -6  -1  20 o 4  67.86   27.85  50.45     173.68   50.45    173.68   0.00      0.00     67.86   27.85  ?       ?      0.00    27.85  
1 1 1 -6  -1  21 o 12 122.86  27.89  466.96    192.19   466.96   192.19   0.00      0.00     122.86  27.89  ?       ?      0.00    27.89  
1 1 1 -6  -1  22 o 11 344.01  40.89  3801.03   791.70   3801.03  791.70   0.00      0.00     344.01  40.89  ?       ?      0.00    40.89  
1 1 1 -6  -1  23 o 16 350.56  41.75  4033.45   823.73   4033.45  823.73   0.00      0.00     350.56  41.75  ?       ?      0.00    41.75  
1 1 1 -6  -1  24 o 13 165.30  17.95  816.95    167.58   807.48   177.37   895.62    511.37   163.85  19.22  155.99  50.25  7.87    53.80  
1 1 1 -6  -1  25 o 3  126.18  15.40  475.95    109.22   469.20   111.62   627.88    529.57   125.11  15.90  132.11  50.35  -7.00   52.80  
1 1 1 -6  -1  26 o 5  150.92  27.36  735.81    228.34   735.81   228.34   0.00      0.00     150.92  27.36  ?       ?      0.00    27.36  
1 1 1 -6  -1  27 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  -1  28 o 6  124.93  21.38  497.12    147.85   510.15   151.12   205.53    714.70   126.48  21.59  105.65  49.06  20.84   53.60  
1 1 1 -6  -1  29 o 7  118.19  13.25  420.57    88.36    428.23   88.89    -214.29   809.20   119.29  13.20  95.50   46.44  23.79   48.28  
1 1 1 -6  0   1  o 8  133.18  13.64  517.54    102.83   521.73   145.59   513.37    145.27   132.57  19.73  131.45  19.87  1.12    28.00  
1 1 1 -6  0   2  o 8  235.51  36.16  1696.66   473.26   0.00     0.00     1696.66   473.26   ?       ?      235.51  36.16  0.00    36.16  
1 1 1 -6  0   3  x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  0   4  o 1  347.08  57.33  3956.86   1102.44  0.00     0.00     3956.86   1102.44  ?       ?      347.08  57.33  0.00    57.33  
1 1 1 -6  0   5  o 19 264.53  41.51  2186.69   609.66   2186.69  609.66   0.00      0.00     264.53  41.51  ?       ?      0.00    41.51  
1 1 1 -6  0   6  o 3  339.09  36.10  3512.50   691.85   3523.08  978.47   3501.93   978.39   328.23  53.79  327.09  53.99  1.15    76.21  
1 1 1 -6  0   7  o 9  262.02  27.28  2053.92   404.34   2085.59  571.88   2022.27   571.76   258.41  39.83  254.01  40.57  4.40    56.86  
1 1 1 -6  0   8  o 4  156.03  15.91  713.50    140.49   756.11   198.80   671.00    198.57   159.14  22.38  149.32  23.98  9.82    32.80  
1 1 1 -6  0   9  o 14 376.42  40.43  4387.24   860.01   4593.59  1216.31  4180.93   1216.17  370.91  59.11  350.55  62.74  20.36   86.20  
1 1 1 -6  0   10 o 9  190.34  28.90  1095.37   305.89   1095.37  305.89   0.00      0.00     190.34  28.90  ?       ?      0.00    28.90  
1 1 1 -6  0   11 f 0  123.89  19.15  456.16    131.84   456.16   131.84   0.00      0.00     123.89  19.15  ?       ?      0.00    19.15  
1 1 1 -6  0   12 o 16 429.23  72.48  6183.07   1722.48  6183.07  1722.48  0.00      0.00     429.23  72.48  ?       ?      0.00    72.48  
1 1 1 -6  0   13 o 14 351.55  55.41  3879.25   1081.30  3879.25  1081.30  0.00      0.00     351.55  55.41  ?       ?      0.00    55.41  
1 1 1 -6  0   14 o 5  167.83  25.33  837.39    236.45   837.39   236.45   0.00      0.00     167.83  25.33  ?       ?      0.00    25.33  
1 1 1 -6  0   15 o 19 495.77  84.63  8336.58   2322.12  8336.58  2322.12  0.00      0.00     495.77  84.63  ?       ?      0.00    84.63  
1 1 1 -6  0   16 o 11 162.76  24.74  789.89    223.85   789.89   223.85   0.00      0.00     162.76  24.74  ?       ?      0.00    24.74  
1 1 1 -6  0   17 f 0  163.46  25.03  800.24    227.40   800.24   227.40   0.00      0.00     163.46  25.03  ?       ?      0.00    25.03  
1 1 1 -6  0   18 o 6  227.11  19.39  1511.64   250.40   1511.64  250.40   0.00      0.00     227.11  19.39  ?       ?      0.00    19.39  
1 1 1 -6  0   19 o 8  329.05  39.20  3310.73   725.87   3310.73  725.87   0.00      0.00     329.05  39.20  ?       ?      0.00    39.20  
1 1 1 -6  0   20 o 13 196.19  30.36  1165.98   330.91   1165.98  330.91   0.00      0.00     196.19  30.36  ?       ?      0.00    30.36  
1 1 1 -6  0   21 o 10 129.89  15.90  497.23    116.10   497.23   116.10   0.00      0.00     129.89  15.90  ?       ?      0.00    15.90  
1 1 1 -6  0   22 o 7  181.85  20.51  986.28    210.43   986.28   210.43   0.00      0.00     181.85  20.51  ?       ?      0.00    20.51  
1 1 1 -6  0   23 o 19 212.16  24.33  1366.01   290.99   1366.01  290.99   0.00      0.00     212.16  24.33  ?       ?      0.00    24.33  
1 1 1 -6  0   24 o 10 191.64  32.19  1179.57   341.64   1179.57  341.64   0.00      0.00     191.64  32.19  ?       ?      0.00    32.19  
1 1 1 -6  0   25 o 18 317.15  78.04  5053.24   1411.07  5053.24  1411.07  0.00      0.00     317.15  78.04  ?       ?      0.00    78.04  
1 1 1 -6  0   26 o 16 102.72  19.79  328.41    112.47   328.41   112.47   0.00      0.00     102.72  19.79  ?       ?      0.00    19.79  
1 1 1 -6  0   27 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  0   28 o 3  105.23  13.19  333.06    77.91    333.89   78.43    272.04    673.75   105.33  13.26  106.25  48.72  -0.92   50.50  
1 1 1 -6  0   29 o 18 53.50   14.20  88.94     44.35    88.37    44.43    238.98    720.92   53.34   14.24  102.19  48.05  -48.86  50.11  
1 1 1 -6  1   1  o 10 184.56  27.89  1024.41   286.32   0.00     0.00     1024.41   286.32   ?       ?      184.56  27.89  0.00    27.89  
1 1 1 -6  1   2  o 3  276.78  43.32  2388.24   665.79   0.00     0.00     2388.24   665.79   ?       ?      276.78  43.32  0.00    43.32  
1 1 1 -6  1   3  x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  1   4  o 18 236.41  24.44  1657.92   326.94   1664.27  462.42   1651.58   462.30   232.76  35.75  231.79  35.90  0.97    50.66  
1 1 1 -6  1   5  o 10 221.15  34.03  1498.56   418.18   1498.56  418.18   0.00      0.00     221.15  34.03  ?       ?      0.00    34.03  
1 1 1 -6  1   6  o 18 102.81  10.65  308.08    61.95    307.26   87.77    308.89    87.45    101.82  15.50  102.12  15.40  -0.30   21.85  
1 1 1 -6  1   7  o 14 485.74  104.11 10110.26  2815.77  10110.26 2815.77  0.00      0.00     485.74  104.11 ?       ?      0.00    104.11 
1 1 1 -6  1   8  o 6  296.32  47.90  2824.04   787.00   2824.04  787.00   0.00      0.00     296.32  47.90  ?       ?      0.00    47.90  
1 1 1 -6  1   9  o 11 140.99  21.23  594.00    166.48   594.00   166.48   0.00      0.00     140.99  21.23  ?       ?      0.00    21.23  
1 1 1 -6  1   10 o 12 319.86  52.11  3314.64   923.90   3314.64  923.90   0.00      0.00     319.86  52.11  ?       ?      0.00    52.11  
1 1 1 -6  1   11 o 12 380.63  64.11  4848.98   1351.02  4848.98  1351.02  0.00      0.00     380.63  64.11  ?       ?      0.00    64.11  
1 1 1 -6  1   12 o 13 524.30  57.00  8747.81   1688.13  9960.21  2387.58  7535.83   2387.17  536.09  80.03  448.96  95.56  87.13   124.64 
1 1 1 -6  1   13 o 3  107.18  16.45  339.54    97.96    0.00     0.00     339.54    97.96    ?       ?      107.18  16.45  0.00    16.45  
1 1 1 -6  1   14 o 14 374.63  38.81  4208.01   822.59   4428.38  1163.51  3987.77   1163.14  376.46  55.50  355.01  59.15  21.45   81.11  
1 1 1 -6  1   15 o 4  421.89  37.50  5315.80   898.80   5011.64  1101.59  5921.52   1554.54  404.41  48.41  429.84  65.03  -25.44  81.07  
1 1 1 -6  1   16 o 12 198.32  22.98  1160.08   256.75   1160.08  256.75   0.00      0.00     198.32  22.98  ?       ?      0.00    22.98  
1 1 1 -6  1   17 o 15 355.34  58.34  4121.67   1148.81  4121.67  1148.81  0.00      0.00     355.34  58.34  ?       ?      0.00    58.34  
1 1 1 -6  1   18 o 15 196.27  19.58  1132.87   217.72   1132.87  217.72   0.00      0.00     196.27  19.58  ?       ?      0.00    19.58  
1 1 1 -6  1   19 o 19 39.21   15.13  28.98     48.19    28.98    48.19    0.00      0.00     39.21   15.13  ?       ?      0.00    15.13  
1 1 1 -6  1   20 o 9  127.84  20.95  488.61    148.40   488.61   148.40   0.00      0.00     127.84  20.95  ?       ?      0.00    20.95  
1 1 1 -6  1   21 o 3  271.91  43.74  2360.21   659.62   2360.21  659.62   0.00      0.00     271.91  43.74  ?       ?      0.00    43.74  
1 1 1 -6  1   22 o 8  50.44   16.19  72.61     53.13    72.61    53.13    0.00      0.00     50.44   16.19  ?       ?      0.00    16.19  
1 1 1 -6  1   23 f 0  249.10  41.76  2058.99   576.04   2058.99  576.04   0.00      0.00     249.10  41.76  ?       ?      0.00    41.76  
1 1 1 -6  1   24 o 2  197.43  20.87  1177.22   233.02   1177.22  233.02   0.00      0.00     197.43  20.87  ?       ?      0.00    20.87  
1 1 1 -6  1   25 o 3  75.56   11.63  170.21    48.83    170.21   48.83    0.00      0.00     75.56   11.63  ?       ?      0.00    11.63  
1 1 1 -6  1   26 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  1   27 o 3  158.10  25.15  806.57    220.65   840.86   238.94   608.00    575.04   160.25  26.93  122.89  50.59  37.36   57.31  
1 1 1 -6  1   28 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  1   29 o 13 126.83  22.77  528.64    159.69   528.64   159.69   0.00      0.00     126.83  22.77  ?       ?      0.00    22.77  
1 1 1 -6  2   1  o 8  323.47  52.13  3355.17   935.05   0.00     0.00     3355.17   935.05   ?       ?      323.47  52.13  0.00    52.13  
1 1 1 -6  2   2  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  2   3  o 19 297.78  47.55  2818.48   785.56   0.00     0.00     2818.48   785.56   ?       ?      297.78  47.55  0.00    47.55  
1 1 1 -6  2   4  o 16 315.35  33.32  3011.31   594.06   2961.35  840.16   3061.26   840.09   303.35  49.98  309.17  48.96  -5.82   69.97  
1 1 1 -6  2   5  o 3  273.00  28.43  2233.16   439.08   2308.26  621.04   2158.10   620.86   271.70  41.10  261.68  42.81  10.03   59.35  
1 1 1 -6  2   6  o 11 292.12  30.70  2575.46   507.07   2610.35  717.17   2540.58   717.03   286.42  45.11  282.05  45.86  4.37    64.32  
1 1 1 -6  2   7  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  2   8  f 0  236.39  36.86  1735.35   483.95   1735.35  483.95   0.00      0.00     236.39  36.86  ?       ?      0.00    36.86  
1 1 1 -6  2   9  o 4  174.38  26.46  918.14    256.56   918.14   256.56   0.00      0.00     174.38  26.46  ?       ?      0.00    26.46  
1 1 1 -6  2   10 o 6  235.39  24.06  1644.05   320.62   1790.80  453.51   1497.40   453.34   242.27  33.50  219.66  37.28  22.61   50.12  
1 1 1 -6  2   11 o 12 368.33  39.23  4152.32   816.79   4195.90  1155.15  4108.75   1155.07  357.71  58.26  353.34  59.02  4.36    82.93  
1 1 1 -6  2   12 o 19 251.30  25.89  1868.92   368.18   1883.33  520.74   1854.51   520.63   248.25  37.73  246.17  38.07  2.07    53.60  
1 1 1 -6  2   13 o 19 186.98  18.89  1022.89   199.96   1089.34  283.14   956.78    282.43   191.36  26.48  178.61  28.50  12.74   38.91  
1 1 1 -6  2   14 o 8  381.75  39.15  4376.31   845.81   4749.24  1196.31  4003.56   1196.00  389.94  54.97  354.26  61.01  35.68   82.12  
1 1 1 -6  2   15 o 10 264.36  20.58  2038.69   309.91   2169.04  381.04   1783.97   532.66   271.80  24.69  241.85  39.74  29.94   46.79  
1 1 1 -6  2   16 o 10 176.28  16.03  905.77    160.40   1204.82  228.03   612.84    225.68   202.79  19.84  142.03  28.67  60.76   34.86  
1 1 1 -6  2   17 o 18 419.02  46.59  5486.09   1101.81  5486.09  1101.81  0.00      0.00     419.02  46.59  ?       ?      0.00    46.59  
1 1 1 -6  2   18 o 19 163.09  17.66  781.88    162.71   781.88   162.71   0.00      0.00     163.09  17.66  ?       ?      0.00    17.66  
1 1 1 -6  2   19 o 18 132.38  15.22  513.95    113.53   513.95   113.53   0.00      0.00     132.38  15.22  ?       ?      0.00    15.22  
1 1 1 -6  2   20 o 16 148.38  16.44  646.23    137.71   646.23   137.71   0.00      0.00     148.38  16.44  ?       ?      0.00    16.44  
1 1 1 -6  2   21 o 11 86.74   18.26  227.57    88.05    227.57   88.05    0.00      0.00     86.74   18.26  ?       ?      0.00    18.26  
1 1 1 -6  2   22 o 9  67.57   10.55  135.11    39.60    135.11   39.60    0.00      0.00     67.57   10.55  ?       ?      0.00    10.55  
1 1 1 -6  2   23 o 8  68.61   10.83  139.67    41.25    139.67   41.25    0.00      0.00     68.61   10.83  ?       ?      0.00    10.83  
1 1 1 -6  2   24 o 3  143.23  15.28  608.94    123.67   608.94   123.67   0.00      0.00     143.23  15.28  ?       ?      0.00    15.28  
1 1 1 -6  2   25 o 12 150.56  24.41  712.94    203.73   712.94   203.73   0.00      0.00     150.56  24.41  ?       ?      0.00    24.41  
1 1 1 -6  2   26 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  2   27 o 11 199.15  36.31  1419.84   399.87   1419.84  399.87   0.00      0.00     199.15  36.31  ?       ?      0.00    36.31  
1 1 1 -6  2   28 o 9  82.26   16.86  212.17    76.96    209.54   77.87    322.28    503.63   81.62   17.16  101.80  44.72  -20.17  47.90  
1 1 1 -6  2   29 o 10 73.73   11.39  164.47    46.64    165.48   46.79    7.52      583.59   73.96   11.38  88.88   42.21  -14.92  43.72  
1 1 1 -6  3   1  o 11 267.60  42.10  2241.02   625.33   2241.02  625.33   0.00      0.00     267.60  42.10  ?       ?      0.00    42.10  
1 1 1 -6  3   2  x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  3   3  o 7  139.03  20.95  576.75    162.00   0.00     0.00     576.75    162.00   ?       ?      139.03  20.95  0.00    20.95  
1 1 1 -6  3   4  o 6  226.79  23.46  1525.71   301.04   1532.28  425.84   1519.14   425.65   223.34  34.31  222.30  34.47  1.04    48.63  
1 1 1 -6  3   5  o 13 143.69  14.83  604.62    120.60   552.81   170.68   656.29    170.44   135.51  22.75  148.50  20.54  -12.99  30.65  
1 1 1 -6  3   6  o 3  218.32  22.49  1413.67   277.90   1514.54  393.16   1312.95   392.86   222.73  31.64  205.99  34.44  16.74   46.76  
1 1 1 -6  3   7  o 14 238.06  37.20  1762.63   491.70   1762.63  491.70   0.00      0.00     238.06  37.20  ?       ?      0.00    37.20  
1 1 1 -6  3   8  o 14 451.18  90.39  8112.57   2259.53  8112.57  2259.53  0.00      0.00     451.18  90.39  ?       ?      0.00    90.39  
1 1 1 -6  3   9  o 2  438.34  48.85  6143.26   1208.29  6261.76  1708.84  6024.79   1708.72  417.04  74.09  406.84  75.95  10.20   106.11 
1 1 1 -6  3   10 o 8  330.52  54.31  3569.42   994.75   3569.42  994.75   0.00      0.00     330.52  54.31  ?       ?      0.00    54.31  
1 1 1 -6  3   11 o 18 236.11  36.34  1708.90   476.82   0.00     0.00     1708.90   476.82   ?       ?      236.11  36.34  0.00    36.34  
1 1 1 -6  3   12 o 18 240.39  24.23  1704.44   329.85   1890.79  466.63   1518.33   466.33   250.51  33.27  222.48  37.87  28.03   50.41  
1 1 1 -6  3   13 o 16 263.55  27.04  2051.91   403.30   2083.11  570.51   2020.73   570.21   261.64  39.19  257.37  39.88  4.27    55.91  
1 1 1 -6  3   14 o 10 183.13  27.50  1000.88   280.18   1000.88  280.18   0.00      0.00     183.13  27.50  ?       ?      0.00    27.50  
1 1 1 -6  3   15 o 16 246.35  37.47  1841.27   513.27   0.00     0.00     1841.27   513.27   ?       ?      246.35  37.47  0.00    37.47  
1 1 1 -6  3   16 o 19 172.15  19.06  870.46    185.25   709.05   262.12   1031.54   261.84   152.31  31.03  186.16  25.14  -33.84  39.94  
1 1 1 -6  3   17 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  3   18 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  3   19 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  3   20 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  3   21 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  3   22 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  3   23 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  3   24 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  3   25 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  3   26 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  3   27 o 19 130.29  13.01  507.17    96.04    507.17   96.04    0.00      0.00     130.29  13.01  ?       ?      0.00    13.01  
1 1 1 -6  3   28 o 3  84.29   10.96  212.60    51.78    212.60   51.78    0.00      0.00     84.29   10.96  ?       ?      0.00    10.96  
1 1 1 -6  3   29 o 1  127.49  22.51  539.23    158.69   539.23   158.69   0.00      0.00     127.49  22.51  ?       ?      0.00    22.51  
1 1 1 -6  4   1  o 18 243.59  38.01  1841.39   514.20   1841.39  514.20   0.00      0.00     243.59  38.01  ?       ?      0.00    38.01  
1 1 1 -6  4   2  o 18 206.14  31.65  1297.61   362.57   0.00     0.00     1297.61   362.57   ?       ?      206.14  31.65  0.00    31.65  
1 1 1 -6  4   3  o 13 168.10  25.52  851.55    238.50   0.00     0.00     851.55    238.50   ?       ?      168.10  25.52  0.00    25.52  
1 1 1 -6  4   4  o 9  126.92  19.23  480.21    135.74   0.00     0.00     480.21    135.74   ?       ?      126.92  19.23  0.00    19.23  
1 1 1 -6  4   5  o 13 361.88  62.67  4503.41   1254.83  4503.41  1254.83  0.00      0.00     361.88  62.67  ?       ?      0.00    62.67  
1 1 1 -6  4   6  o 13 290.71  30.62  2555.32   503.37   2604.34  711.93   2506.31   711.81   285.66  44.89  279.48  45.96  6.18    64.25  
1 1 1 -6  4   7  o 11 244.83  38.46  1873.79   522.71   1873.79  522.71   0.00      0.00     244.83  38.46  ?       ?      0.00    38.46  
1 1 1 -6  4   8  o 14 223.44  34.61  1539.36   429.62   1539.36  429.62   0.00      0.00     223.44  34.61  ?       ?      0.00    34.61  
1 1 1 -6  4   9  o 14 296.58  30.91  2651.65   518.50   2990.20  733.39   2313.32   733.15   308.94  42.48  267.13  49.63  41.81   65.33  
1 1 1 -6  4   10 o 3  116.96  17.89  406.25    116.30   406.25   116.30   0.00      0.00     116.96  17.89  ?       ?      0.00    17.89  
1 1 1 -6  4   11 o 19 287.08  45.02  2574.43   717.64   0.00     0.00     2574.43   717.64   ?       ?      287.08  45.02  0.00    45.02  
1 1 1 -6  4   12 o 2  204.75  20.81  1230.36   241.20   1368.47  341.12   1092.27   341.10   214.13  28.45  189.79  32.47  24.34   43.18  
1 1 1 -6  4   13 o 4  538.70  59.77  9180.48   1817.16  8712.23  2569.84  9648.73   2569.87  493.15  94.21  525.78  88.27  -32.63  129.10 
1 1 1 -6  4   14 o 11 245.11  25.62  1771.55   355.18   1569.55  502.16   1973.76   502.43   226.23  40.14  256.07  35.10  -29.84  53.32  
1 1 1 -6  4   15 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  4   16 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  4   17 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  4   18 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  4   19 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  4   20 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  4   21 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  4   22 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  4   23 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  4   24 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  4   25 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  4   26 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  4   27 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  4   28 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  4   29 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  5   1  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  5   2  o 8  204.52  21.16  1237.19   244.81   1247.77  346.36   1226.62   346.08   202.19  30.81  200.33  31.10  1.86    43.78  
1 1 1 -6  5   3  o 7  103.21  11.03  310.87    64.34    286.91   91.14    334.68    90.83    98.02   16.80  106.36  15.32  -8.34   22.73  
1 1 1 -6  5   4  o 5  55.97   11.78  93.87     36.64    0.00     0.00     93.87     36.64    ?       ?      55.97   11.78  0.00    11.78  
1 1 1 -6  5   5  o 11 297.03  48.36  2856.06   796.31   0.00     0.00     2856.06   796.31   ?       ?      297.03  48.36  0.00    48.36  
1 1 1 -6  5   6  o 15 255.86  26.66  1959.44   385.83   2119.34  545.82   1799.73   545.48   261.27  37.46  238.51  41.34  22.77   55.79  
1 1 1 -6  5   7  o 12 170.11  17.45  850.28    168.01   954.34   237.96   746.84    237.25   178.66  23.79  156.65  27.38  22.01   36.27  
1 1 1 -6  5   8  o 16 308.03  49.99  3061.89   853.64   3061.89  853.64   0.00      0.00     308.03  49.99  ?       ?      0.00    49.99  
1 1 1 -6  5   9  o 3  211.69  32.43  1365.48   381.57   1365.48  381.57   0.00      0.00     211.69  32.43  ?       ?      0.00    32.43  
1 1 1 -6  5   10 o 1  285.64  44.89  2552.40   711.77   0.00     0.00     2552.40   711.77   ?       ?      285.64  44.89  0.00    44.89  
1 1 1 -6  5   11 o 14 461.35  80.82  7404.98   2062.55  0.00     0.00     7404.98   2062.55  ?       ?      461.35  80.82  0.00    80.82  
1 1 1 -6  5   12 o 1  188.72  19.32  1043.09   206.39   1033.78  291.73   1052.41   292.02   185.82  28.24  187.59  27.97  -1.77   39.74  
1 1 1 -6  5   13 o 17 296.44  30.66  2609.05   514.21   2605.77  727.22   2612.33   727.18   290.90  45.00  291.30  44.93  -0.40   63.59  
1 1 1 -6  5   14 o 3  336.77  35.25  3398.50   671.45   3841.97  949.73   2955.32   949.42   352.19  48.24  304.12  56.46  48.07   74.26  
1 1 1 -6  5   15 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  5   16 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  5   17 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  5   18 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  5   19 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  5   20 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  5   21 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  5   22 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  5   23 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  5   24 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  5   25 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  5   26 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  5   27 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  5   28 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  5   29 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  6   1  o 18 270.15  42.96  2306.83   643.91   0.00     0.00     2306.83   643.91   ?       ?      270.15  42.96  0.00    42.96  
1 1 1 -6  6   2  o 11 74.76   9.20   163.45    38.65    156.68   55.24    169.94    54.08    72.40   13.79  75.63   12.92  -3.23   18.90  
1 1 1 -6  6   3  f 0  115.20  17.95  395.16    114.84   395.16   114.84   0.00      0.00     115.20  17.95  ?       ?      0.00    17.95  
1 1 1 -6  6   4  o 17 48.18   8.57   68.85     22.84    70.55    34.74    67.55     30.32    48.50   12.42  47.44   11.30  1.06    16.79  
1 1 1 -6  6   5  o 11 294.16  47.38  2771.85   772.98   0.00     0.00     2771.85   772.98   ?       ?      294.16  47.38  0.00    47.38  
1 1 1 -6  6   6  o 8  292.21  46.85  2723.40   759.37   0.00     0.00     2723.40   759.37   ?       ?      292.21  46.85  0.00    46.85  
1 1 1 -6  6   7  o 12 370.46  39.79  4225.43   832.88   4161.67  1177.80  4289.20   1177.94  353.15  60.26  359.51  59.13  -6.37   84.42  
1 1 1 -6  6   8  o 13 223.67  23.12  1478.83   292.64   1395.19  413.78   1562.52   413.92   213.29  35.01  226.83  32.73  -13.54  47.93  
1 1 1 -6  6   9  o 16 390.95  65.55  5093.09   1419.13  5093.09  1419.13  0.00      0.00     390.95  65.55  ?       ?      0.00    65.55  
1 1 1 -6  6   10 o 17 266.40  41.10  2180.38   608.41   2180.38  608.41   0.00      0.00     266.40  41.10  ?       ?      0.00    41.10  
1 1 1 -6  6   11 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  6   12 o 14 471.47  50.79  6873.81   1353.00  7445.49  1913.62  6302.35   1913.24  474.29  72.59  429.30  80.59  45.00   108.46 
1 1 1 -6  6   13 o 7  497.47  54.25  7744.93   1524.13  8011.79  2155.64  7478.17   2155.26  483.75  80.45  463.73  84.05  20.02   116.35 
1 1 1 -6  6   14 f 0  323.30  33.85  3137.90   618.96   3126.86  875.78   3148.92   874.90   314.89  50.13  316.17  49.85  -1.28   70.70  
1 1 1 -6  6   15 o 2  229.66  35.38  1618.19   451.56   0.00     0.00     1618.19   451.56   ?       ?      229.66  35.38  0.00    35.38  
1 1 1 -6  6   16 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  6   17 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  6   18 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  6   19 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  6   20 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  6   21 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  6   22 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  6   23 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  6   24 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  6   25 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  6   26 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  6   27 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  6   28 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  6   29 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  7   1  o 9  104.48  11.48  318.65    67.72    314.45   96.15    322.78    95.41    102.81  16.88  104.27  16.49  -1.46   23.59  
1 1 1 -6  7   2  o 3  302.60  31.80  2756.96   544.24   2739.52  769.87   2774.38   769.47   293.79  47.25  295.91  46.86  -2.12   66.54  
1 1 1 -6  7   3  o 3  269.95  28.15  2176.38   429.85   2106.33  608.04   2246.38   607.77   259.46  42.28  268.92  40.64  -9.46   58.64  
1 1 1 -6  7   4  o 16 363.13  38.78  4037.00   795.89   4073.77  1125.61  4000.24   1125.52  352.32  57.64  348.59  58.30  3.73    81.99  
1 1 1 -6  7   5  o 4  284.87  29.74  2428.03   479.20   2374.70  677.86   2481.30   677.52   275.11  44.43  281.94  43.24  -6.83   62.00  
1 1 1 -6  7   6  o 1  136.54  14.28  544.66    110.26   534.60   156.31   554.63    155.56   133.91  21.03  136.57  20.47  -2.66   29.35  
1 1 1 -6  7   7  o 3  521.03  101.32 10488.16  2921.50  0.00     0.00     10488.16  2921.50  ?       ?      521.03  101.32 0.00    101.32 
1 1 1 -6  7   8  o 11 507.42  93.57  9423.84   2625.23  0.00     0.00     9423.84   2625.23  ?       ?      507.42  93.57  0.00    93.57  
1 1 1 -6  7   9  o 13 252.05  38.72  1937.24   542.38   1937.24  542.38   0.00      0.00     252.05  38.72  ?       ?      0.00    38.72  
1 1 1 -6  7   10 o 14 129.50  13.98  489.37    102.29   534.13   147.18   447.54    142.27   134.35  19.67  122.49  20.99  11.86   28.76  
1 1 1 -6  7   11 o 14 599.95  121.42 14497.68  4038.16  14497.68 4038.16  0.00      0.00     599.95  121.42 ?       ?      0.00    121.42 
1 1 1 -6  7   12 f 0  454.65  78.07  7049.05   1964.23  7049.05  1964.23  0.00      0.00     454.65  78.07  ?       ?      0.00    78.07  
1 1 1 -6  7   13 o 1  411.50  69.87  5708.33   1591.51  5708.33  1591.51  0.00      0.00     411.50  69.87  ?       ?      0.00    69.87  
1 1 1 -6  7   14 o 17 242.51  37.65  1815.91   507.15   0.00     0.00     1815.91   507.15   ?       ?      242.51  37.65  0.00    37.65  
1 1 1 -6  7   15 o 19 302.79  49.41  2973.91   829.18   0.00     0.00     2973.91   829.18   ?       ?      302.79  49.41  0.00    49.41  
1 1 1 -6  7   16 o 8  256.86  29.65  1996.29   429.24   0.00     0.00     1996.29   429.24   ?       ?      256.86  29.65  0.00    29.65  
1 1 1 -6  7   17 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  7   18 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  7   19 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  7   20 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  7   21 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  7   22 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  7   23 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  7   24 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  7   25 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  7   26 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  7   27 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  7   28 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  8   1  o 12 199.63  20.58  1169.93   232.51   1096.02  328.77   1243.88   328.87   190.46  31.15  203.81  28.92  -13.36  42.50  
1 1 1 -6  8   2  o 11 317.43  33.15  3015.24   595.10   3009.02  841.73   3021.46   841.48   310.01  48.92  310.73  48.78  -0.72   69.08  
1 1 1 -6  8   3  o 15 67.28   10.08  133.19    37.75    144.61   55.70    123.48    51.35    69.50   14.43  64.15   14.31  5.35    20.32  
1 1 1 -6  8   4  o 14 367.96  59.58  4358.72   1215.48  4358.72  1215.48  0.00      0.00     367.96  59.58  ?       ?      0.00    59.58  
1 1 1 -6  8   5  o 12 362.64  58.36  4208.10   1173.71  4208.10  1173.71  0.00      0.00     362.64  58.36  ?       ?      0.00    58.36  
1 1 1 -6  8   6  o 11 447.42  48.06  6161.24   1215.07  5894.76  1718.39  6427.70   1718.36  419.29  74.10  441.34  70.17  -22.05  102.05 
1 1 1 -6  8   7  o 1  269.91  27.93  2155.50   426.58   2225.29  604.24   2086.15   602.33   270.16  40.18  260.88  41.62  9.28    57.85  
1 1 1 -6  8   8  o 9  223.35  33.96  1504.82   421.77   0.00     0.00     1504.82   421.77   ?       ?      223.35  33.96  0.00    33.96  
1 1 1 -6  8   9  x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  8   10 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  8   11 o 17 427.76  46.06  5636.16   1113.24  5560.80  1575.08  5711.38   1573.65  408.04  69.75  414.62  68.50  -6.58   97.76  
1 1 1 -6  8   12 o 17 163.55  17.34  784.32    160.32   789.24   232.89   779.89    221.04   162.04  25.91  161.40  24.64  0.65    35.75  
1 1 1 -6  8   13 o 2  345.51  57.89  3960.60   1107.72  3960.60  1107.72  0.00      0.00     345.51  57.89  ?       ?      0.00    57.89  
1 1 1 -6  8   14 o 3  249.36  40.82  1962.02   564.19   1962.02  564.19   0.00      0.00     249.36  40.82  ?       ?      0.00    40.82  
1 1 1 -6  8   15 o 13 201.53  19.04  1196.22   217.66   1763.52  331.99   768.58    288.25   243.38  24.08  156.90  33.05  86.48   40.89  
1 1 1 -6  8   16 o 5  361.83  33.92  3987.07   696.37   2913.40  1221.17  4504.46   847.71   278.97  74.75  381.13  39.31  -102.16 84.45  
1 1 1 -6  8   17 o 5  257.47  39.29  2078.43   562.34   0.00     0.00     2078.43   562.34   ?       ?      257.47  39.29  0.00    39.29  
1 1 1 -6  8   18 o 12 176.25  18.22  917.24    181.66   0.00     0.00     917.24    181.66   ?       ?      176.25  18.22  0.00    18.22  
1 1 1 -6  8   19 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  8   20 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  8   21 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  8   22 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  8   23 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  8   24 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  8   25 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  8   26 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  8   27 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  8   28 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  9   1  o 17 430.04  70.37  6013.71   1677.25  6013.71  1677.25  0.00      0.00     430.04  70.37  ?       ?      0.00    70.37  
1 1 1 -6  9   2  o 14 544.43  97.51  10535.77  2935.60  10535.77 2935.60  0.00      0.00     544.43  97.51  ?       ?      0.00    97.51  
1 1 1 -6  9   3  o 19 532.66  94.64  10005.62  2787.88  0.00     0.00     10005.62  2787.88  ?       ?      532.66  94.64  0.00    94.64  
1 1 1 -6  9   4  o 17 206.66  21.36  1252.07   249.71   1155.19  353.66   1348.38   352.64   195.69  32.63  212.58  29.71  -16.88  44.13  
1 1 1 -6  9   5  o 18 457.52  49.01  6420.04   1267.15  6152.56  1792.18  6687.43   1791.85  430.15  75.32  451.76  71.47  -21.61  103.83 
1 1 1 -6  9   6  o 8  308.93  32.07  2837.77   560.43   2942.17  793.29   2733.76   791.85   309.17  46.10  296.96  48.09  12.21   66.62  
1 1 1 -6  9   7  o 17 397.95  42.02  4799.05   945.55   4904.27  1337.69  4693.97   1336.74  391.13  61.61  381.46  63.26  9.67    88.30  
1 1 1 -6  9   8  o 19 548.53  60.86  9595.63   1884.14  9966.75  2665.17  9224.84   2663.98  528.96  91.05  503.51  95.66  25.44   132.07 
1 1 1 -6  9   9  o 4  225.76  23.13  1501.31   295.50   1676.42  420.46   1330.40   415.39   236.17  31.82  208.62  35.98  27.55   48.04  
1 1 1 -6  9   10 f 0  472.42  87.27  8181.51   2279.71  0.00     0.00     8181.51   2279.71  ?       ?      472.42  87.27  0.00    87.27  
1 1 1 -6  9   11 o 19 231.81  36.03  1653.76   463.85   0.00     0.00     1653.76   463.85   ?       ?      231.81  36.03  0.00    36.03  
1 1 1 -6  9   12 o 2  319.91  52.94  3361.54   938.22   0.00     0.00     3361.54   938.22   ?       ?      319.91  52.94  0.00    52.94  
1 1 1 -6  9   13 o 10 201.91  21.08  1207.38   240.72   1494.75  362.71   981.18    321.80   222.03  29.16  177.93  32.71  44.10   43.82  
1 1 1 -6  9   14 o 2  155.63  19.43  718.06    169.81   587.97   279.29   794.36    213.88   136.58  35.35  162.66  23.59  -26.08  42.50  
1 1 1 -6  9   15 o 18 64.53   30.45  -304.77   294.69   -304.77  294.69   0.00      0.00     64.53   30.45  ?       ?      0.00    30.45  
1 1 1 -6  9   16 o 8  171.24  17.10  861.80    165.83   3640.59  418.05   342.90    180.65   351.84  20.79  105.43  28.96  246.41  35.65  
1 1 1 -6  9   17 o 2  299.78  50.61  3008.79   840.04   0.00     0.00     3008.79   840.04   ?       ?      299.78  50.61  0.00    50.61  
1 1 1 -6  9   18 o 14 111.69  18.00  375.32    111.51   0.00     0.00     375.32    111.51   ?       ?      111.69  18.00  0.00    18.00  
1 1 1 -6  9   19 o 5  38.17   11.60  42.56     27.66    0.00     0.00     42.56     27.66    ?       ?      38.17   11.60  0.00    11.60  
1 1 1 -6  9   20 o 5  183.70  29.97  1083.73   305.12   0.00     0.00     1083.73   305.12   ?       ?      183.70  29.97  0.00    29.97  
1 1 1 -6  9   21 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  9   22 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  9   23 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  9   24 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  9   25 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  9   26 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  9   27 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  10  1  f 0  375.37  39.52  4239.69   838.78   3944.78  1186.46  4534.36   1185.96  351.22  61.06  379.96  56.05  -28.74  82.89  
1 1 1 -6  10  2  x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  10  3  o 13 272.10  42.03  2266.01   635.37   2266.01  635.37   0.00      0.00     272.10  42.03  ?       ?      0.00    42.03  
1 1 1 -6  10  4  o 11 219.88  33.72  1459.71   412.11   1459.71  412.11   0.00      0.00     219.88  33.72  ?       ?      0.00    33.72  
1 1 1 -6  10  5  o 5  382.99  40.91  4452.87   885.59   3966.07  1252.61  4939.35   1252.20  347.36  65.21  394.09  57.00  -46.73  86.61  
1 1 1 -6  10  6  o 16 369.76  39.36  4150.29   822.69   4015.30  1164.29  4284.91   1162.64  351.80  59.79  365.27  57.33  -13.46  82.83  
1 1 1 -6  10  7  o 3  199.94  31.65  1212.14   351.19   1212.14  351.19   0.00      0.00     199.94  31.65  ?       ?      0.00    31.65  
1 1 1 -6  10  8  o 6  380.21  41.07  4450.99   882.17   4375.64  1249.15  4525.97   1246.01  361.95  62.37  369.42  60.87  -7.47   87.15  
1 1 1 -6  10  9  o 11 299.08  31.47  2697.45   532.29   2775.72  755.97   2620.50   749.60   295.77  46.02  286.54  47.21  9.23    65.93  
1 1 1 -6  10  10 o 19 382.99  43.48  4610.28   939.06   4103.39  1330.40  5113.58   1325.67  338.34  70.77  387.85  61.60  -49.51  93.83  
1 1 1 -6  10  11 o 16 240.83  25.49  1733.01   347.06   1820.51  502.53   1653.22   479.89   241.70  37.43  230.02  37.64  11.68   53.08  
1 1 1 -6  10  12 o 11 245.89  27.62  1817.38   383.10   1685.43  565.68   1929.16   520.67   228.78  44.68  248.89  37.61  -20.11  58.40  
1 1 1 -6  10  13 o 2  256.52  40.75  2069.90   580.01   0.00     0.00     2069.90   580.01   ?       ?      256.52  40.75  0.00    40.75  
1 1 1 -6  10  14 o 10 404.10  74.61  5979.86   1667.15  0.00     0.00     5979.86   1667.15  ?       ?      404.10  74.61  0.00    74.61  
1 1 1 -6  10  15 o 17 85.26   11.50  213.80    54.87    -1265.17 345.53   252.06    55.57    47.36   24.06  92.84   10.62  -45.49  26.29  
1 1 1 -6  10  16 o 6  107.44  13.31  340.01    80.31    312.75   357.63   341.46    82.42    109.35  41.45  107.60  13.65  1.76    43.64  
1 1 1 -6  10  17 o 19 119.26  12.96  418.47    87.32    150.60   385.01   432.99    89.66    98.12   40.98  121.31  13.08  -23.19  43.02  
1 1 1 -6  10  18 o 11 134.17  19.70  546.50    147.20   409.64   342.38   577.54    163.04   113.79  41.01  137.37  21.37  -23.58  46.24  
1 1 1 -6  10  19 o 16 140.08  22.44  607.69    174.39   0.00     0.00     607.69    174.39   ?       ?      140.08  22.44  0.00    22.44  
1 1 1 -6  10  20 o 14 120.84  19.74  450.61    132.22   0.00     0.00     450.61    132.22   ?       ?      120.84  19.74  0.00    19.74  
1 1 1 -6  10  21 o 4  95.47   11.78  271.28    63.20    0.00     0.00     271.28    63.20    ?       ?      95.47   11.78  0.00    11.78  
1 1 1 -6  10  22 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  10  23 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  10  24 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  10  25 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  10  26 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  10  27 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  11  1  o 15 271.47  42.70  2291.37   643.57   0.00     0.00     2291.37   643.57   ?       ?      271.47  42.70  0.00    42.70  
1 1 1 -6  11  2  o 7  442.31  79.06  6933.73   1933.86  0.00     0.00     6933.73   1933.86  ?       ?      442.31  79.06  0.00    79.06  
1 1 1 -6  11  3  o 12 278.09  28.90  2309.14   454.72   2720.28  648.16   1910.66   638.10   297.73  38.85  245.04  47.07  52.68   61.03  
1 1 1 -6  11  4  o 2  437.66  48.83  6045.64   1206.02  5555.02  1705.94  6535.84   1705.22  393.23  78.32  435.26  70.67  -42.03  105.49 
1 1 1 -6  11  5  o 9  491.32  99.50  9715.77   2710.19  9715.77  2710.19  0.00      0.00     491.32  99.50  ?       ?      0.00    99.50  
1 1 1 -6  11  6  o 7  145.26  27.64  643.77    222.04   643.77   222.04   0.00      0.00     145.26  27.64  ?       ?      0.00    27.64  
1 1 1 -6  11  7  o 10 92.49   28.00  256.48    161.35   256.48   161.35   0.00      0.00     92.49   28.00  ?       ?      0.00    28.00  
1 1 1 -6  11  8  o 1  294.82  30.94  2625.63   515.80   2817.50  737.05   2441.49   722.08   298.08  44.43  275.39  47.38  22.69   64.95  
1 1 1 -6  11  9  o 14 338.19  38.04  3529.37   725.70   3146.19  1033.38  3902.21   1019.34  302.95  61.52  345.06  53.16  -42.11  81.31  
1 1 1 -6  11  10 o 16 153.97  19.18  701.52    165.86   735.09   283.65   684.08    204.45   153.69  33.13  150.63  24.48  3.06    41.19  
1 1 1 -6  11  11 o 14 71.42   36.17  -2439.32  743.21   -2439.32 743.21   0.00      0.00     71.42   36.17  ?       ?      0.00    36.17  
1 1 1 -6  11  12 o 4  414.10  26.98  5106.86   637.82   10410.53 939.17   566.78    868.94   591.22  27.75  154.47  62.72  436.75  68.58  
1 1 1 -6  11  13 o 15 450.04  95.34  8562.03   2386.38  0.00     0.00     8562.03   2386.38  ?       ?      450.04  95.34  0.00    95.34  
1 1 1 -6  11  14 o 8  380.30  76.78  5689.64   1618.35  5689.64  1618.35  0.00      0.00     380.30  76.78  ?       ?      0.00    76.78  
1 1 1 -6  11  15 o 4  295.06  31.30  2703.71   522.05   0.00     0.00     2703.71   522.05   ?       ?      295.06  31.30  0.00    31.30  
1 1 1 -6  11  16 o 3  36.49   15.88  -9.07     62.17    0.00     0.00     -9.07     62.17    ?       ?      36.49   15.88  0.00    15.88  
1 1 1 -6  11  17 o 8  149.14  24.66  693.68    203.79   0.00     0.00     693.68    203.79   ?       ?      149.14  24.66  0.00    24.66  
1 1 1 -6  11  18 o 2  37.97   13.37  37.46     36.17    0.00     0.00     37.46     36.17    ?       ?      37.97   13.37  0.00    13.37  
1 1 1 -6  11  19 f 0  102.22  12.39  310.68    71.25    0.00     0.00     310.68    71.25    ?       ?      102.22  12.39  0.00    12.39  
1 1 1 -6  11  20 o 2  164.30  27.88  892.16    253.61   0.00     0.00     892.16    253.61   ?       ?      164.30  27.88  0.00    27.88  
1 1 1 -6  11  21 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  11  22 o 12 80.86   18.17  208.81    82.29    0.00     0.00     208.81    82.29    ?       ?      80.86   18.17  0.00    18.17  
1 1 1 -6  11  23 o 16 97.78   12.40  289.66    68.05    0.00     0.00     289.66    68.05    ?       ?      97.78   12.40  0.00    12.40  
1 1 1 -6  11  24 f 0  84.96   12.19  220.48    57.74    0.00     0.00     220.48    57.74    ?       ?      84.96   12.19  0.00    12.19  
1 1 1 -6  11  25 o 13 179.17  22.37  1099.52   225.08   0.00     0.00     1099.52   225.08   ?       ?      179.17  22.37  0.00    22.37  
1 1 1 -6  11  26 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  12  1  o 17 238.45  25.61  1687.93   345.02   1894.35  502.09   1503.26   474.90   248.92  36.20  220.17  39.00  28.75   53.21  
1 1 1 -6  12  2  o 18 290.35  30.29  2525.49   497.45   2948.48  714.15   2126.84   693.30   308.74  41.33  257.94  48.60  50.80   63.80  
1 1 1 -6  12  3  o 10 481.82  93.33  8923.97   2488.29  0.00     0.00     8923.97   2488.29  ?       ?      481.82  93.33  0.00    93.33  
1 1 1 -6  12  4  o 1  212.52  33.66  1380.88   396.95   0.00     0.00     1380.88   396.95   ?       ?      212.52  33.66  0.00    33.66  
1 1 1 -6  12  5  o 2  382.34  65.60  4967.83   1388.01  0.00     0.00     4967.83   1388.01  ?       ?      382.34  65.60  0.00    65.60  
1 1 1 -6  12  6  f 0  357.44  40.16  3939.60   809.80   3508.96  1154.09  4357.28   1136.57  320.18  65.01  364.95  56.04  -44.77  85.83  
1 1 1 -6  12  7  o 1  378.71  65.24  4892.57   1367.26  0.00     0.00     4892.57   1367.26  ?       ?      378.71  65.24  0.00    65.24  
1 1 1 -6  12  8  o 10 469.46  94.17  8736.78   2449.52  8736.78  2449.52  0.00      0.00     469.46  94.17  ?       ?      0.00    94.17  
1 1 1 -6  12  9  o 13 334.76  59.32  3773.99   1098.21  3773.99  1098.21  0.00      0.00     334.76  59.32  ?       ?      0.00    59.32  
1 1 1 -6  12  10 o 12 338.39  43.36  3620.83   822.91   2466.79  1183.25  4701.88   1145.22  254.83  75.51  376.77  54.53  -121.94 93.14  
1 1 1 -6  12  11 o 7  260.59  42.82  2178.97   618.29   0.00     0.00     2178.97   618.29   ?       ?      260.59  42.82  0.00    42.82  
1 1 1 -6  12  12 o 16 305.82  31.49  2876.37   544.94   3353.80  795.14   2453.53   748.31   320.56  44.40  269.04  50.30  51.52   67.09  
1 1 1 -6  12  13 o 1  155.66  26.18  747.90    225.69   0.00     0.00     747.90    225.69   ?       ?      155.66  26.18  0.00    26.18  
1 1 1 -6  12  14 o 11 154.93  23.80  737.40    204.94   353.45   416.20   860.30    235.47   113.47  44.26  166.87  25.38  -53.40  51.02  
1 1 1 -6  12  15 o 4  153.15  15.95  697.45    138.13   0.00     0.00     697.45    138.13   ?       ?      153.15  15.95  0.00    15.95  
1 1 1 -6  12  16 o 1  128.77  15.32  495.02    111.04   0.00     0.00     495.02    111.04   ?       ?      128.77  15.32  0.00    15.32  
1 1 1 -6  12  17 o 15 237.67  25.22  1772.21   338.91   1536.00  715.66   1840.50   384.79   184.32  59.45  239.49  28.55  -55.16  65.95  
1 1 1 -6  12  18 o 2  134.22  15.11  541.48    114.40   724.81   452.49   528.96    118.24   133.89  47.26  132.34  15.88  1.55    49.86  
1 1 1 -6  12  19 o 14 118.67  22.19  451.40    145.59   0.00     0.00     451.40    145.59   ?       ?      118.67  22.19  0.00    22.19  
1 1 1 -6  12  20 o 17 91.69   19.97  270.02    102.11   0.00     0.00     270.02    102.11   ?       ?      91.69   19.97  0.00    19.97  
1 1 1 -6  12  21 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  12  22 o 9  65.79   14.15  135.56    51.85    0.00     0.00     135.56    51.85    ?       ?      65.79   14.15  0.00    14.15  
1 1 1 -6  12  23 o 2  123.96  15.33  479.80    106.74   0.00     0.00     479.80    106.74   ?       ?      123.96  15.33  0.00    15.33  
1 1 1 -6  12  24 o 2  67.02   18.68  151.05    74.52    0.00     0.00     151.05    74.52    ?       ?      67.02   18.68  0.00    18.68  
1 1 1 -6  12  25 o 16 83.37   21.25  246.05    101.97   0.00     0.00     246.05    101.97   ?       ?      83.37   21.25  0.00    21.25  
1 1 1 -6  13  1  o 19 131.57  24.43  523.34    177.74   0.00     0.00     523.34    177.74   ?       ?      131.57  24.43  0.00    24.43  
1 1 1 -6  13  2  o 7  212.37  24.89  1342.19   297.70   1151.81  455.43   1484.21   393.37   190.38  42.72  221.08  31.92  -30.71  53.33  
1 1 1 -6  13  3  o 15 152.15  25.91  699.64    218.23   0.00     0.00     699.64    218.23   ?       ?      152.15  25.91  0.00    25.91  
1 1 1 -6  13  4  o 16 81.97   32.86  108.88    235.18   108.88   235.18   0.00      0.00     81.97   32.86  ?       ?      0.00    32.86  
1 1 1 -6  13  5  x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  13  6  o 16 101.40  25.51  315.64    148.35   0.00     0.00     315.64    148.35   ?       ?      101.40  25.51  0.00    25.51  
1 1 1 -6  13  7  o 10 161.62  28.22  800.21    252.32   0.00     0.00     800.21    252.32   ?       ?      161.62  28.22  0.00    28.22  
1 1 1 -6  13  8  o 19 371.64  41.60  4391.56   872.32   4486.49  1247.51  4300.73   1220.25  354.34  63.67  346.83  63.63  7.52    90.01  
1 1 1 -6  13  9  o 3  245.10  47.40  2013.50   642.89   2013.50  642.89   0.00      0.00     245.10  47.40  ?       ?      0.00    47.40  
1 1 1 -6  13  10 o 6  183.44  31.15  1055.97   316.36   0.00     0.00     1055.97   316.36   ?       ?      183.44  31.15  0.00    31.15  
1 1 1 -6  13  11 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  13  12 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  13  13 o 8  131.07  23.14  532.86    167.74   607.79   408.00   517.62    184.00   132.08  44.97  128.01  25.93  4.06    51.91  
1 1 1 -6  13  14 o 4  200.77  17.72  1206.58   202.09   1706.25  500.37   1109.19   220.91   221.83  40.79  191.14  20.45  30.69   45.63  
1 1 1 -6  13  15 o 17 294.36  27.63  2750.10   461.40   2702.83  876.24   2768.24   542.74   247.86  61.80  289.33  33.28  -41.47  70.19  
1 1 1 -6  13  16 o 5  209.63  20.23  1348.91   240.48   1828.21  637.49   1269.39   259.67   208.47  53.12  201.55  22.84  6.92    57.83  
1 1 1 -6  13  17 o 10 235.59  24.25  1769.15   323.27   2209.24  729.57   1661.63   360.61   216.95  57.62  223.98  28.70  -7.03   64.37  
1 1 1 -6  13  18 o 11 140.76  16.54  606.62    131.14   -151.36  519.78   658.15    135.52   84.93   40.19  146.78  16.36  -61.84  43.39  
1 1 1 -6  13  19 o 18 120.25  14.53  440.15    98.28    0.00     0.00     440.15    98.28    ?       ?      120.25  14.53  0.00    14.53  
1 1 1 -6  13  20 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  13  21 o 11 30.47   13.28  -4.26     43.66    0.00     0.00     -4.26     43.66    ?       ?      30.47   13.28  0.00    13.28  
1 1 1 -6  13  22 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  13  23 o 14 48.78   19.03  61.15     76.98    0.00     0.00     61.15     76.98    ?       ?      48.78   19.03  0.00    19.03  
1 1 1 -6  14  1  o 17 221.70  25.97  1485.50   324.23   1391.28  487.49   1560.24   434.18   206.23  42.59  222.91  35.09  -16.68  55.18  
1 1 1 -6  14  2  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  14  3  o 4  279.31  33.77  2427.38   530.54   1861.12  763.72   2955.49   737.55   227.28  58.27  300.98  43.99  -73.70  73.01  
1 1 1 -6  14  4  f 0  182.01  22.76  996.82    232.65   928.84   355.98   1047.51   307.39   169.37  37.59  183.61  30.21  -14.24  48.23  
1 1 1 -6  14  5  o 9  211.52  25.93  1361.03   308.33   1139.60  456.49   1546.78   418.11   184.23  43.81  221.51  33.96  -37.28  55.43  
1 1 1 -6  14  6  o 18 215.88  26.09  1422.06   316.83   1322.79  476.26   1500.86   424.35   198.62  43.02  216.85  35.30  -18.23  55.65  
1 1 1 -6  14  7  o 7  90.00   25.16  251.56    135.02   556.27   305.43   177.55    150.53   129.97  38.33  79.13   27.30  50.84   47.06  
1 1 1 -6  14  8  o 4  199.98  34.54  1289.18   382.16   0.00     0.00     1289.18   382.16   ?       ?      199.98  34.54  0.00    34.54  
1 1 1 -6  14  9  o 5  291.41  54.96  3140.51   885.72   0.00     0.00     3140.51   885.72   ?       ?      291.41  54.96  0.00    54.96  
1 1 1 -6  14  10 o 2  89.84   25.44  253.66    137.15   0.00     0.00     253.66    137.15   ?       ?      89.84   25.44  0.00    25.44  
1 1 1 -6  14  11 o 7  134.33  26.75  573.65    199.03   0.00     0.00     573.65    199.03   ?       ?      134.33  26.75  0.00    26.75  
1 1 1 -6  14  12 o 9  92.65   24.56  273.52    132.69   0.00     0.00     273.52    132.69   ?       ?      92.65   24.56  0.00    24.56  
1 1 1 -6  14  13 o 17 207.99  20.85  1325.01   245.57   1294.56  577.95   1331.72   271.28   176.50  52.89  206.99  23.23  -30.48  57.77  
1 1 1 -6  14  14 o 16 115.96  47.20  467.27    493.41   467.27   493.41   0.00      0.00     115.96  47.20  ?       ?      0.00    47.20  
1 1 1 -6  14  15 o 6  138.50  52.33  885.10    569.18   885.10   569.18   0.00      0.00     138.50  52.33  ?       ?      0.00    52.33  
1 1 1 -6  14  16 f 0  104.20  14.31  329.40    83.33    862.03   606.30   319.14    84.13    131.83  52.79  102.38  14.74  29.45   54.81  
1 1 1 -6  14  17 o 9  118.09  16.25  429.70    107.22   122.45   661.43   437.99    108.66   98.17   46.11  119.21  16.30  -21.04  48.91  
1 1 1 -6  14  18 o 4  49.71   15.82  74.93     50.79    -233.68  573.61   77.37     50.99    82.38   39.83  50.37   15.83  32.02   42.86  
1 1 1 -6  14  19 o 15 107.58  14.42  356.36    86.81    0.00     0.00     356.36    86.81    ?       ?      107.58  14.42  0.00    14.42  
1 1 1 -6  14  20 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  14  21 o 8  55.71   18.03  100.03    65.82    0.00     0.00     100.03    65.82    ?       ?      55.71   18.03  0.00    18.03  
1 1 1 -6  14  22 f 0  42.48   16.93  39.42     62.12    0.00     0.00     39.42     62.12    ?       ?      42.48   16.93  0.00    16.93  
1 1 1 -6  15  1  o 18 79.74   32.77  95.89     240.63   95.89    240.63   0.00      0.00     79.74   32.77  ?       ?      0.00    32.77  
1 1 1 -6  15  2  f 0  276.79  53.14  2752.77   813.66   2752.77  813.66   0.00      0.00     276.79  53.14  ?       ?      0.00    53.14  
1 1 1 -6  15  3  o 1  126.71  22.00  491.93    154.25   296.35   279.61   577.49    184.94   101.47  36.99  136.61  24.48  -35.14  44.36  
1 1 1 -6  15  4  o 4  249.91  30.20  1958.42   424.44   1786.62  623.36   2106.90   579.52   223.10  49.92  250.28  41.81  -27.18  65.12  
1 1 1 -6  15  5  o 10 285.59  31.74  2582.48   511.64   2936.93  751.62   2276.42   698.43   290.20  46.70  251.53  50.13  38.67   68.51  
1 1 1 -6  15  6  o 6  86.22   25.68  231.68    136.57   474.88   329.93   181.39    150.02   119.74  40.44  79.10   27.26  40.64   48.77  
1 1 1 -6  15  7  o 12 231.22  29.00  1688.38   376.50   1668.14  585.64   1702.64   491.55   212.97  48.93  223.86  39.70  -10.89  63.01  
1 1 1 -6  15  8  o 19 351.05  43.75  4324.08   862.57   4496.01  1251.52  4168.51   1190.48  314.64  70.98  304.83  69.57  9.81    99.39  
1 1 1 -6  15  9  o 19 152.92  29.12  758.69    246.33   0.00     0.00     758.69    246.33   ?       ?      152.92  29.12  0.00    29.12  
1 1 1 -6  15  10 o 12 285.82  36.30  2780.62   582.20   3088.20  910.89   2568.19   757.00   266.07  60.95  252.15  53.93  13.92   81.38  
1 1 1 -6  15  11 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  15  12 o 2  111.19  26.48  409.05    166.62   0.00     0.00     409.05    166.62   ?       ?      111.19  26.48  0.00    26.48  
1 1 1 -6  15  13 o 1  85.51   25.80  240.80    137.18   0.00     0.00     240.80    137.18   ?       ?      85.51   25.80  0.00    25.80  
1 1 1 -6  15  14 o 10 58.35   23.62  65.32     122.86   0.00     0.00     65.32     122.86   ?       ?      58.35   23.62  0.00    23.62  
1 1 1 -6  15  15 o 5  98.82   16.07  302.37    88.04    0.00     0.00     302.37    88.04    ?       ?      98.82   16.07  0.00    16.07  
1 1 1 -6  15  16 o 19 81.89   16.18  210.67    73.36    628.82   735.31   206.47    73.73    111.73  51.11  80.95   16.43  30.78   53.69  
1 1 1 -6  15  17 o 13 145.72  27.39  745.00    220.70   0.00     0.00     745.00    220.70   ?       ?      145.72  27.39  0.00    27.39  
1 1 1 -6  15  18 o 2  186.38  30.24  1285.19   312.49   1737.67  748.60   1189.70   343.88   143.63  58.25  171.05  36.15  -27.43  68.56  
1 1 1 -6  15  19 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  15  20 o 13 84.75   16.87  235.22    79.19    0.00     0.00     235.22    79.19    ?       ?      84.75   16.87  0.00    16.87  
1 1 1 -6  16  1  f 0  78.25   24.39  188.73    121.38   365.98   292.95   151.99    133.36   106.94  38.00  73.11   25.67  33.82   45.86  
1 1 1 -6  16  2  o 3  79.34   25.69  192.61    133.59   29.58    293.05   235.37    150.09   79.19   34.47  86.59   27.14  -7.40   43.87  
1 1 1 -6  16  3  o 11 152.09  25.06  728.09    211.17   827.67   385.70   685.47    252.34   151.09  42.63  144.06  31.40  7.03    52.94  
1 1 1 -6  16  4  o 12 309.88  90.67  5994.10   1715.14  5994.10  1715.14  0.00      0.00     309.88  90.67  ?       ?      0.00    90.67  
1 1 1 -6  16  5  o 12 249.98  60.24  2694.80   854.30   2694.80  854.30   0.00      0.00     249.98  60.24  ?       ?      0.00    60.24  
1 1 1 -6  16  6  o 3  85.07   27.08  229.65    148.84   0.00     0.00     229.65    148.84   ?       ?      85.07   27.08  0.00    27.08  
1 1 1 -6  16  7  o 19 75.28   25.97  170.07    136.18   0.00     0.00     170.07    136.18   ?       ?      75.28   25.97  0.00    25.97  
1 1 1 -6  16  8  f 0  153.70  27.90  774.79    237.13   1022.20  593.95   727.87    258.64   150.78  54.05  146.26  31.72  4.51    62.67  
1 1 1 -6  16  9  o 15 140.11  55.38  923.86    658.75   923.86   658.75   0.00      0.00     140.11  55.38  ?       ?      0.00    55.38  
1 1 1 -6  16  10 o 12 119.19  27.41  476.06    183.59   0.00     0.00     476.06    183.59   ?       ?      119.19  27.41  0.00    27.41  
1 1 1 -6  16  11 o 7  104.16  26.32  364.75    157.42   263.05   558.78   373.52    164.07   102.86  46.03  105.05  27.05  -2.19   53.39  
1 1 1 -6  16  12 o 6  100.11  14.57  305.61    81.26    242.35   566.72   306.94    82.11    100.44  45.53  100.27  14.70  0.16    47.84  
1 1 1 -6  16  13 o 7  63.25   15.26  125.39    54.76    0.00     0.00     125.39    54.76    ?       ?      63.25   15.26  0.00    15.26  
1 1 1 -6  16  14 f 0  83.74   16.09  220.20    74.55    0.00     0.00     220.20    74.55    ?       ?      83.74   16.09  0.00    16.09  
1 1 1 -6  16  15 o 16 160.91  36.21  1029.75   326.36   0.00     0.00     1029.75   326.36   ?       ?      160.91  36.21  0.00    36.21  
1 1 1 -6  16  16 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  16  17 o 11 72.42   28.12  178.23    167.34   0.00     0.00     178.23    167.34   ?       ?      72.42   28.12  0.00    28.12  
1 1 1 -6  16  18 o 15 86.85   43.29  251.74    864.61   251.74   864.61   0.00      0.00     86.85   43.29  ?       ?      0.00    43.29  
1 1 1 -6  17  1  o 1  148.31  31.54  740.64    260.29   0.00     0.00     740.64    260.29   ?       ?      148.31  31.54  0.00    31.54  
1 1 1 -6  17  2  o 19 215.60  42.15  1706.65   503.01   0.00     0.00     1706.65   503.01   ?       ?      215.60  42.15  0.00    42.15  
1 1 1 -6  17  3  o 14 68.91   27.00  110.61    155.46   0.00     0.00     110.61    155.46   ?       ?      68.91   27.00  0.00    27.00  
1 1 1 -6  17  4  o 9  90.26   27.46  267.59    154.93   566.76   445.26   226.38    165.26   121.50  46.20  84.41   28.62  37.10   54.35  
1 1 1 -6  17  5  o 15 187.18  36.60  1247.99   379.13   0.00     0.00     1247.99   379.13   ?       ?      187.18  36.60  0.00    36.60  
1 1 1 -6  17  6  o 14 86.54   28.23  245.74    161.07   0.00     0.00     245.74    161.07   ?       ?      86.54   28.23  0.00    28.23  
1 1 1 -6  17  7  o 5  110.19  49.18  369.60    632.98   369.60   632.98   0.00      0.00     110.19  49.18  ?       ?      0.00    49.18  
1 1 1 -6  17  8  o 10 89.62   43.46  -366.95   696.18   -366.95  696.18   0.00      0.00     89.62   43.46  ?       ?      0.00    43.46  
1 1 1 -6  17  9  o 19 64.35   25.00  104.64    132.29   0.00     0.00     104.64    132.29   ?       ?      64.35   25.00  0.00    25.00  
1 1 1 -6  17  10 o 18 62.67   14.90  122.74    52.79    -229.73  602.88   125.47    53.00    85.57   41.24  63.38   14.83  22.19   43.82  
1 1 1 -6  17  11 o 17 179.72  21.10  1036.91   213.56   987.45   671.26   1042.48   225.26   127.08  53.65  179.04  22.41  -51.96  58.14  
1 1 1 -6  17  12 o 9  175.05  22.30  1005.53   218.96   0.00     0.00     1005.53   218.96   ?       ?      175.05  22.30  0.00    22.30  
1 1 1 -6  17  13 o 16 62.85   17.34  127.52    64.58    0.00     0.00     127.52    64.58    ?       ?      62.85   17.34  0.00    17.34  
1 1 1 -6  17  14 o 5  46.24   17.16  57.22     60.62    650.23   1061.76  55.28     60.72    99.38   49.27  45.86   17.14  53.52   52.16  
1 1 1 -6  17  15 o 17 72.28   19.31  175.59    81.64    -583.16  1148.52  179.44    81.85    84.42   42.98  73.10   19.25  11.32   47.09  
1 1 1 -6  18  1  o 13 56.75   24.91  -2.11     155.87   -105.10  475.38   10.30     164.99   84.44   39.48  59.24   25.82  25.20   47.17  
1 1 1 -6  18  2  o 4  52.21   23.64  -49.78    152.25   90.10    515.59   -63.14    159.36   93.77   42.86  52.47   23.92  41.30   49.08  
1 1 1 -6  18  3  o 11 59.93   25.41  41.89     151.57   0.00     0.00     41.89     151.57   ?       ?      59.93   25.41  0.00    25.41  
1 1 1 -6  18  4  o 18 77.74   28.30  188.67    163.68   0.00     0.00     188.67    163.68   ?       ?      77.74   28.30  0.00    28.30  
1 1 1 -6  18  5  o 19 56.19   24.46  11.96     147.72   0.00     0.00     11.96     147.72   ?       ?      56.19   24.46  0.00    24.46  
1 1 1 -6  18  6  x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -6  18  7  o 12 51.52   23.50  -53.22    154.01   0.00     0.00     -53.22    154.01   ?       ?      51.52   23.50  0.00    23.50  
1 1 1 -6  18  8  o 4  62.31   26.04  72.00     155.71   580.75   861.87   54.84     158.32   108.19  51.36  60.94   25.91  47.25   57.52  
1 1 1 -6  18  9  o 15 68.55   15.57  148.81    59.88    0.00     0.00     148.81    59.88    ?       ?      68.55   15.57  0.00    15.57  
1 1 1 -6  18  10 o 9  52.43   16.36  85.64     54.60    79.92    749.74   85.67     54.75    91.74   44.63  52.44   16.39  39.30   47.55  
1 1 1 -6  18  11 o 10 74.10   16.61  176.65    68.88    10.78    788.33   177.92    69.15    89.40   43.96  74.37   16.62  15.03   47.00  
1 1 1 -5  -18 1  o 12 71.34   23.62  152.03    112.67   152.03   112.67   0.00      0.00     71.34   23.62  ?       ?      0.00    23.62  
1 1 1 -5  -18 2  o 6  79.49   24.54  197.04    123.21   197.04   123.21   0.00      0.00     79.49   24.54  ?       ?      0.00    24.54  
1 1 1 -5  -18 3  o 11 103.59  24.34  342.64    142.29   342.64   142.29   0.00      0.00     103.59  24.34  ?       ?      0.00    24.34  
1 1 1 -5  -18 4  o 18 169.55  19.59  874.58    187.14   776.67   266.33   970.07    263.02   153.24  31.33  174.43  27.15  -21.19  41.46  
1 1 1 -5  -18 5  o 18 70.92   16.02  154.56    63.69    112.68   111.16   175.02    77.72    64.69   23.36  75.10   18.22  -10.42  29.62  
1 1 1 -5  -17 1  o 2  95.41   14.56  272.33    77.21    96.43    130.02   368.14    95.96    65.20   24.92  110.98  15.48  -45.78  29.34  
1 1 1 -5  -17 2  o 15 113.51  15.62  385.10    99.11    384.53   148.76   385.56    132.90   110.76  24.08  111.76  21.50  -1.00   32.28  
1 1 1 -5  -17 3  o 16 136.33  16.09  553.86    123.48   521.61   180.04   582.50    169.68   128.98  25.22  137.69  22.22  -8.71   33.61  
1 1 1 -5  -17 4  o 19 134.49  15.77  538.49    119.41   599.88   175.67   485.76    162.80   139.55  22.71  124.97  23.56  14.58   32.72  
1 1 1 -5  -17 5  o 18 78.12   22.70  188.62    107.84   188.62   107.84   0.00      0.00     78.12   22.70  ?       ?      0.00    22.70  
1 1 1 -5  -17 6  o 10 66.62   22.32  128.24    100.55   128.24   100.55   0.00      0.00     66.62   22.32  ?       ?      0.00    22.32  
1 1 1 -5  -17 7  o 4  93.94   23.81  278.61    128.57   278.61   128.57   0.00      0.00     93.94   23.81  ?       ?      0.00    23.81  
1 1 1 -5  -17 8  o 17 49.06   20.22  27.32     92.06    27.32    92.06    0.00      0.00     49.06   20.22  ?       ?      0.00    20.22  
1 1 1 -5  -17 9  o 17 63.68   22.11  113.50    98.81    113.50   98.81    0.00      0.00     63.68   22.11  ?       ?      0.00    22.11  
1 1 1 -5  -16 1  o 1  254.29  30.85  2010.76   441.09   1982.10  626.06   2039.01   621.56   241.06  46.93  245.50  45.79  -4.44   65.57  
1 1 1 -5  -16 2  o 17 78.75   16.43  188.13    71.89    118.70   109.24   241.18    95.48    66.28   23.24  88.79   19.29  -22.50  30.20  
1 1 1 -5  -16 3  o 9  208.67  20.97  1304.24   247.84   1422.31  341.01   1172.06   360.81   214.45  28.40  191.41  34.09  23.04   44.37  
1 1 1 -5  -16 4  o 16 113.15  15.09  380.36    95.60    418.03   141.83   348.99    129.42   116.75  21.97  106.47  21.91  10.28   31.02  
1 1 1 -5  -16 5  f 0  192.15  29.57  1154.70   315.77   1154.70  315.77   0.00      0.00     192.15  29.57  ?       ?      0.00    29.57  
1 1 1 -5  -16 6  f 0  273.01  25.03  2265.70   387.99   2486.89  511.99   1967.33   594.65   281.11  32.31  240.42  44.73  40.69   55.18  
1 1 1 -5  -16 7  o 16 195.13  19.74  1139.33   218.04   1241.30  303.28   1030.23   313.69   200.35  27.06  180.00  31.51  20.35   41.53  
1 1 1 -5  -16 8  o 7  77.61   14.81  181.82    63.59    277.03   102.13   121.53    81.27    95.09   19.37  64.01   19.96  31.08   27.81  
1 1 1 -5  -16 9  o 16 163.73  17.66  799.78    163.40   829.29   231.34   770.40    230.82   163.58  25.46  157.07  26.54  6.51    36.78  
1 1 1 -5  -16 10 o 4  62.72   22.13  106.33    99.24    106.33   99.24    0.00      0.00     62.72   22.13  ?       ?      0.00    22.13  
1 1 1 -5  -16 11 o 4  144.56  25.52  655.44    204.07   626.88   207.40   1523.67   1143.68  140.80  26.63  176.95  71.91  -36.15  76.69  
1 1 1 -5  -16 12 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  -15 1  o 6  247.40  22.93  1821.37   321.93   1903.62  420.86   1705.39   499.79   249.96  29.92  231.94  38.91  18.03   49.09  
1 1 1 -5  -15 2  o 9  300.12  28.65  2723.62   487.60   2705.74  618.82   2752.89   791.88   293.99  37.52  288.10  49.67  5.89    62.25  
1 1 1 -5  -15 3  o 15 222.86  22.11  1478.04   279.19   1525.58  378.11   1421.05   413.99   223.11  30.30  212.99  35.08  10.12   46.36  
1 1 1 -5  -15 4  o 13 64.91   17.12  127.44    64.72    124.39   103.82   129.38    82.77    66.96   22.69  66.10   20.06  0.86    30.28  
1 1 1 -5  -15 5  o 7  210.97  21.06  1324.10   251.70   1351.50  340.55   1291.12   373.68   209.97  29.03  203.24  33.17  6.73    44.08  
1 1 1 -5  -15 6  o 1  39.06   15.70  21.23     53.79    -21.44   88.11    46.58     67.92    42.44   18.67  47.32   18.03  -4.88   25.96  
1 1 1 -5  -15 7  o 15 102.65  15.07  313.38    86.16    235.53   126.73   380.30    117.50   87.47   24.35  112.32  18.89  -24.85  30.82  
1 1 1 -5  -15 8  o 3  142.40  16.28  600.44    130.70   561.65   186.80   637.65    182.95   134.96  25.03  144.81  22.76  -9.85   33.83  
1 1 1 -5  -15 9  o 1  278.75  30.11  2403.97   474.13   2467.33  672.44   2341.32   668.63   271.42  44.71  263.29  45.91  8.13    64.08  
1 1 1 -5  -15 10 o 3  124.09  22.41  471.93    153.76   471.93   153.76   0.00      0.00     124.09  22.41  ?       ?      0.00    22.41  
1 1 1 -5  -15 11 o 5  50.57   20.16  41.67     88.07    41.67    88.07    0.00      0.00     50.57   20.16  ?       ?      0.00    20.16  
1 1 1 -5  -15 12 o 8  151.96  66.04  690.33    1072.78  0.00     0.00     690.33    1072.78  ?       ?      151.96  66.04  0.00    66.04  
1 1 1 -5  -15 13 o 10 128.54  22.98  510.96    163.35   523.78   165.00   -120.52   1158.11  130.21  22.91  129.99  61.05  0.21    65.20  
1 1 1 -5  -15 14 o 12 252.56  32.79  2055.34   464.21   2006.86  493.45   2428.57   1369.08  247.02  35.84  206.61  80.37  40.40   88.00  
1 1 1 -5  -14 1  o 11 267.61  26.91  2131.73   407.75   1983.05  521.03   2366.67   654.97   254.16  36.78  275.08  42.87  -20.92  56.49  
1 1 1 -5  -14 2  o 11 225.16  28.52  1523.88   360.33   1649.77  688.49   1476.39   422.88   222.96  54.30  219.26  34.75  3.70    64.47  
1 1 1 -5  -14 3  o 15 258.41  41.04  2092.09   588.55   0.00     0.00     2092.09   588.55   ?       ?      258.41  41.04  0.00    41.04  
1 1 1 -5  -14 4  o 8  372.11  46.39  4402.48   969.52   4093.35  1476.62  4636.74   1285.41  329.56  79.06  367.77  63.16  -38.21  101.19 
1 1 1 -5  -14 5  o 6  150.65  23.84  683.70    199.34   286.19   704.11   718.33    207.84   132.68  55.42  154.38  24.25  -21.70  60.49  
1 1 1 -5  -14 6  o 9  252.36  31.56  1940.86   447.31   2071.33  818.00   1885.20   534.26   244.80  58.92  244.90  39.33  -0.10   70.84  
1 1 1 -5  -14 7  o 1  236.01  32.18  1708.30   424.71   1462.42  788.59   1808.75   504.05   203.22  61.97  240.19  37.80  -36.97  72.59  
1 1 1 -5  -14 8  o 12 146.40  16.77  632.37    138.40   577.23   199.87   683.15    191.82   137.16  26.34  150.58  22.91  -13.42  34.91  
1 1 1 -5  -14 9  o 5  163.52  17.51  789.82    161.80   749.36   224.89   833.24    232.97   156.67  25.91  165.59  25.31  -8.93   36.22  
1 1 1 -5  -14 10 o 6  154.99  16.69  709.50    146.17   722.54   205.11   696.04    208.35   154.22  23.94  150.98  24.91  3.24    34.55  
1 1 1 -5  -14 11 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  -14 12 o 11 167.99  24.39  860.44    228.35   906.45   235.85   171.06    912.91   172.45  24.51  133.31  59.31  39.14   64.17  
1 1 1 -5  -14 13 o 17 207.04  25.66  1310.31   298.46   1281.01  312.60   1612.31   1003.70  203.84  27.41  195.81  70.25  8.03    75.41  
1 1 1 -5  -14 14 o 8  159.06  23.75  774.67    210.20   732.21   215.16   1662.68   984.03   153.96  25.22  196.40  69.66  -42.44  74.08  
1 1 1 -5  -14 15 o 18 85.40   21.94  226.70    108.13   224.51   108.67   446.76    1089.54  84.99   22.08  143.44  64.23  -58.46  67.92  
1 1 1 -5  -14 16 o 19 123.93  50.04  451.40    549.65   320.69   610.28   1012.96   1264.97  119.48  50.83  159.90  70.54  -40.42  86.94  
1 1 1 -5  -14 17 o 14 99.22   19.89  303.75    109.33   301.22   109.63   774.45    1494.48  98.76   20.02  154.11  71.35  -55.36  74.11  
1 1 1 -5  -13 1  o 1  188.81  30.58  1073.62   320.11   1073.62  320.11   0.00      0.00     188.81  30.58  ?       ?      0.00    30.58  
1 1 1 -5  -13 2  o 6  134.82  25.39  547.22    189.29   547.22   189.29   0.00      0.00     134.82  25.39  ?       ?      0.00    25.39  
1 1 1 -5  -13 3  o 11 46.63   18.12  39.24     69.57    148.48   105.71   -44.25    92.41    71.97   22.81  41.43   18.62  30.54   29.44  
1 1 1 -5  -13 4  o 11 85.93   15.88  220.13    75.46    256.65   113.82   191.48    100.81   92.12   21.85  79.81   21.52  12.31   30.67  
1 1 1 -5  -13 5  o 4  113.79  15.22  380.85    96.91    404.14   138.26   358.35    135.89   116.04  21.55  108.95  22.47  7.09    31.14  
1 1 1 -5  -13 6  o 8  321.38  29.08  3073.81   530.75   3099.51  673.69   3031.77   861.77   319.09  37.49  308.80  50.35  10.29   62.77  
1 1 1 -5  -13 7  o 13 370.21  30.83  4103.09   649.28   4398.78  814.45   3587.46   1075.50  379.52  37.89  328.78  59.16  50.74   70.25  
1 1 1 -5  -13 8  o 4  206.45  20.30  1256.06   237.49   1258.08  319.46   1253.57   355.08   204.29  27.97  202.65  31.55  1.64    42.17  
1 1 1 -5  -13 9  o 14 180.38  28.37  988.49    284.09   0.00     0.00     988.49    284.09   ?       ?      180.38  28.37  0.00    28.37  
1 1 1 -5  -13 10 o 5  155.56  54.85  760.76    609.48   760.76   609.48   0.00      0.00     155.56  54.85  ?       ?      0.00    54.85  
1 1 1 -5  -13 11 o 12 74.71   18.72  169.50    80.14    0.00     0.00     169.50    80.14    ?       ?      74.71   18.72  0.00    18.72  
1 1 1 -5  -13 12 o 11 183.99  55.10  1184.62   627.44   1184.62  627.44   0.00      0.00     183.99  55.10  ?       ?      0.00    55.10  
1 1 1 -5  -13 13 o 9  231.23  59.07  1951.24   786.91   1951.24  786.91   0.00      0.00     231.23  59.07  ?       ?      0.00    59.07  
1 1 1 -5  -13 14 o 13 259.82  26.51  2052.43   389.85   2131.18  422.97   1607.84   1004.98  263.74  28.38  198.88  70.41  64.86   75.92  
1 1 1 -5  -13 15 o 19 113.18  22.34  393.79    140.00   393.79   140.00   0.00      0.00     113.18  22.34  ?       ?      0.00    22.34  
1 1 1 -5  -13 16 o 14 132.08  21.98  533.09    160.80   533.09   160.80   0.00      0.00     132.08  21.98  ?       ?      0.00    21.98  
1 1 1 -5  -13 17 o 14 84.47   20.15  220.59    96.35    218.53   96.66    541.30    1207.57  84.06   20.27  148.88  67.07  -64.83  70.06  
1 1 1 -5  -13 18 o 9  85.25   22.55  227.35    112.02   227.35   112.02   0.00      0.00     85.25   22.55  ?       ?      0.00    22.55  
1 1 1 -5  -12 1  o 1  275.08  23.06  2220.96   360.77   2315.26  453.42   2058.24   595.59   279.25  28.69  258.48  41.55  20.77   50.49  
1 1 1 -5  -12 2  o 7  374.98  34.15  4203.33   727.04   4034.68  898.73   4522.70   1236.75  362.62  44.08  374.97  59.44  -12.34  74.00  
1 1 1 -5  -12 3  o 18 183.17  19.78  984.38    204.70   1008.65  290.36   960.40    288.62   183.38  28.51  178.68  29.14  4.70    40.77  
1 1 1 -5  -12 4  o 11 255.28  30.09  1939.09   432.52   1939.09  432.52   0.00      0.00     255.28  30.09  ?       ?      0.00    30.09  
1 1 1 -5  -12 5  x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  -12 6  o 2  248.11  38.69  1869.93   533.04   1869.93  533.04   0.00      0.00     248.11  38.69  ?       ?      0.00    38.69  
1 1 1 -5  -12 7  o 3  166.98  27.44  835.53    253.92   835.53   253.92   0.00      0.00     166.98  27.44  ?       ?      0.00    27.44  
1 1 1 -5  -12 8  o 6  184.09  29.45  1019.23   300.77   1019.23  300.77   0.00      0.00     184.09  29.45  ?       ?      0.00    29.45  
1 1 1 -5  -12 9  f 0  437.93  76.49  6642.25   1853.11  6642.25  1853.11  0.00      0.00     437.93  76.49  ?       ?      0.00    76.49  
1 1 1 -5  -12 10 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  -12 11 o 13 298.83  33.92  2717.49   571.54   0.00     0.00     2717.49   571.54   ?       ?      298.83  33.92  0.00    33.92  
1 1 1 -5  -12 12 o 3  259.78  32.47  2057.33   473.64   2486.81  549.85   822.14    932.48   285.02  34.29  168.89  66.15  116.12  74.51  
1 1 1 -5  -12 13 o 13 65.14   20.56  123.05    85.98    123.05   85.98    0.00      0.00     65.14   20.56  ?       ?      0.00    20.56  
1 1 1 -5  -12 14 o 9  173.24  45.84  1000.90   462.95   1034.88  577.51   939.81    774.40   173.61  53.05  167.45  61.47  6.16    81.20  
1 1 1 -5  -12 15 o 6  97.16   43.31  -66.96    489.48   -66.96   489.48   0.00      0.00     97.16   43.31  ?       ?      0.00    43.31  
1 1 1 -5  -12 16 o 18 99.97   44.23  -15.08    500.95   -15.08   500.95   0.00      0.00     99.97   44.23  ?       ?      0.00    44.23  
1 1 1 -5  -12 17 o 16 148.26  49.81  760.73    500.49   760.73   500.49   0.00      0.00     148.26  49.81  ?       ?      0.00    49.81  
1 1 1 -5  -12 18 o 11 131.32  47.67  566.07    463.87   566.07   463.87   0.00      0.00     131.32  47.67  ?       ?      0.00    47.67  
1 1 1 -5  -12 19 o 3  114.22  21.79  403.17    137.66   401.43   138.58   532.18    1192.83  113.90  21.99  146.56  66.28  -32.66  69.83  
1 1 1 -5  -12 20 o 19 163.54  24.90  833.59    226.43   824.28   230.34   1100.01   1232.79  162.28  25.57  159.64  70.06  2.64    74.58  
1 1 1 -5  -11 1  o 18 315.87  25.77  2925.03   463.16   3086.29  571.82   2617.40   789.77   322.97  31.23  290.85  49.04  32.13   58.14  
1 1 1 -5  -11 2  o 16 462.55  40.91  6428.72   1075.10  6188.61  1319.17  6903.66   1855.30  447.55  52.33  458.74  72.89  -11.19  89.73  
1 1 1 -5  -11 3  o 4  385.64  40.63  4486.30   885.98   4416.07  1253.07  4556.51   1252.84  372.00  60.77  378.67  59.60  -6.68   85.12  
1 1 1 -5  -11 4  o 1  161.08  17.29  758.99    157.36   710.43   222.15   807.89    222.94   153.95  26.07  164.82  24.29  -10.87  35.63  
1 1 1 -5  -11 5  o 4  86.50   12.57  220.12    60.58    212.65   87.74    226.93    83.75    84.05   18.67  87.05   17.37  -3.00   25.50  
1 1 1 -5  -11 6  o 10 135.19  14.66  533.77    111.98   575.53   153.77   486.62    163.40   139.52  19.75  127.37  23.20  12.15   30.47  
1 1 1 -5  -11 7  o 4  153.92  16.67  692.71    144.90   758.52   198.40   617.46    212.14   160.09  22.18  143.14  26.80  16.94   34.79  
1 1 1 -5  -11 8  o 13 150.26  16.64  660.22    141.17   738.85   194.55   572.76    205.17   158.05  22.04  137.80  26.90  20.25   34.78  
1 1 1 -5  -11 9  o 7  620.76  35.35  11422.63  1254.41  11422.63 1254.41  0.00      0.00     620.76  35.35  ?       ?      0.00    35.35  
1 1 1 -5  -11 10 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  -11 11 o 11 147.45  23.00  648.28    188.36   648.28   188.36   0.00      0.00     147.45  23.00  ?       ?      0.00    23.00  
1 1 1 -5  -11 12 o 4  219.37  34.36  1469.20   418.46   1469.20  418.46   0.00      0.00     219.37  34.36  ?       ?      0.00    34.36  
1 1 1 -5  -11 13 o 2  274.60  44.00  2382.59   670.24   2382.59  670.24   0.00      0.00     274.60  44.00  ?       ?      0.00    44.00  
1 1 1 -5  -11 14 o 9  161.87  24.85  789.59    223.51   819.59   237.19   551.71    667.84   164.64  25.95  144.89  56.20  19.75   61.90  
1 1 1 -5  -11 15 o 15 265.56  43.14  2259.14   635.11   2259.14  635.11   0.00      0.00     265.56  43.14  ?       ?      0.00    43.14  
1 1 1 -5  -11 16 o 5  147.39  24.34  660.80    198.75   660.80   198.75   0.00      0.00     147.39  24.34  ?       ?      0.00    24.34  
1 1 1 -5  -11 17 o 15 55.55   20.94  68.57     91.04    69.38    91.61    2.83      822.85   55.78   21.01  123.95  55.64  -68.17  59.47  
1 1 1 -5  -11 18 o 19 127.58  22.06  496.59    155.70   498.40   157.89   432.90    937.88   127.72  22.35  143.02  61.96  -15.30  65.86  
1 1 1 -5  -11 19 o 19 95.56   40.43  117.45    382.56   123.40   415.13   83.92     985.24   98.72   41.96  131.31  59.72  -32.58  72.99  
1 1 1 -5  -11 20 o 1  99.13   41.77  157.63    405.66   157.63   405.66   0.00      0.00     99.13   41.77  ?       ?      0.00    41.77  
1 1 1 -5  -11 21 f 0  151.52  47.33  847.35    456.80   847.35   456.80   0.00      0.00     151.52  47.33  ?       ?      0.00    47.33  
1 1 1 -5  -11 22 o 4  91.50   39.51  94.39     378.96   94.39    378.96   0.00      0.00     91.50   39.51  ?       ?      0.00    39.51  
1 1 1 -5  -10 1  f 0  215.01  22.18  1352.92   269.85   1237.11  381.99   1468.29   381.26   202.85  34.01  222.24  30.70  -19.39  45.82  
1 1 1 -5  -10 2  o 19 461.83  48.67  6450.09   1270.91  6556.83  1797.40  6343.37   1797.27  453.09  71.47  444.62  72.94  8.47    102.12 
1 1 1 -5  -10 3  o 4  234.49  23.04  1608.51   306.11   1412.97  379.72   1971.47   517.34   217.83  31.26  256.70  36.10  -38.86  47.76  
1 1 1 -5  -10 4  o 10 78.25   11.93  180.22    51.90    188.17   73.15    172.16    73.64    79.30   16.60  75.74   17.32  3.56    23.99  
1 1 1 -5  -10 5  o 19 234.24  24.18  1609.62   320.48   1572.55  453.01   1646.75   453.45   228.66  35.68  234.36  34.76  -5.70   49.81  
1 1 1 -5  -10 6  o 2  180.45  17.50  949.69    179.05   844.86   230.94   1107.64   283.49   168.74  24.56  193.28  26.23  -24.54  35.93  
1 1 1 -5  -10 7  o 2  291.30  30.38  2515.53   500.64   2347.13  708.22   2683.73   707.80   275.61  46.41  296.58  42.81  -20.97  63.14  
1 1 1 -5  -10 8  o 6  178.93  17.95  935.79    181.86   989.10   240.44   864.52    278.00   182.89  23.44  169.28  29.69  13.61   37.83  
1 1 1 -5  -10 9  o 13 161.56  21.98  772.13    198.61   772.13   198.61   0.00      0.00     161.56  21.98  ?       ?      0.00    21.98  
1 1 1 -5  -10 10 o 1  97.87   20.79  288.22    113.22   0.00     0.00     288.22    113.22   ?       ?      97.87   20.79  0.00    20.79  
1 1 1 -5  -10 11 o 6  298.63  38.10  2685.11   638.34   1511.62  800.45   4735.34   1058.02  216.61  61.51  393.28  47.85  -176.67 77.93  
1 1 1 -5  -10 12 o 14 172.31  36.24  910.57    347.07   507.00   493.08   1306.84   488.60   137.34  49.24  205.30  42.85  -67.96  65.27  
1 1 1 -5  -10 13 o 11 179.16  24.56  954.35    245.96   954.35   245.96   0.00      0.00     179.16  24.56  ?       ?      0.00    24.56  
1 1 1 -5  -10 14 o 3  390.00  45.18  4739.32   992.75   4827.30  1343.90  4633.64   1472.87  379.62  63.94  364.04  73.02  15.58   97.06  
1 1 1 -5  -10 15 o 14 72.35   20.61  156.90    89.72    156.90   89.72    0.00      0.00     72.35   20.61  ?       ?      0.00    20.61  
1 1 1 -5  -10 16 o 8  43.37   19.27  -33.21    96.11    -33.21   96.11    0.00      0.00     43.37   19.27  ?       ?      0.00    19.27  
1 1 1 -5  -10 17 o 12 201.88  32.53  1264.07   364.22   1264.07  364.22   0.00      0.00     201.88  32.53  ?       ?      0.00    32.53  
1 1 1 -5  -10 18 o 7  177.63  29.25  976.93    287.87   976.93   287.87   0.00      0.00     177.63  29.25  ?       ?      0.00    29.25  
1 1 1 -5  -10 19 o 7  183.57  28.36  1044.19   289.26   1050.91  305.89   987.29    889.55   183.35  30.11  166.11  64.74  17.23   71.39  
1 1 1 -5  -10 20 o 11 226.83  23.87  1560.83   306.22   1459.20  323.14   2455.51   958.75   217.99  26.36  245.82  66.39  -27.83  71.43  
1 1 1 -5  -10 21 f 0  66.02   20.41  130.38    85.16    130.98   85.46    45.78     1018.54  66.16   20.44  129.42  59.56  -63.26  62.97  
1 1 1 -5  -10 22 o 14 286.66  29.25  2592.84   474.52   2547.75  510.91   2876.04   1280.32  281.52  32.19  229.42  79.60  52.11   85.87  
1 1 1 -5  -10 23 o 5  108.99  40.90  373.68    346.34   428.83   359.50   -338.62   1291.95  114.10  41.88  124.45  60.08  -10.35  73.24  
1 1 1 -5  -9  1  o 14 77.11   15.16  177.51    64.73    0.00     0.00     177.51    64.73    ?       ?      77.11   15.16  0.00    15.16  
1 1 1 -5  -9  2  o 16 182.95  27.69  997.52    281.74   0.00     0.00     997.52    281.74   ?       ?      182.95  27.69  0.00    27.69  
1 1 1 -5  -9  3  f 0  428.05  68.77  5857.35   1632.58  0.00     0.00     5857.35   1632.58  ?       ?      428.05  68.77  0.00    68.77  
1 1 1 -5  -9  4  o 12 129.50  20.34  496.55    146.23   0.00     0.00     496.55    146.23   ?       ?      129.50  20.34  0.00    20.34  
1 1 1 -5  -9  5  o 17 298.13  45.47  2697.48   753.67   0.00     0.00     2697.48   753.67   ?       ?      298.13  45.47  0.00    45.47  
1 1 1 -5  -9  6  o 8  249.30  37.75  1866.40   523.33   0.00     0.00     1866.40   523.33   ?       ?      249.30  37.75  0.00    37.75  
1 1 1 -5  -9  7  o 15 286.18  31.99  2422.37   516.51   2223.73  748.31   2603.11   713.82   268.37  50.42  293.24  43.74  -24.87  66.75  
1 1 1 -5  -9  8  o 3  368.82  39.65  4068.62   826.30   3986.41  1186.83  4145.97   1151.13  356.12  60.20  365.00  56.78  -8.87   82.75  
1 1 1 -5  -9  9  x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  -9  10 o 4  276.88  22.65  2243.80   356.83   2423.91  446.36   1924.85   593.98   286.59  27.47  250.04  42.93  36.55   50.96  
1 1 1 -5  -9  11 o 1  388.21  35.27  4501.98   777.52   4305.54  959.25   4878.25   1327.60  374.81  45.51  389.86  61.34  -15.05  76.38  
1 1 1 -5  -9  12 o 1  432.97  32.88  5553.44   811.17   5557.08  1147.96  5549.81   1146.37  425.96  47.77  425.70  47.73  0.26    67.53  
1 1 1 -5  -9  13 o 11 317.10  29.68  2970.83   534.09   2970.83  534.09   0.00      0.00     317.10  29.68  ?       ?      0.00    29.68  
1 1 1 -5  -9  14 o 8  205.48  31.72  1270.00   362.17   1270.00  362.17   0.00      0.00     205.48  31.72  ?       ?      0.00    31.72  
1 1 1 -5  -9  15 o 5  277.77  33.09  2321.67   517.31   2321.67  517.31   0.00      0.00     277.77  33.09  ?       ?      0.00    33.09  
1 1 1 -5  -9  16 o 16 181.96  24.80  990.34    252.35   990.34   252.35   0.00      0.00     181.96  24.80  ?       ?      0.00    24.80  
1 1 1 -5  -9  17 o 12 171.45  23.29  879.60    223.35   916.16   236.82   585.34    671.85   174.75  24.26  146.87  56.52  27.88   61.51  
1 1 1 -5  -9  18 o 16 301.08  35.74  2810.29   605.77   2810.29  605.77   0.00      0.00     301.08  35.74  ?       ?      0.00    35.74  
1 1 1 -5  -9  19 o 8  255.14  26.19  1967.59   378.20   1859.64  415.94   2482.68   908.59   246.05  30.07  260.37  61.73  -14.32  68.67  
1 1 1 -5  -9  20 o 3  88.50   20.41  240.56    101.59   235.12   102.48   551.36    773.94   87.44   20.73  142.39  58.66  -54.95  62.21  
1 1 1 -5  -9  21 o 11 122.92  22.14  463.51    150.50   454.82   152.77   748.64    874.74   121.54  22.73  151.73  62.42  -30.19  66.43  
1 1 1 -5  -9  22 o 17 93.85   21.14  273.01    111.12   268.17   111.79   672.71    1016.46  92.94   21.40  148.38  64.39  -55.44  67.85  
1 1 1 -5  -9  23 o 19 234.20  36.63  1826.68   476.41   1822.57  516.42   1850.17   1234.30  230.54  40.50  185.58  74.97  44.96   85.21  
1 1 1 -5  -9  24 o 5  108.80  19.97  366.04    120.15   368.35   120.74   131.36    1216.46  109.14  20.01  129.96  61.50  -20.83  64.67  
1 1 1 -5  -8  1  o 8  402.20  43.07  4973.54   979.02   4424.43  1384.29  5523.05   1384.80  361.15  69.29  411.69  60.39  -50.54  91.91  
1 1 1 -5  -8  2  o 7  107.46  11.89  336.89    72.11    326.29   102.43   347.31    101.53   104.72  17.67  108.27  16.89  -3.55   24.44  
1 1 1 -5  -8  3  o 16 365.22  38.47  4028.28   794.37   4100.52  1123.46  3956.05   1123.36  358.85  56.39  351.61  57.65  7.24    80.65  
1 1 1 -5  -8  4  o 8  170.18  17.63  846.69    169.73   917.88   240.29   775.80    239.76   175.87  24.46  160.86  26.92  15.01   36.37  
1 1 1 -5  -8  5  o 5  142.63  15.06  593.37    121.45   649.40   171.96   537.62    171.54   148.30  20.77  134.22  23.10  14.08   31.06  
1 1 1 -5  -8  6  o 7  84.64   10.97  209.55    52.06    226.93   74.63    193.08    72.65    87.43   15.43  80.37   16.30  7.06    22.45  
1 1 1 -5  -8  7  o 16 365.68  37.90  3977.44   784.04   4089.04  1108.85  3865.86   1108.76  364.24  54.72  353.16  56.60  11.08   78.73  
1 1 1 -5  -8  8  f 0  219.41  37.53  1452.34   455.69   1452.34  455.69   0.00      0.00     219.41  37.53  ?       ?      0.00    37.53  
1 1 1 -5  -8  9  o 9  193.69  29.36  1116.80   316.21   0.00     0.00     1116.80   316.21   ?       ?      193.69  29.36  0.00    29.36  
1 1 1 -5  -8  10 o 1  492.14  81.64  7987.57   2225.69  0.00     0.00     7987.57   2225.69  ?       ?      492.14  81.64  0.00    81.64  
1 1 1 -5  -8  11 o 5  114.47  19.12  389.29    121.23   0.00     0.00     389.29    121.23   ?       ?      114.47  19.12  0.00    19.12  
1 1 1 -5  -8  12 o 19 414.14  46.33  5254.37   1082.64  5010.80  1547.78  5487.70   1514.93  387.93  72.16  410.42  66.58  -22.49  98.18  
1 1 1 -5  -8  13 o 12 438.37  76.26  6473.67   1849.59  6473.67  1849.59  0.00      0.00     438.37  76.26  ?       ?      0.00    76.26  
1 1 1 -5  -8  14 o 18 197.38  25.37  1153.63   280.81   1085.47  315.96   1409.81   612.60   190.24  29.92  211.01  51.12  -20.76  59.23  
1 1 1 -5  -8  15 o 15 362.49  21.35  3827.17   442.23   2771.07  511.46   6955.59   880.29   306.09  29.47  485.23  31.78  -179.14 43.34  
1 1 1 -5  -8  16 o 3  138.42  42.52  584.70    370.41   540.36   470.91   656.65    599.88   138.03  48.25  152.17  54.34  -14.14  72.68  
1 1 1 -5  -8  17 o 14 446.93  41.22  6148.00   1045.76  6178.87  1264.07  6081.04   1861.56  440.51  50.92  406.75  82.55  33.77   96.99  
1 1 1 -5  -8  18 f 0  225.83  27.68  1535.92   351.34   1535.92  351.34   0.00      0.00     225.83  27.68  ?       ?      0.00    27.68  
1 1 1 -5  -8  19 f 0  217.40  30.44  1446.43   369.55   1483.99  419.50   1316.34   780.81   218.36  34.62  192.70  62.09  25.65   71.09  
1 1 1 -5  -8  20 o 5  173.75  21.75  905.03    212.22   881.78   221.40   1168.03   744.62   171.00  23.15  179.87  60.75  -8.87   65.02  
1 1 1 -5  -8  21 o 11 122.18  19.27  450.21    130.65   441.52   132.68   727.24    748.99   120.81  19.82  150.13  59.14  -29.32  62.37  
1 1 1 -5  -8  22 o 2  183.08  21.19  1010.74   218.63   968.34   225.52   1672.98   891.24   178.62  22.49  199.74  66.46  -21.11  70.16  
1 1 1 -5  -8  23 o 14 134.77  20.64  553.68    154.62   519.29   156.53   1939.00   993.39   130.03  21.74  205.10  70.16  -75.07  73.45  
1 1 1 -5  -8  24 o 15 38.68   17.07  -18.54    74.22    -18.54   74.22    0.00      0.00     38.68   17.07  ?       ?      0.00    17.07  
1 1 1 -5  -8  25 o 16 81.30   20.43  207.40    95.20    207.65   95.54    172.26    1118.45  81.34   20.48  126.77  59.67  -45.43  63.09  
1 1 1 -5  -7  1  o 18 171.33  25.97  882.71    247.42   882.71   247.42   0.00      0.00     171.33  25.97  ?       ?      0.00    25.97  
1 1 1 -5  -7  2  o 8  324.40  52.69  3398.97   947.54   3398.97  947.54   0.00      0.00     324.40  52.69  ?       ?      0.00    52.69  
1 1 1 -5  -7  3  o 19 356.43  58.88  4171.82   1162.66  4171.82  1162.66  0.00      0.00     356.43  58.88  ?       ?      0.00    58.88  
1 1 1 -5  -7  4  o 7  407.71  69.66  5641.93   1571.97  5641.93  1571.97  0.00      0.00     407.71  69.66  ?       ?      0.00    69.66  
1 1 1 -5  -7  5  o 18 269.87  41.83  2247.71   627.11   2247.71  627.11   0.00      0.00     269.87  41.83  ?       ?      0.00    41.83  
1 1 1 -5  -7  6  o 7  139.45  21.01  577.20    162.95   577.20   162.95   0.00      0.00     139.45  21.01  ?       ?      0.00    21.01  
1 1 1 -5  -7  7  o 6  290.36  44.73  2587.20   721.65   2587.20  721.65   0.00      0.00     290.36  44.73  ?       ?      0.00    44.73  
1 1 1 -5  -7  8  x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  -7  9  o 19 243.62  25.16  1741.09   346.78   1478.05  489.70   2005.68   491.15   220.51  40.16  259.59  33.76  -39.07  52.47  
1 1 1 -5  -7  10 o 11 437.75  33.86  5642.26   844.40   5610.55  1036.69  5704.77   1455.51  433.54  42.19  428.69  60.85  4.85    74.05  
1 1 1 -5  -7  11 o 8  635.89  71.17  12788.33  2553.51  10680.58 3611.00  14896.60  3611.43  537.04  120.14 661.23  98.11  -124.19 155.11 
1 1 1 -5  -7  12 o 17 285.58  21.77  2377.72   354.22   2608.71  440.32   1954.08   596.30   298.26  25.98  253.04  42.56  45.22   49.86  
1 1 1 -5  -7  13 o 9  426.68  35.96  5430.70   872.66   5455.70  1233.65  5405.65   1234.59  419.08  52.42  416.93  52.76  2.15    74.38  
1 1 1 -5  -7  14 o 8  337.67  56.94  3637.21   1064.49  3637.21  1064.49  0.00      0.00     337.67  56.94  ?       ?      0.00    56.94  
1 1 1 -5  -7  15 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  -7  16 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  -7  17 o 1  164.95  44.64  853.77    432.86   853.77   432.86   0.00      0.00     164.95  44.64  ?       ?      0.00    44.64  
1 1 1 -5  -7  18 o 19 365.66  64.16  4505.37   1297.62  4505.37  1297.62  0.00      0.00     365.66  64.16  ?       ?      0.00    64.16  
1 1 1 -5  -7  19 o 12 421.76  38.06  5489.76   911.53   5640.51  1094.38  5148.25   1647.14  420.94  46.04  367.57  80.31  53.37   92.57  
1 1 1 -5  -7  20 o 8  111.17  18.70  370.75    115.14   380.93   117.05   67.62     638.82   112.71  18.75  116.89  50.88  -4.18   54.22  
1 1 1 -5  -7  21 o 13 239.60  25.28  1732.99   342.50   1767.51  374.40   1555.91   848.01   240.91  27.57  202.34  64.66  38.57   70.29  
1 1 1 -5  -7  22 o 13 88.32   19.11  238.71    94.07    237.97   94.77    288.50    776.13   88.15   19.27  129.92  56.32  -41.77  59.53  
1 1 1 -5  -7  23 o 17 109.30  20.20  365.59    122.07   371.84   123.34   68.15     851.06   110.24  20.23  123.31  55.85  -13.07  59.41  
1 1 1 -5  -7  24 o 1  206.05  22.01  1291.57   256.32   1291.57  256.32   0.00      0.00     206.05  22.01  ?       ?      0.00    22.01  
1 1 1 -5  -7  25 o 16 42.67   17.67  17.79     70.68    17.79    70.68    0.00      0.00     42.67   17.67  ?       ?      0.00    17.67  
1 1 1 -5  -7  26 o 8  159.36  18.79  773.42    168.61   762.13   170.85   1194.82   1044.06  157.97  19.24  152.39  65.69  5.58    68.45  
1 1 1 -5  -6  1  o 3  140.26  14.43  575.15    114.49   570.55   161.95   579.74    161.89   138.29  21.06  139.47  20.86  -1.18   29.64  
1 1 1 -5  -6  2  o 11 388.16  41.94  4668.50   919.67   4566.34  1300.58  4770.67   1300.64  367.03  64.06  376.81  62.30  -9.78   89.36  
1 1 1 -5  -6  3  o 18 161.15  16.55  761.11    150.90   745.63   213.37   776.60    213.43   157.63  24.36  161.09  23.79  -3.46   34.06  
1 1 1 -5  -6  4  o 13 512.30  58.61  8598.65   1692.59  8415.85  2393.65  8781.46   2393.72  467.04  92.55  480.65  90.06  -13.60  129.14 
1 1 1 -5  -6  5  o 14 194.84  19.99  1117.15   220.39   931.49   311.08   1304.23   312.28   174.25  32.29  208.82  26.66  -34.57  41.87  
1 1 1 -5  -6  6  o 1  452.43  49.54  6439.53   1265.74  5875.74  1789.87  7003.53   1790.19  405.65  79.71  452.32  71.30  -46.66  106.94 
1 1 1 -5  -6  7  o 3  365.22  59.77  4341.23   1209.77  4341.23  1209.77  0.00      0.00     365.22  59.77  ?       ?      0.00    59.77  
1 1 1 -5  -6  8  x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  -6  9  o 10 221.89  16.89  1430.95   213.49   1475.57  265.14   1348.68   360.03   224.63  20.80  212.41  30.39  12.22   36.82  
1 1 1 -5  -6  10 o 19 466.64  76.50  7100.90   1978.22  7100.90  1978.22  0.00      0.00     466.64  76.50  ?       ?      0.00    76.50  
1 1 1 -5  -6  11 o 12 135.09  20.33  539.26    152.81   539.26   152.81   0.00      0.00     135.09  20.33  ?       ?      0.00    20.33  
1 1 1 -5  -6  12 o 6  166.08  24.87  817.58    229.78   817.58   229.78   0.00      0.00     166.08  24.87  ?       ?      0.00    24.87  
1 1 1 -5  -6  13 o 9  166.95  25.05  827.36    232.71   827.36   232.71   0.00      0.00     166.95  25.05  ?       ?      0.00    25.05  
1 1 1 -5  -6  14 o 14 246.79  37.58  1845.45   515.56   1845.45  515.56   0.00      0.00     246.79  37.58  ?       ?      0.00    37.58  
1 1 1 -5  -6  15 o 11 112.28  19.62  376.12    121.84   371.50   130.43   407.79    341.46   111.27  21.19  120.29  41.13  -9.01   46.27  
1 1 1 -5  -6  16 o 19 432.34  72.76  6241.75   1741.68  6241.75  1741.68  0.00      0.00     432.34  72.76  ?       ?      0.00    72.76  
1 1 1 -5  -6  17 o 12 233.73  30.22  1629.95   396.04   2133.03  453.49   13.18     812.96   267.92  30.00  132.77  57.60  135.15  64.94  
1 1 1 -5  -6  18 o 10 239.81  27.56  1707.92   372.57   1829.05  420.46   1265.24   803.81   247.47  30.22  197.91  62.92  49.56   69.80  
1 1 1 -5  -6  19 o 17 170.91  40.08  922.83    386.40   922.83   386.40   0.00      0.00     170.91  40.08  ?       ?      0.00    40.08  
1 1 1 -5  -6  20 o 14 230.84  43.24  1710.49   551.91   1710.49  551.91   0.00      0.00     230.84  43.24  ?       ?      0.00    43.24  
1 1 1 -5  -6  21 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  -6  22 o 15 166.05  36.93  894.13    342.91   894.13   342.91   0.00      0.00     166.05  36.93  ?       ?      0.00    36.93  
1 1 1 -5  -6  23 o 18 87.46   18.82  234.21    91.67    224.31   92.35    895.55    754.81   85.47   19.28  157.09  60.05  -71.63  63.07  
1 1 1 -5  -6  24 o 12 132.21  17.61  524.92    130.36   514.08   132.16   914.53    792.29   130.66  18.11  154.84  60.87  -24.18  63.51  
1 1 1 -5  -6  25 o 17 197.99  20.09  1185.87   225.17   1137.46  232.73   1894.88   890.69   193.25  21.33  202.56  66.39  -9.31   69.74  
1 1 1 -5  -6  26 o 10 44.45   17.41  37.45     64.65    38.68    64.82    -204.61   908.53   44.71   17.46  110.93  52.68  -66.22  55.50  
1 1 1 -5  -6  27 o 12 191.32  20.05  1123.70   216.92   1123.70  216.92   0.00      0.00     191.32  20.05  ?       ?      0.00    20.05  
1 1 1 -5  -5  1  o 16 356.71  58.75  4167.16   1161.15  0.00     0.00     4167.16   1161.15  ?       ?      356.71  58.75  0.00    58.75  
1 1 1 -5  -5  2  o 19 284.57  29.69  2422.97   477.93   2336.36  675.86   2509.59   675.92   272.65  44.73  283.75  42.83  -11.09  61.93  
1 1 1 -5  -5  3  f 0  311.49  32.71  2923.26   576.17   2959.75  814.86   2886.78   814.79   305.52  48.04  301.24  48.78  4.28    68.47  
1 1 1 -5  -5  4  o 8  145.88  14.95  622.31    123.39   577.85   174.43   666.85    174.58   138.83  22.67  149.81  20.86  -10.98  30.81  
1 1 1 -5  -5  5  o 3  327.56  34.63  3255.47   641.39   3225.63  907.03   3285.31   907.11   316.09  51.78  319.43  51.20  -3.34   72.81  
1 1 1 -5  -5  6  o 17 303.86  31.93  2780.91   548.58   2844.81  775.81   2717.00   775.81   299.84  46.58  292.14  47.92  7.69    66.83  
1 1 1 -5  -5  7  x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  -5  8  o 19 144.89  21.83  625.62    175.96   0.00     0.00     625.62    175.96   ?       ?      144.89  21.83  0.00    21.83  
1 1 1 -5  -5  9  o 2  526.19  43.05  8456.44   1288.94  8690.82  1578.97  7988.29   2231.54  525.48  53.07  473.08  85.31  52.41   100.47 
1 1 1 -5  -5  10 o 3  197.33  21.38  1144.08   238.34   1073.13  341.96   1211.10   332.37   188.14  32.86  201.05  29.69  -12.90  44.28  
1 1 1 -5  -5  11 o 16 211.04  18.91  1298.48   226.67   1191.71  278.63   1507.44   389.79   200.97  24.67  224.82  31.03  -23.84  39.64  
1 1 1 -5  -5  12 o 13 261.76  26.74  2013.53   396.17   2100.76  560.34   1926.35   560.19   264.43  38.00  252.41  39.99  12.02   55.17  
1 1 1 -5  -5  13 o 5  779.48  91.65  20294.11  4022.90  18651.55 5689.23  21936.69  5689.26  670.61  151.38 751.31  136.95 -80.69  204.14 
1 1 1 -5  -5  14 o 15 224.05  22.71  1470.21   288.04   1470.21  288.04   0.00      0.00     224.05  22.71  ?       ?      0.00    22.71  
1 1 1 -5  -5  15 o 4  152.79  24.03  695.42    203.86   695.42   203.86   0.00      0.00     152.79  24.03  ?       ?      0.00    24.03  
1 1 1 -5  -5  16 o 15 150.87  24.31  680.50    203.38   680.50   203.38   0.00      0.00     150.87  24.31  ?       ?      0.00    24.31  
1 1 1 -5  -5  17 o 3  345.68  55.43  3799.74   1062.86  3799.74  1062.86  0.00      0.00     345.68  55.43  ?       ?      0.00    55.43  
1 1 1 -5  -5  18 o 9  414.18  68.73  5647.19   1576.89  5647.19  1576.89  0.00      0.00     414.18  68.73  ?       ?      0.00    68.73  
1 1 1 -5  -5  19 o 12 83.13   19.47  208.64    91.27    239.82   92.78    -725.89   507.95   89.29   18.70  78.48   37.83  10.81   42.20  
1 1 1 -5  -5  20 o 13 305.74  26.00  2776.99   451.95   2751.77  527.49   2846.62   876.43   302.30  30.83  294.42  53.84  7.88    62.04  
1 1 1 -5  -5  21 o 1  223.53  26.56  1505.98   334.12   1334.90  389.44   1983.21   650.43   207.23  33.91  245.35  47.90  -38.12  58.69  
1 1 1 -5  -5  22 o 12 66.10   28.63  -9.64     200.31   2.73     211.88   -113.65   614.46   68.89   29.64  106.44  47.90  -37.54  56.33  
1 1 1 -5  -5  23 o 11 193.59  36.82  1215.08   394.24   1215.08  394.24   0.00      0.00     193.59  36.82  ?       ?      0.00    36.82  
1 1 1 -5  -5  24 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  -5  25 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  -5  26 o 9  188.86  35.31  1202.85   368.79   1202.85  368.79   0.00      0.00     188.86  35.31  ?       ?      0.00    35.31  
1 1 1 -5  -5  27 o 19 123.09  15.06  455.24    104.23   454.50   105.04   502.70    841.02   122.93  15.21  125.70  56.35  -2.77   58.37  
1 1 1 -5  -5  28 o 1  147.21  24.25  694.03    197.79   690.29   202.87   765.68    888.85   146.31  25.05  131.46  58.50  14.85   63.64  
1 1 1 -5  -4  1  o 11 205.50  21.04  1240.93   244.73   1268.59  346.14   1213.28   346.06   205.34  30.27  200.49  31.07  4.85    43.38  
1 1 1 -5  -4  2  o 8  147.33  22.09  645.99    181.10   645.99   181.10   0.00      0.00     147.33  22.09  ?       ?      0.00    22.09  
1 1 1 -5  -4  3  o 5  217.08  22.34  1388.79   274.49   1315.32  388.17   1462.28   388.22   207.84  33.69  220.07  31.64  -12.23  46.21  
1 1 1 -5  -4  4  o 14 161.71  16.55  765.49    151.48   783.20   214.21   747.77    214.25   161.97  23.74  158.03  24.40  3.95    34.05  
1 1 1 -5  -4  5  o 17 271.87  28.25  2205.39   434.54   2134.87  614.50   2275.92   614.55   261.49  42.39  270.93  40.78  -9.44   58.82  
1 1 1 -5  -4  6  o 6  166.97  25.21  836.75    234.09   836.75   234.09   0.00      0.00     166.97  25.21  ?       ?      0.00    25.21  
1 1 1 -5  -4  7  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  -4  8  o 17 222.00  22.96  1458.22   288.34   1545.28  407.77   1371.15   407.78   225.41  32.45  211.20  34.85  14.21   47.61  
1 1 1 -5  -4  9  o 5  267.12  22.97  2102.62   348.83   2052.85  427.61   2201.62   603.11   261.96  28.92  266.40  40.73  -4.44   49.95  
1 1 1 -5  -4  10 o 6  172.53  17.68  872.11    172.63   802.27   243.89   942.23    244.38   163.21  26.97  177.81  24.60  -14.60  36.51  
1 1 1 -5  -4  11 o 18 245.46  17.51  1753.18   245.05   1995.13  301.10   1278.57   421.71   261.37  20.23  204.18  37.35  57.19   42.48  
1 1 1 -5  -4  12 o 14 106.43  10.95  329.44    65.94    402.55   93.41    256.80    93.10    117.32  14.16  92.66   18.15  24.65   23.02  
1 1 1 -5  -4  13 o 18 488.55  46.70  7204.22   1293.69  7204.22  1293.69  0.00      0.00     488.55  46.70  ?       ?      0.00    46.70  
1 1 1 -5  -4  14 o 2  430.53  49.95  5637.09   1211.64  5637.09  1211.64  0.00      0.00     430.53  49.95  ?       ?      0.00    49.95  
1 1 1 -5  -4  15 o 8  166.59  18.53  811.98    174.17   811.98   174.17   0.00      0.00     166.59  18.53  ?       ?      0.00    18.53  
1 1 1 -5  -4  16 o 18 138.04  20.40  564.48    156.78   661.66   181.38   277.32    311.80   149.38  21.79  106.16  39.00  43.22   44.68  
1 1 1 -5  -4  17 o 6  259.24  29.91  2006.11   437.03   2006.11  437.03   0.00      0.00     259.24  29.91  ?       ?      0.00    29.91  
1 1 1 -5  -4  18 o 12 211.88  20.08  1315.15   241.32   1211.49  271.30   1707.85   528.05   202.43  23.80  235.39  40.54  -32.96  47.01  
1 1 1 -5  -4  19 o 3  477.17  24.39  6664.01   665.87   4872.23  792.36   10971.01  1228.48  403.80  34.51  606.42  35.44  -202.62 49.47  
1 1 1 -5  -4  20 o 10 214.75  23.75  1365.00   287.94   1526.72  323.30   744.67    633.19   226.83  25.26  158.32  55.90  68.51   61.34  
1 1 1 -5  -4  21 o 11 295.88  34.88  2686.10   581.13   2725.54  761.09   2630.96   899.93   290.70  47.23  277.82  58.29  12.88   75.02  
1 1 1 -5  -4  22 o 16 104.69  19.08  330.62    110.42   324.73   112.40   492.90    590.23   103.61  19.62  135.41  52.74  -31.81  56.27  
1 1 1 -5  -4  23 o 15 52.89   17.42  78.71     61.27    78.71    61.27    0.00      0.00     52.89   17.42  ?       ?      0.00    17.42  
1 1 1 -5  -4  24 o 11 178.48  28.80  998.46    285.00   998.46   285.00   0.00      0.00     178.48  28.80  ?       ?      0.00    28.80  
1 1 1 -5  -4  25 o 19 173.99  18.17  906.90    178.77   898.97   184.50   1028.86   723.27   172.93  18.89  159.96  59.29  12.97   62.22  
1 1 1 -5  -4  26 o 6  73.76   18.40  168.57    77.66    168.57   77.66    0.00      0.00     73.76   18.40  ?       ?      0.00    18.40  
1 1 1 -5  -4  27 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  -4  28 o 11 61.41   24.67  74.04     132.84   74.04    132.84   0.00      0.00     61.41   24.67  ?       ?      0.00    24.67  
1 1 1 -5  -3  1  o 7  169.27  17.26  837.10    165.39   865.96   234.02   808.29    233.76   170.71  24.59  164.59  25.57  6.12    35.47  
1 1 1 -5  -3  2  o 11 200.21  20.49  1175.32   232.13   1154.51  328.35   1196.13   328.22   196.05  30.14  199.80  29.50  -3.75   42.17  
1 1 1 -5  -3  3  o 13 243.50  37.20  1805.78   503.54   0.00     0.00     1805.78   503.54   ?       ?      243.50  37.20  0.00    37.20  
1 1 1 -5  -3  4  o 18 367.05  59.92  4375.99   1219.10  0.00     0.00     4375.99   1219.10  ?       ?      367.05  59.92  0.00    59.92  
1 1 1 -5  -3  5  o 15 361.42  59.27  4261.20   1187.15  0.00     0.00     4261.20   1187.15  ?       ?      361.42  59.27  0.00    59.27  
1 1 1 -5  -3  6  x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  -3  7  o 8  216.14  33.09  1424.75   397.56   0.00     0.00     1424.75   397.56   ?       ?      216.14  33.09  0.00    33.09  
1 1 1 -5  -3  8  o 19 181.97  27.61  999.70    279.38   0.00     0.00     999.70    279.38   ?       ?      181.97  27.61  0.00    27.61  
1 1 1 -5  -3  9  o 6  209.79  32.12  1341.67   374.48   0.00     0.00     1341.67   374.48   ?       ?      209.79  32.12  0.00    32.12  
1 1 1 -5  -3  10 o 6  311.70  50.15  3110.44   866.86   0.00     0.00     3110.44   866.86   ?       ?      311.70  50.15  0.00    50.15  
1 1 1 -5  -3  11 o 15 480.00  38.29  6983.57   1046.21  7407.18  1281.65  6137.59   1811.21  488.62  46.24  416.90  78.56  71.72   91.16  
1 1 1 -5  -3  12 o 10 497.12  44.04  7542.05   1243.76  7483.00  1523.53  7660.04   2153.57  486.91  55.50  468.22  83.17  18.69   99.98  
1 1 1 -5  -3  13 o 13 254.45  23.24  1897.03   335.71   1584.34  411.56   2518.74   580.32   230.15  32.02  289.96  35.61  -59.82  47.89  
1 1 1 -5  -3  14 o 6  515.90  43.03  7975.52   1262.88  8340.94  1547.41  7246.69   2185.38  522.55  52.29  464.90  85.02  57.64   99.81  
1 1 1 -5  -3  15 o 5  463.32  52.95  6576.49   1383.09  6576.49  1383.09  0.00      0.00     463.32  52.95  ?       ?      0.00    52.95  
1 1 1 -5  -3  16 o 3  514.66  89.18  9115.70   2539.46  9115.70  2539.46  0.00      0.00     514.66  89.18  ?       ?      0.00    89.18  
1 1 1 -5  -3  17 o 14 303.25  25.76  2708.49   444.19   2576.24  537.38   2993.78   789.24   293.53  32.43  311.07  45.55  -17.53  55.91  
1 1 1 -5  -3  18 o 1  179.88  20.23  952.49    205.24   952.49   205.24   0.00      0.00     179.88  20.23  ?       ?      0.00    20.23  
1 1 1 -5  -3  19 o 5  456.71  42.40  6356.49   1098.94  6580.40  1336.87  5889.92   1929.83  458.47  51.70  405.94  85.52  52.53   99.93  
1 1 1 -5  -3  20 o 15 29.33   14.69  -299.30   105.47   -199.50  107.77   -2568.02  513.82   34.27   16.73  ?       ?      0.00    16.73  
1 1 1 -5  -3  21 o 6  284.07  26.51  2401.26   427.36   2516.16  498.39   2082.17   830.56   289.24  30.47  248.05  59.16  41.20   66.55  
1 1 1 -5  -3  22 o 10 288.02  24.81  2477.13   406.23   2375.78  464.55   2806.52   837.46   279.89  29.35  289.09  52.39  -9.20   60.05  
1 1 1 -5  -3  23 o 8  55.94   17.27  91.56     61.01    91.56    61.01    0.00      0.00     55.94   17.27  ?       ?      0.00    17.27  
1 1 1 -5  -3  24 o 15 186.68  18.11  1035.27   191.63   995.45   200.04   1479.44   668.03   182.57  19.38  199.14  56.07  -16.56  59.32  
1 1 1 -5  -3  25 o 6  189.04  30.86  1143.03   323.36   1143.03  323.36   0.00      0.00     189.04  30.86  ?       ?      0.00    30.86  
1 1 1 -5  -3  26 o 1  216.58  29.99  1505.01   362.87   1454.75  412.18   1678.19   765.12   208.51  35.72  195.75  61.28  12.75   70.93  
1 1 1 -5  -3  27 o 1  51.68   17.43  75.60     61.32    72.09    61.61    436.48    624.72   50.93   17.47  120.18  51.29  -69.25  54.18  
1 1 1 -5  -3  28 o 12 135.39  15.09  551.42    115.28   551.42   115.28   0.00      0.00     135.39  15.09  ?       ?      0.00    15.09  
1 1 1 -5  -3  29 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  -2  1  o 5  127.70  19.05  482.04    135.42   0.00     0.00     482.04    135.42   ?       ?      127.70  19.05  0.00    19.05  
1 1 1 -5  -2  2  f 0  351.16  55.27  3867.44   1077.46  0.00     0.00     3867.44   1077.46  ?       ?      351.16  55.27  0.00    55.27  
1 1 1 -5  -2  3  o 12 174.14  26.05  903.87    252.43   0.00     0.00     903.87    252.43   ?       ?      174.14  26.05  0.00    26.05  
1 1 1 -5  -2  4  o 12 263.42  40.43  2123.37   591.85   0.00     0.00     2123.37   591.85   ?       ?      263.42  40.43  0.00    40.43  
1 1 1 -5  -2  5  o 8  230.78  23.71  1570.93   309.70   1579.45  438.00   1562.41   437.96   228.10  34.53  226.77  34.75  1.33    48.99  
1 1 1 -5  -2  6  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  -2  7  o 4  109.80  11.28  351.28    70.08    349.36   99.13    353.19    99.09    108.60  16.41  109.23  16.30  -0.63   23.13  
1 1 1 -5  -2  8  o 14 180.31  27.29  979.95    273.64   979.95   273.64   0.00      0.00     180.31  27.29  ?       ?      0.00    27.29  
1 1 1 -5  -2  9  o 13 281.43  29.45  2377.90   468.72   2395.99  662.85   2359.80   662.89   275.83  43.28  273.48  43.69  2.35    61.50  
1 1 1 -5  -2  10 o 17 394.85  42.94  4858.04   957.70   5032.85  1354.41  4683.24   1354.39  385.25  63.45  368.75  66.42  16.50   91.86  
1 1 1 -5  -2  11 o 1  136.60  20.50  555.74    155.83   555.74   155.83   0.00      0.00     136.60  20.50  ?       ?      0.00    20.50  
1 1 1 -5  -2  12 o 9  430.42  46.66  5764.69   1134.57  5776.98  1605.50  5752.43   1603.54  411.89  70.43  410.92  70.51  0.97    99.66  
1 1 1 -5  -2  13 o 1  342.35  32.87  3496.20   637.97   3917.74  906.53   3082.56   897.99   356.83  45.27  312.73  51.83  44.11   68.82  
1 1 1 -5  -2  14 o 16 478.89  58.84  7182.39   1583.53  5916.50  2241.26  8444.20   2237.64  405.65  97.46  503.05  80.17  -97.41  126.20 
1 1 1 -5  -2  15 f 0  237.28  36.87  1696.88   485.88   1696.88  485.88   0.00      0.00     237.28  36.87  ?       ?      0.00    36.87  
1 1 1 -5  -2  16 o 12 284.37  44.36  2468.84   700.52   2468.84  700.52   0.00      0.00     284.37  44.36  ?       ?      0.00    44.36  
1 1 1 -5  -2  17 o 9  112.57  26.80  385.26    170.73   385.26   170.73   0.00      0.00     112.57  26.80  ?       ?      0.00    26.80  
1 1 1 -5  -2  18 o 19 42.19   15.82  38.31     51.77    49.26    52.93    -203.34   248.65   44.92   16.13  62.50   29.00  -17.58  33.18  
1 1 1 -5  -2  19 o 6  116.74  20.99  408.53    135.52   408.53   135.52   0.00      0.00     116.74  20.99  ?       ?      0.00    20.99  
1 1 1 -5  -2  20 o 19 121.34  21.10  440.43    141.66   602.41   148.24   -1263.85  480.84   142.95  18.50  63.51   31.75  79.45   36.74  
1 1 1 -5  -2  21 o 14 135.99  16.39  543.49    125.35   608.63   130.31   -263.18   458.58   144.09  16.03  87.98   40.29  56.11   43.36  
1 1 1 -5  -2  22 o 12 179.11  24.17  963.11    242.22   938.61   270.80   1061.18   541.76   175.58  27.79  178.16  50.61  -2.57   57.74  
1 1 1 -5  -2  23 o 14 289.88  49.75  2834.93   798.07   2834.93  798.07   0.00      0.00     289.88  49.75  ?       ?      0.00    49.75  
1 1 1 -5  -2  24 o 5  30.72   13.64  -16.68    48.07    -12.36   48.26    -559.48   541.09   31.44   13.83  83.55   39.95  -52.11  42.28  
1 1 1 -5  -2  25 o 11 249.54  21.30  1876.23   302.17   1823.18  329.72   2154.43   755.09   244.56  23.79  237.25  56.29  7.31    61.11  
1 1 1 -5  -2  26 o 12 296.25  24.36  2705.52   410.59   2540.07  464.04   3302.18   881.22   283.06  28.97  291.71  54.63  -8.66   61.83  
1 1 1 -5  -2  27 o 16 119.27  12.58  421.31    84.83    421.31   84.83    0.00      0.00     119.27  12.58  ?       ?      0.00    12.58  
1 1 1 -5  -2  28 o 2  126.80  21.61  506.28    151.67   506.28   151.67   0.00      0.00     126.80  21.61  ?       ?      0.00    21.61  
1 1 1 -5  -2  29 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  -1  1  x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  -1  2  o 18 243.28  36.79  1785.26   497.72   0.00     0.00     1785.26   497.72   ?       ?      243.28  36.79  0.00    36.79  
1 1 1 -5  -1  3  o 2  426.32  45.17  5519.38   1088.58  5408.28  1539.50  5630.47   1539.46  408.55  68.03  418.13  66.35  -9.58   95.03  
1 1 1 -5  -1  4  o 8  52.56   8.73   81.56     25.42    0.00     0.00     81.56     25.42    ?       ?      52.56   8.73   0.00    8.73   
1 1 1 -5  -1  5  o 6  313.40  49.15  3069.45   855.24   3069.45  855.24   0.00      0.00     313.40  49.15  ?       ?      0.00    49.15  
1 1 1 -5  -1  6  o 7  281.07  43.78  2452.65   683.44   0.00     0.00     2452.65   683.44   ?       ?      281.07  43.78  0.00    43.78  
1 1 1 -5  -1  7  o 8  295.78  46.74  2753.48   767.24   2753.48  767.24   0.00      0.00     295.78  46.74  ?       ?      0.00    46.74  
1 1 1 -5  -1  8  o 13 333.17  54.50  3612.72   1006.45  3612.72  1006.45  0.00      0.00     333.17  54.50  ?       ?      0.00    54.50  
1 1 1 -5  -1  9  o 9  262.97  41.33  2165.06   603.41   2165.06  603.41   0.00      0.00     262.97  41.33  ?       ?      0.00    41.33  
1 1 1 -5  -1  10 o 14 335.27  55.65  3710.01   1033.55  3710.01  1033.55  0.00      0.00     335.27  55.65  ?       ?      0.00    55.65  
1 1 1 -5  -1  11 o 18 385.13  67.07  5130.28   1429.00  5130.28  1429.00  0.00      0.00     385.13  67.07  ?       ?      0.00    67.07  
1 1 1 -5  -1  12 o 14 268.49  42.07  2249.95   627.07   2249.95  627.07   0.00      0.00     268.49  42.07  ?       ?      0.00    42.07  
1 1 1 -5  -1  13 o 1  508.15  43.75  7923.09   1263.91  8053.42  1548.38  7662.82   2188.02  503.74  54.41  460.90  85.85  42.84   101.64 
1 1 1 -5  -1  14 o 5  342.24  28.88  3458.55   562.03   3454.78  689.09   3466.06   971.35   339.51  35.90  332.37  52.66  7.14    63.73  
1 1 1 -5  -1  15 o 19 503.23  53.30  7798.76   1516.27  7798.76  1516.27  0.00      0.00     503.23  53.30  ?       ?      0.00    53.30  
1 1 1 -5  -1  16 o 7  102.56  13.62  308.40    78.20    308.40   78.20    0.00      0.00     102.56  13.62  ?       ?      0.00    13.62  
1 1 1 -5  -1  17 o 3  270.03  29.55  2161.64   450.54   2161.64  450.54   0.00      0.00     270.03  29.55  ?       ?      0.00    29.55  
1 1 1 -5  -1  18 o 13 219.03  18.63  1401.73   232.02   1361.79  275.09   1500.16   431.86   214.96  22.63  221.98  35.05  -7.02   41.72  
1 1 1 -5  -1  19 f 0  399.74  68.71  5441.77   1519.90  5441.77  1519.90  0.00      0.00     399.74  68.71  ?       ?      0.00    68.71  
1 1 1 -5  -1  20 o 4  57.76   22.83  54.87     111.97   54.87    111.97   0.00      0.00     57.76   22.83  ?       ?      0.00    22.83  
1 1 1 -5  -1  21 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  -1  22 o 6  123.86  15.02  451.21    104.61   488.68   107.64   -187.14   444.32   129.01  14.80  88.86   40.29  40.15   42.92  
1 1 1 -5  -1  23 o 13 438.41  39.17  6078.02   975.47   6211.92  1178.10  5786.04   1739.66  433.39  48.17  372.50  83.43  60.88   96.34  
1 1 1 -5  -1  24 o 13 163.72  15.57  789.97    144.54   802.03   149.92   630.80    544.57   164.85  16.05  139.77  51.51  25.07   53.95  
1 1 1 -5  -1  25 o 10 74.08   12.46  163.93    51.09    164.44   51.33    108.98    530.97   74.19   12.50  105.89  46.24  -31.71  47.89  
1 1 1 -5  -1  26 o 17 167.37  15.48  832.68    147.08   845.59   152.39   657.07    562.10   168.50  15.94  134.53  51.72  33.96   54.12  
1 1 1 -5  -1  27 o 9  269.22  23.97  2255.31   366.63   2255.31  366.63   0.00      0.00     269.22  23.97  ?       ?      0.00    23.97  
1 1 1 -5  -1  28 o 10 42.10   15.82  40.80     51.83    40.80    51.83    0.00      0.00     42.10   15.82  ?       ?      0.00    15.82  
1 1 1 -5  -1  29 o 1  87.55   42.12  -298.15   622.29   0.00     0.00     -298.15   622.29   ?       ?      87.55   42.12  0.00    42.12  
1 1 1 -5  -1  30 o 8  73.30   12.47  163.39    50.59    159.87   50.73    786.94    674.94   72.43   12.66  122.63  52.84  -50.20  54.33  
1 1 1 -5  0   1  o 9  276.17  28.34  2248.13   442.97   2260.34  626.49   2235.92   626.43   273.08  41.25  271.48  41.51  1.60    58.52  
1 1 1 -5  0   2  f 0  164.25  16.76  787.04    155.80   752.27   220.37   821.79    220.32   158.98  24.97  166.59  23.71  -7.61   34.43  
1 1 1 -5  0   3  o 18 192.96  19.68  1089.12   214.99   1081.74  304.05   1096.51   304.03   190.33  28.72  191.71  28.49  -1.38   40.46  
1 1 1 -5  0   4  x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  0   5  x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  0   6  o 17 214.42  32.53  1390.81   387.86   1390.81  387.86   0.00      0.00     214.42  32.53  ?       ?      0.00    32.53  
1 1 1 -5  0   7  x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  0   8  o 7  68.56   10.62  138.64    40.45    138.64   40.45    0.00      0.00     68.56   10.62  ?       ?      0.00    10.62  
1 1 1 -5  0   9  o 5  54.96   6.28   87.97     19.45    94.23    27.78    81.96     27.23    56.54   8.85   52.56   9.37   3.98    12.89  
1 1 1 -5  0   10 o 1  469.04  53.38  7160.99   1411.76  7010.36  1996.54  7311.61   1996.53  429.60  83.97  441.81  81.73  -12.21  117.17 
1 1 1 -5  0   11 o 2  460.45  52.21  6867.58   1355.82  6527.21  1917.41  7207.95   1917.43  414.92  83.39  442.97  78.26  -28.05  114.37 
1 1 1 -5  0   12 o 7  421.70  33.53  5368.32   804.94   5833.53  986.20   4439.92   1393.19  435.35  39.90  354.98  70.85  80.37   81.32  
1 1 1 -5  0   13 o 2  447.23  36.68  6053.47   933.49   6479.12  1143.72  5204.09   1615.65  457.68  44.07  384.12  75.96  73.57   87.82  
1 1 1 -5  0   14 o 10 356.64  37.37  3837.99   753.72   3954.97  1065.99  3721.05   1065.85  353.03  54.34  341.02  56.42  12.01   78.33  
1 1 1 -5  0   15 f 0  350.15  55.15  3847.04   1071.93  3847.04  1071.93  0.00      0.00     350.15  55.15  ?       ?      0.00    55.15  
1 1 1 -5  0   16 o 9  261.17  39.73  2067.40   576.85   2067.40  576.85   0.00      0.00     261.17  39.73  ?       ?      0.00    39.73  
1 1 1 -5  0   17 f 0  434.18  71.57  6180.76   1721.85  6180.76  1721.85  0.00      0.00     434.18  71.57  ?       ?      0.00    71.57  
1 1 1 -5  0   18 o 3  244.94  37.67  1832.94   512.79   1832.94  512.79   0.00      0.00     244.94  37.67  ?       ?      0.00    37.67  
1 1 1 -5  0   19 o 9  217.22  23.25  1396.20   285.41   1680.68  341.12   732.26    521.13   237.90  25.37  153.78  50.80  84.12   56.79  
1 1 1 -5  0   20 o 8  160.34  16.52  752.86    149.86   749.60   162.96   770.74    381.52   159.67  18.10  156.23  41.74  3.44    45.50  
1 1 1 -5  0   21 o 9  181.04  34.20  1008.23   342.42   1008.23  342.42   0.00      0.00     181.04  34.20  ?       ?      0.00    34.20  
1 1 1 -5  0   22 o 19 220.94  19.59  1435.57   245.87   1445.73  277.83   1398.87   528.06   220.98  22.20  208.03  45.49  12.95   50.62  
1 1 1 -5  0   23 o 18 137.61  22.70  573.88    173.04   573.88   173.04   0.00      0.00     137.61  22.70  ?       ?      0.00    22.70  
1 1 1 -5  0   24 f 0  252.48  42.26  2108.43   590.82   2108.43  590.82   0.00      0.00     252.48  42.26  ?       ?      0.00    42.26  
1 1 1 -5  0   25 o 16 44.41   16.25  47.52     54.01    47.52    54.01    0.00      0.00     44.41   16.25  ?       ?      0.00    16.25  
1 1 1 -5  0   26 o 14 204.83  18.35  1260.05   213.46   1295.87  229.96   1037.04   573.84   207.12  19.57  160.94  53.32  46.18   56.80  
1 1 1 -5  0   27 o 2  45.53   13.29  62.17     36.87    62.17    36.87    0.00      0.00     45.53   13.29  ?       ?      0.00    13.29  
1 1 1 -5  0   28 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  0   29 o 11 59.51   12.92  108.73    42.86    109.71   42.99    -52.15    549.59   59.79   12.91  90.33   42.30  -30.54  44.23  
1 1 1 -5  0   30 o 17 108.34  19.01  372.77    113.95   386.12   115.92   -9.60     620.46   110.32  18.99  91.85   43.60  18.47   47.55  
1 1 1 -5  1   1  o 17 237.66  24.36  1658.28   327.59   1584.28  463.29   1732.28   463.28   229.11  36.44  240.34  34.57  -11.23  50.23  
1 1 1 -5  1   2  o 6  457.64  48.63  6386.22   1258.10  6343.71  1779.24  6428.72   1779.21  440.97  72.82  444.40  72.22  -3.42   102.56 
1 1 1 -5  1   3  o 10 553.08  99.83  10962.51  3052.98  10962.51 3052.98  0.00      0.00     553.08  99.83  ?       ?      0.00    99.83  
1 1 1 -5  1   4  o 2  112.25  16.78  372.07    104.79   372.07   104.79   0.00      0.00     112.25  16.78  ?       ?      0.00    16.78  
1 1 1 -5  1   5  x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  1   6  o 5  290.24  30.03  2511.04   493.06   2639.01  697.34   2383.11   697.24   292.29  42.83  276.26  45.55  16.03   62.52  
1 1 1 -5  1   7  f 0  258.79  26.77  1990.06   391.91   2004.86  554.27   1975.26   554.22   255.06  39.10  252.98  39.45  2.07    55.54  
1 1 1 -5  1   8  o 15 146.08  14.92  624.13    123.38   621.50   174.53   626.76    174.43   144.30  21.74  144.95  21.62  -0.65   30.66  
1 1 1 -5  1   9  o 5  252.78  26.24  1905.55   375.17   1919.87  530.62   1891.23   530.53   248.65  38.41  246.60  38.75  2.06    54.56  
1 1 1 -5  1   10 o 6  96.88   10.00  273.48    54.80    262.53   77.53    284.41    77.47    94.06   14.85  98.12   14.16  -4.06   20.52  
1 1 1 -5  1   11 o 17 130.62  13.49  498.83    99.66    464.03   140.60   533.98    141.29   124.46  20.38  134.07  18.88  -9.61   27.78  
1 1 1 -5  1   12 o 9  208.92  21.43  1290.08   253.40   1368.47  358.57   1211.86   358.17   212.35  30.27  198.79  32.51  13.56   44.42  
1 1 1 -5  1   13 o 16 479.77  42.81  7112.38   1166.82  6874.14  1429.28  7588.40   2020.33  461.28  55.06  459.33  79.50  1.95    96.70  
1 1 1 -5  1   14 o 1  179.23  14.67  934.48    149.65   908.55   184.81   983.88    255.03   176.00  18.57  181.71  25.12  -5.71   31.24  
1 1 1 -5  1   15 o 1  264.27  26.42  2059.73   395.46   2059.73  395.46   0.00      0.00     264.27  26.42  ?       ?      0.00    26.42  
1 1 1 -5  1   16 o 5  400.79  43.12  4857.38   976.46   4857.38  976.46   0.00      0.00     400.79  43.12  ?       ?      0.00    43.12  
1 1 1 -5  1   17 o 6  555.88  62.17  9797.78   1949.88  9797.78  1949.88  0.00      0.00     555.88  62.17  ?       ?      0.00    62.17  
1 1 1 -5  1   18 o 15 291.40  31.43  2538.19   517.41   2538.19  517.41   0.00      0.00     291.40  31.43  ?       ?      0.00    31.43  
1 1 1 -5  1   19 f 0  128.27  15.57  483.43    112.29   483.43   112.29   0.00      0.00     128.27  15.57  ?       ?      0.00    15.57  
1 1 1 -5  1   20 o 4  283.43  44.99  2531.87   707.56   2531.87  707.56   0.00      0.00     283.43  44.99  ?       ?      0.00    44.99  
1 1 1 -5  1   21 o 11 347.36  57.24  3946.82   1101.67  3946.82  1101.67  0.00      0.00     347.36  57.24  ?       ?      0.00    57.24  
1 1 1 -5  1   22 o 9  282.49  34.69  2441.15   550.77   2718.85  746.17   2108.73   816.37   291.92  46.05  249.15  58.14  42.77   74.17  
1 1 1 -5  1   23 o 18 195.58  24.70  1154.46   271.11   1171.44  328.84   1118.41   479.06   194.68  30.42  182.76  45.77  11.92   54.95  
1 1 1 -5  1   24 o 16 63.50   10.19  119.52    35.89    119.52   35.89    0.00      0.00     63.50   10.19  ?       ?      0.00    10.19  
1 1 1 -5  1   25 o 12 88.96   15.54  238.56    76.46    238.53   77.58    239.68    451.27   88.89   15.78  107.37  44.56  -18.48  47.28  
1 1 1 -5  1   26 o 1  180.05  15.46  963.25    158.23   1028.52  167.57   426.06    480.75   185.94  15.85  117.57  47.03  68.37   49.63  
1 1 1 -5  1   27 f 0  97.66   18.17  294.58    98.10    294.58   98.10    0.00      0.00     97.66   18.17  ?       ?      0.00    18.17  
1 1 1 -5  1   28 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  1   29 o 7  61.97   18.09  120.32    68.34    116.49   69.01    314.13    491.25   61.10   18.27  101.96  44.50  -40.86  48.10  
1 1 1 -5  1   30 o 8  45.04   16.89  50.05     59.03    53.24    59.34    -249.04   574.71   45.76   16.98  82.44   39.86  -36.69  43.33  
1 1 1 -5  2   1  o 19 197.46  20.15  1140.96   225.23   1145.28  318.59   1136.64   318.46   195.82  29.24  195.03  29.35  0.78    41.43  
1 1 1 -5  2   2  o 18 421.97  44.59  5403.44   1063.78  5470.99  1504.45  5335.90   1504.38  412.26  65.78  406.38  66.81  5.88    93.75  
1 1 1 -5  2   3  o 1  273.37  41.89  2283.56   636.53   2283.56  636.53   0.00      0.00     273.37  41.89  ?       ?      0.00    41.89  
1 1 1 -5  2   4  x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  2   5  o 15 268.45  41.42  2216.76   617.82   2216.76  617.82   0.00      0.00     268.45  41.42  ?       ?      0.00    41.42  
1 1 1 -5  2   6  o 1  400.23  42.84  4926.60   968.98   5010.70  1370.38  4842.50   1370.30  389.07  63.55  381.30  64.93  7.77    90.85  
1 1 1 -5  2   7  o 18 226.56  23.36  1517.79   299.50   1494.27  423.60   1541.30   423.52   221.10  34.50  224.86  33.86  -3.76   48.34  
1 1 1 -5  2   8  o 4  364.18  39.12  4083.22   805.06   4026.15  1138.54  4140.29   1138.51  347.40  59.21  353.20  58.17  -5.80   83.01  
1 1 1 -5  2   9  o 8  206.55  21.25  1260.95   248.42   1268.60  351.36   1253.30   351.28   203.99  30.98  202.66  31.19  1.34    43.96  
1 1 1 -5  2   10 o 1  410.10  75.93  6182.73   1721.83  0.00     0.00     6182.73   1721.83  ?       ?      410.10  75.93  0.00    75.93  
1 1 1 -5  2   11 o 6  300.02  31.79  2730.71   539.24   2693.24  762.63   2768.18   762.57   288.78  47.66  293.37  46.85  -4.59   66.84  
1 1 1 -5  2   12 o 9  224.64  23.42  1498.11   297.56   1436.84  420.93   1559.31   420.70   215.60  35.22  225.51  33.52  -9.90   48.62  
1 1 1 -5  2   13 o 3  214.89  22.31  1364.88   271.21   1311.68  383.72   1417.97   383.37   207.01  33.43  215.98  31.88  -8.97   46.19  
1 1 1 -5  2   14 o 7  123.29  10.64  441.16    74.60    434.63   93.38    452.67    124.03   121.95  13.57  123.68  18.00  -1.73   22.54  
1 1 1 -5  2   15 o 2  116.76  12.86  397.73    84.77    397.73   84.77    0.00      0.00     116.76  12.86  ?       ?      0.00    12.86  
1 1 1 -5  2   16 o 18 109.59  16.74  354.87    101.99   354.87   101.99   0.00      0.00     109.59  16.74  ?       ?      0.00    16.74  
1 1 1 -5  2   17 o 2  197.54  20.59  1144.10   230.13   1144.10  230.13   0.00      0.00     197.54  20.59  ?       ?      0.00    20.59  
1 1 1 -5  2   18 o 5  249.97  26.10  1851.38   369.02   1851.38  369.02   0.00      0.00     249.97  26.10  ?       ?      0.00    26.10  
1 1 1 -5  2   19 o 16 307.64  33.24  2863.83   577.78   2863.83  577.78   0.00      0.00     307.64  33.24  ?       ?      0.00    33.24  
1 1 1 -5  2   20 o 15 361.45  37.91  4004.87   774.88   4004.87  774.88   0.00      0.00     361.45  37.91  ?       ?      0.00    37.91  
1 1 1 -5  2   21 o 6  225.40  25.63  1513.06   325.78   1513.06  325.78   0.00      0.00     225.40  25.63  ?       ?      0.00    25.63  
1 1 1 -5  2   22 o 16 30.25   12.14  12.35     32.15    20.14    32.34    -645.31   297.05   32.33   12.41  53.37   26.38  -21.04  29.16  
1 1 1 -5  2   23 o 15 143.52  13.54  603.17    110.24   653.39   117.04   208.17    328.23   149.37  13.80  98.81   39.08  50.57   41.44  
1 1 1 -5  2   24 o 10 112.75  10.48  371.22    67.05    386.17   68.33    -15.66    347.69   115.02  10.46  84.36   37.11  30.66   38.55  
1 1 1 -5  2   25 o 5  35.79   13.40  28.32     37.14    28.32    37.14    0.00      0.00     35.79   13.40  ?       ?      0.00    13.40  
1 1 1 -5  2   26 o 9  49.03   13.86  72.54     40.73    72.08    40.95    114.69    393.33   48.90   13.92  93.23   40.25  -44.33  42.59  
1 1 1 -5  2   27 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  2   28 o 19 91.80   16.07  259.21    81.60    254.22   83.19    385.90    419.32   90.70   16.59  106.59  43.46  -15.88  46.52  
1 1 1 -5  2   29 f 0  91.53   18.93  266.33    96.17    264.72   98.31    302.03    463.11   91.04   19.40  99.57   43.33  -8.53   47.48  
1 1 1 -5  2   30 o 6  89.03   19.71  257.82    98.06    257.82   98.06    0.00      0.00     89.03   19.71  ?       ?      0.00    19.71  
1 1 1 -5  3   1  o 1  504.16  54.82  7933.01   1561.02  8127.79  2207.66  7738.25   2207.57  488.16  81.66  473.75  84.26  14.41   117.34 
1 1 1 -5  3   2  o 1  149.50  15.29  652.20    129.37   647.69   183.09   656.69    182.84   147.65  22.29  148.74  22.08  -1.09   31.38  
1 1 1 -5  3   3  f 0  368.53  59.50  4364.14   1215.86  4364.14  1215.86  0.00      0.00     368.53  59.50  ?       ?      0.00    59.50  
1 1 1 -5  3   4  x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  3   5  o 2  125.67  18.91  468.64    132.18   468.64   132.18   0.00      0.00     125.67  18.91  ?       ?      0.00    18.91  
1 1 1 -5  3   6  o 6  411.96  71.62  5860.26   1632.28  5860.26  1632.28  0.00      0.00     411.96  71.62  ?       ?      0.00    71.62  
1 1 1 -5  3   7  o 3  199.54  20.45  1173.47   230.90   1229.59  326.71   1117.47   326.36   201.75  29.04  191.61  30.71  10.14   42.27  
1 1 1 -5  3   8  o 13 495.48  57.04  8094.12   1592.74  8205.74  2252.50  7982.51   2252.44  460.67  88.39  452.06  89.96  8.61    126.12 
1 1 1 -5  3   9  o 15 112.37  11.47  368.39    72.99    383.70   103.48   353.23    102.96   113.81  16.30  108.96  17.02  4.85    23.57  
1 1 1 -5  3   10 o 7  208.35  32.10  1332.29   371.63   0.00     0.00     1332.29   371.63   ?       ?      208.35  32.10  0.00    32.10  
1 1 1 -5  3   11 o 7  199.93  20.74  1182.47   234.58   1134.04  331.73   1230.91   331.75   192.29  31.11  201.06  29.63  -8.77   42.96  
1 1 1 -5  3   12 o 2  508.02  59.85  8632.45   1711.93  8304.82  2421.06  8960.06   2421.02  450.94  96.44  475.67  91.99  -24.73  133.28 
1 1 1 -5  3   13 o 3  271.36  42.60  2304.11   641.82   0.00     0.00     2304.11   641.82   ?       ?      271.36  42.60  0.00    42.60  
1 1 1 -5  3   14 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  3   15 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  3   16 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  3   17 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  3   18 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  3   19 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  3   20 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  3   21 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  3   22 o 16 92.39   10.48  249.44    54.61    249.44   54.61    0.00      0.00     92.39   10.48  ?       ?      0.00    10.48  
1 1 1 -5  3   23 o 4  176.20  17.56  917.98    175.23   917.98   175.23   0.00      0.00     176.20  17.56  ?       ?      0.00    17.56  
1 1 1 -5  3   24 o 16 108.16  17.49  352.58    104.87   352.58   104.87   0.00      0.00     108.16  17.49  ?       ?      0.00    17.49  
1 1 1 -5  3   25 o 7  81.48   9.42   194.79    43.24    194.80   43.63    194.17    326.80   81.46   9.51   94.65   38.45  -13.18  39.61  
1 1 1 -5  3   26 o 1  69.84   10.24  144.78    39.85    138.25   40.09    678.31    362.48   68.13   10.59  136.10  42.11  -67.96  43.42  
1 1 1 -5  3   27 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  3   28 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  3   29 o 16 78.98   36.81  -66.10    408.16   0.00     0.00     -66.10    408.16   ?       ?      78.98   36.81  0.00    36.81  
1 1 1 -5  3   30 o 4  90.63   40.97  231.47    455.51   0.00     0.00     231.47    455.51   ?       ?      90.63   40.97  0.00    40.97  
1 1 1 -5  4   1  f 0  159.18  23.94  755.76    212.00   0.00     0.00     755.76    212.00   ?       ?      159.18  23.94  0.00    23.94  
1 1 1 -5  4   2  o 16 181.22  18.63  962.87    191.09   873.72   270.30   1051.94   270.18   170.07  28.71  187.81  25.74  -17.74  38.55  
1 1 1 -5  4   3  x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  4   4  o 9  459.72  84.15  7679.64   2139.01  7679.64  2139.01  0.00      0.00     459.72  84.15  ?       ?      0.00    84.15  
1 1 1 -5  4   5  o 18 418.36  73.84  6134.31   1708.69  6134.31  1708.69  0.00      0.00     418.36  73.84  ?       ?      0.00    73.84  
1 1 1 -5  4   6  o 8  330.70  54.38  3576.29   996.43   3576.29  996.43   0.00      0.00     330.70  54.38  ?       ?      0.00    54.38  
1 1 1 -5  4   7  o 15 323.88  34.39  3195.45   629.69   3177.46  890.55   3213.44   890.47   312.46  51.44  314.51  51.07  -2.05   72.48  
1 1 1 -5  4   8  o 18 298.93  31.47  2707.70   531.86   2973.45  752.26   2442.07   752.08   306.08  44.08  273.44  49.74  32.64   66.46  
1 1 1 -5  4   9  o 19 123.58  12.70  446.33    88.85    408.58   125.91   483.78    125.40   116.77  19.47  127.74  17.57  -10.97  26.22  
1 1 1 -5  4   10 o 5  262.32  27.52  2067.46   408.26   1988.08  577.36   2146.85   577.38   250.32  41.64  261.37  39.73  -11.06  57.55  
1 1 1 -5  4   11 o 18 298.35  48.56  2882.60   803.05   0.00     0.00     2882.60   803.05   ?       ?      298.35  48.56  0.00    48.56  
1 1 1 -5  4   12 o 5  452.96  50.67  6585.60   1295.06  6757.98  1831.51  6413.21   1831.49  431.79  76.70  417.40  79.33  14.39   110.35 
1 1 1 -5  4   13 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  4   14 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  4   15 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  4   16 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  4   17 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  4   18 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  4   19 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  4   20 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  4   21 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  4   22 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  4   23 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  4   24 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  4   25 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  4   26 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  4   27 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  4   28 o 17 27.27   11.07  9.50      27.07    9.50     27.07    0.00      0.00     27.27   11.07  ?       ?      0.00    11.07  
1 1 1 -5  4   29 o 2  62.79   20.32  124.06    83.58    96.28    85.71    662.92    377.50   57.59   20.54  121.49  43.14  -63.89  47.78  
1 1 1 -5  4   30 o 5  87.95   19.90  255.42    98.13    253.61   100.91   286.93    420.75   87.32   20.49  90.71   40.31  -3.39   45.22  
1 1 1 -5  5   1  o 14 392.83  67.14  5239.36   1459.80  0.00     0.00     5239.36   1459.80  ?       ?      392.83  67.14  0.00    67.14  
1 1 1 -5  5   2  x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  5   3  x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  5   4  o 5  132.90  13.73  516.21    103.22   507.23   146.04   525.16    145.90   130.39  20.16  132.83  19.73  -2.43   28.21  
1 1 1 -5  5   5  o 8  359.65  38.65  3986.77   785.46   4001.22  1110.86  3972.33   1110.76  346.45  57.90  344.97  58.16  1.48    82.06  
1 1 1 -5  5   6  o 1  275.44  43.94  2408.39   671.46   2408.39  671.46   0.00      0.00     275.44  43.94  ?       ?      0.00    43.94  
1 1 1 -5  5   7  o 19 126.38  19.17  476.41    134.73   476.41   134.73   0.00      0.00     126.38  19.17  ?       ?      0.00    19.17  
1 1 1 -5  5   8  o 19 445.92  50.62  6467.93   1272.97  6618.31  1800.30  6317.56   1800.22  420.82  77.37  408.00  79.72  12.82   111.09 
1 1 1 -5  5   9  o 13 208.18  21.51  1284.78   253.37   1367.82  358.46   1201.86   358.19   211.71  30.36  197.27  32.78  14.45   44.68  
1 1 1 -5  5   10 o 17 473.51  54.57  7396.35   1456.33  7625.12  2059.62  7167.60   2059.52  445.13  83.67  426.67  87.04  18.46   120.73 
1 1 1 -5  5   11 o 2  567.06  69.29  11244.57  2208.93  11909.09 3123.97  10580.11  3123.84  523.43  107.56 478.11  115.19 45.32   157.60 
1 1 1 -5  5   12 f 0  393.73  68.19  5333.21   1485.57  5333.21  1485.57  0.00      0.00     393.73  68.19  ?       ?      0.00    68.19  
1 1 1 -5  5   13 o 6  101.77  15.45  306.24    87.41    0.00     0.00     306.24    87.41    ?       ?      101.77  15.45  0.00    15.45  
1 1 1 -5  5   14 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  5   15 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  5   16 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  5   17 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  5   18 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  5   19 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  5   20 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  5   21 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  5   22 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  5   23 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  5   24 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  5   25 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  5   26 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  5   27 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  5   28 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  5   29 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  5   30 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  6   1  o 17 338.05  36.03  3492.06   688.45   3481.46  973.64   3502.66   973.58   326.03  53.90  327.18  53.70  -1.16   76.08  
1 1 1 -5  6   2  x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  6   3  o 8  148.92  22.62  664.63    187.29   0.00     0.00     664.63    187.29   ?       ?      148.92  22.62  0.00    22.62  
1 1 1 -5  6   4  o 1  349.99  59.70  4150.13   1156.55  0.00     0.00     4150.13   1156.55  ?       ?      349.99  59.70  0.00    59.70  
1 1 1 -5  6   5  o 12 277.97  29.24  2329.89   459.58   2364.09  650.02   2295.70   649.87   272.86  42.91  268.36  43.69  4.50    61.24  
1 1 1 -5  6   6  o 10 192.72  19.92  1097.21   217.23   1144.59  307.41   1049.94   307.02   194.15  28.42  185.28  29.88  8.87    41.24  
1 1 1 -5  6   7  o 4  288.74  46.93  2694.18   751.19   2694.18  751.19   0.00      0.00     288.74  46.93  ?       ?      0.00    46.93  
1 1 1 -5  6   8  o 8  159.48  24.32  766.53    215.64   766.53   215.64   0.00      0.00     159.48  24.32  ?       ?      0.00    24.32  
1 1 1 -5  6   9  o 8  235.03  36.80  1717.33   480.18   1717.33  480.18   0.00      0.00     235.03  36.80  ?       ?      0.00    36.80  
1 1 1 -5  6   10 o 4  218.30  22.47  1411.65   277.61   1555.86  393.07   1268.13   392.13   226.27  31.08  202.40  35.02  23.87   46.82  
1 1 1 -5  6   11 o 14 98.62   16.63  289.69    90.81    289.69   90.81    0.00      0.00     98.62   16.63  ?       ?      0.00    16.63  
1 1 1 -5  6   12 o 7  242.41  25.06  1739.77   343.77   1743.93  487.11   1735.65   485.21   238.70  36.72  238.14  36.67  0.56    51.89  
1 1 1 -5  6   13 o 1  539.55  60.21  9318.16   1833.31  9348.65  2593.13  9287.69   2592.26  507.78  92.36  505.69  92.71  2.09    130.87 
1 1 1 -5  6   14 o 15 153.82  14.97  689.62    130.49   437.27   233.41   804.35    157.38   119.76  32.93  165.94  16.75  -46.19  36.95  
1 1 1 -5  6   15 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  6   16 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  6   17 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  6   18 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  6   19 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  6   20 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  6   21 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  6   22 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  6   23 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  6   24 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  6   25 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  6   26 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  6   27 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  6   28 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  6   29 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  6   30 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  7   1  o 5  37.32   13.38  34.10     36.39    34.10    36.39    0.00      0.00     37.32   13.38  ?       ?      0.00    13.38  
1 1 1 -5  7   2  o 1  206.57  31.86  1306.43   365.69   0.00     0.00     1306.43   365.69   ?       ?      206.57  31.86  0.00    31.86  
1 1 1 -5  7   3  o 14 175.74  18.18  909.18    180.77   911.13   255.93   907.24    255.35   173.58  26.53  173.20  26.53  0.38    37.51  
1 1 1 -5  7   4  o 14 275.00  28.91  2277.42   449.51   2277.89  635.87   2276.95   635.55   267.94  42.78  267.89  42.76  0.05    60.49  
1 1 1 -5  7   5  o 8  239.73  37.63  1793.13   500.77   0.00     0.00     1793.13   500.77   ?       ?      239.73  37.63  0.00    37.63  
1 1 1 -5  7   6  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  7   7  o 11 202.59  21.02  1213.73   240.96   1090.50  340.97   1336.68   340.57   188.03  32.78  210.07  29.01  -22.04  43.78  
1 1 1 -5  7   8  o 8  432.41  48.02  5954.50   1171.90  6077.80  1657.41  5831.22   1657.22  412.75  72.60  402.02  74.55  10.73   104.06 
1 1 1 -5  7   9  o 10 236.78  36.89  1731.05   485.10   1731.05  485.10   0.00      0.00     236.78  36.89  ?       ?      0.00    36.89  
1 1 1 -5  7   10 o 11 325.80  52.79  3416.43   953.63   3416.43  953.63   0.00      0.00     325.80  52.79  ?       ?      0.00    52.79  
1 1 1 -5  7   11 o 13 421.31  72.14  6034.39   1682.09  6034.39  1682.09  0.00      0.00     421.31  72.14  ?       ?      0.00    72.14  
1 1 1 -5  7   12 o 17 622.32  141.32 17711.24  4933.05  17711.24 4933.05  0.00      0.00     622.32  141.32 ?       ?      0.00    141.32 
1 1 1 -5  7   13 o 13 187.16  19.78  1027.18   209.33   991.94   300.85   1060.26   291.46   181.47  29.92  188.32  27.79  -6.85   40.84  
1 1 1 -5  7   14 o 3  349.98  35.42  3674.08   701.82   3844.73  995.76   3505.62   989.33   350.42  51.00  332.95  53.58  17.46   73.97  
1 1 1 -5  7   15 o 3  618.28  72.54  12923.46  2525.70  0.00     0.00     12923.46  2525.70  ?       ?      618.28  72.54  0.00    72.54  
1 1 1 -5  7   16 o 4  233.89  24.05  1622.40   318.38   0.00     0.00     1622.40   318.38   ?       ?      233.89  24.05  0.00    24.05  
1 1 1 -5  7   17 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  7   18 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  7   19 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  7   20 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  7   21 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  7   22 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  7   23 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  7   24 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  7   25 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  7   26 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  7   27 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  7   28 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  7   29 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  8   1  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  8   2  o 9  209.61  21.73  1298.69   257.69   1321.21  364.97   1276.29   363.88   208.26  31.51  204.42  32.06  3.84    44.95  
1 1 1 -5  8   3  o 1  348.54  37.27  3722.74   734.13   3726.43  1038.39  3719.05   1038.05  336.37  55.72  336.00  55.77  0.37    78.84  
1 1 1 -5  8   4  o 19 344.74  36.85  3637.08   717.98   3390.52  1015.45  3883.56   1015.29  319.32  57.51  345.72  52.83  -26.41  78.09  
1 1 1 -5  8   5  x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  8   6  o 7  245.84  25.65  1797.60   356.69   1669.12  504.67   1925.86   504.22   231.49  39.39  250.48  36.11  -18.99  53.43  
1 1 1 -5  8   7  o 10 120.56  18.74  432.30    125.48   0.00     0.00     432.30    125.48   ?       ?      120.56  18.74  0.00    18.74  
1 1 1 -5  8   8  o 16 352.44  57.78  4048.80   1128.62  0.00     0.00     4048.80   1128.62  ?       ?      352.44  57.78  0.00    57.78  
1 1 1 -5  8   9  o 14 316.17  50.33  3157.09   882.85   3157.09  882.85   0.00      0.00     316.17  50.33  ?       ?      0.00    50.33  
1 1 1 -5  8   10 o 1  320.37  31.28  3056.03   567.99   3786.70  805.12   2332.06   801.42   352.92  40.47  270.15  53.57  82.77   67.14  
1 1 1 -5  8   11 o 3  527.42  57.91  8800.88   1724.55  8957.69  2439.95  8644.34   2437.81  504.48  87.42  493.42  89.35  11.06   125.00 
1 1 1 -5  8   12 o 3  294.48  46.23  2687.09   755.76   2687.09  755.76   0.00      0.00     294.48  46.23  ?       ?      0.00    46.23  
1 1 1 -5  8   13 o 18 370.52  60.52  4437.90   1242.78  4437.90  1242.78  0.00      0.00     370.52  60.52  ?       ?      0.00    60.52  
1 1 1 -5  8   14 o 3  277.08  20.81  2248.05   328.63   2582.46  581.34   2090.99   398.40   291.94  35.41  265.53  26.49  26.41   44.22  
1 1 1 -5  8   15 o 2  93.66   10.24  255.88    54.19    363.79   190.82   246.42    56.51    108.80  29.72  91.79   10.94  17.01   31.67  
1 1 1 -5  8   16 o 1  122.14  12.14  435.42    83.99    0.00     0.00     435.42    83.99    ?       ?      122.14  12.14  0.00    12.14  
1 1 1 -5  8   17 o 8  313.55  32.80  3000.93   581.71   0.00     0.00     3000.93   581.71   ?       ?      313.55  32.80  0.00    32.80  
1 1 1 -5  8   18 o 4  61.12   9.79   110.39    33.19    0.00     0.00     110.39    33.19    ?       ?      61.12   9.79   0.00    9.79   
1 1 1 -5  8   19 o 3  205.97  32.09  1306.60   367.03   0.00     0.00     1306.60   367.03   ?       ?      205.97  32.09  0.00    32.09  
1 1 1 -5  8   20 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  8   21 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  8   22 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  8   23 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  8   24 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  8   25 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  8   26 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  8   27 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  8   28 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  8   29 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  9   1  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  9   2  o 18 318.63  50.68  3209.01   896.01   0.00     0.00     3209.01   896.01   ?       ?      318.63  50.68  0.00    50.68  
1 1 1 -5  9   3  o 9  358.10  58.28  4148.76   1157.00  0.00     0.00     4148.76   1157.00  ?       ?      358.10  58.28  0.00    58.28  
1 1 1 -5  9   4  o 15 295.20  30.81  2601.32   514.37   2577.73  727.77   2624.88   727.09   287.55  45.61  290.48  45.06  -2.93   64.11  
1 1 1 -5  9   5  o 9  504.51  56.17  8079.09   1599.30  7780.19  2261.87  8377.93   2261.65  465.09  87.94  487.38  83.86  -22.29  121.51 
1 1 1 -5  9   6  o 16 525.25  59.32  8813.51   1757.32  8174.10  2485.33  9452.83   2485.14  470.56  95.28  516.44  86.91  -45.88  128.96 
1 1 1 -5  9   7  o 15 441.59  47.41  6005.32   1183.15  6017.63  1673.59  5993.03   1672.87  425.21  71.07  424.20  71.22  1.00    100.61 
1 1 1 -5  9   8  o 3  773.54  95.39  21537.95  4146.11  23510.38 5863.99  19566.18  5862.99  717.08  147.38 618.17  162.94 98.91   219.71 
1 1 1 -5  9   9  o 12 513.62  55.61  8267.92   1613.43  8557.28  2282.63  7979.02   2280.85  499.15  82.54  478.18  86.26  20.97   119.39 
1 1 1 -5  9   10 o 3  223.19  34.07  1504.89   422.65   0.00     0.00     1504.89   422.65   ?       ?      223.19  34.07  0.00    34.07  
1 1 1 -5  9   11 o 17 509.51  92.78  9381.67   2613.67  0.00     0.00     9381.67   2613.67  ?       ?      509.51  92.78  0.00    92.78  
1 1 1 -5  9   12 o 9  163.01  25.09  794.84    227.31   0.00     0.00     794.84    227.31   ?       ?      163.01  25.09  0.00    25.09  
1 1 1 -5  9   13 o 9  220.23  17.70  1417.49   221.93   1565.44  404.92   1353.97   265.33   227.22  31.92  214.19  21.89  13.03   38.70  
1 1 1 -5  9   14 o 19 302.67  25.88  2725.90   445.29   2568.69  787.41   2799.82   539.91   280.43  50.78  304.31  31.35  -23.88  59.68  
1 1 1 -5  9   15 o 5  147.78  28.42  671.64    232.37   -190.65  382.69   1175.26   292.46   81.31   37.07  197.36  26.48  -116.04 45.56  
1 1 1 -5  9   16 o 12 135.24  17.32  541.10    131.37   743.94   274.00   480.55    149.70   154.57  31.94  126.33  21.41  28.24   38.45  
1 1 1 -5  9   17 o 18 99.65   11.95  291.04    66.98    0.00     0.00     291.04    66.98    ?       ?      99.65   11.95  0.00    11.95  
1 1 1 -5  9   18 o 14 122.81  13.00  441.44    90.27    0.00     0.00     441.44    90.27    ?       ?      122.81  13.00  0.00    13.00  
1 1 1 -5  9   19 o 18 207.99  22.17  1294.34   260.63   0.00     0.00     1294.34   260.63   ?       ?      207.99  22.17  0.00    22.17  
1 1 1 -5  9   20 o 17 130.53  14.45  503.44    106.48   0.00     0.00     503.44    106.48   ?       ?      130.53  14.45  0.00    14.45  
1 1 1 -5  9   21 o 11 83.84   11.29  207.99    52.94    0.00     0.00     207.99    52.94    ?       ?      83.84   11.29  0.00    11.29  
1 1 1 -5  9   22 o 4  71.09   15.67  154.97    62.21    0.00     0.00     154.97    62.21    ?       ?      71.09   15.67  0.00    15.67  
1 1 1 -5  9   23 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  9   24 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  9   25 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  9   26 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  9   27 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  9   28 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  10  1  o 6  159.38  16.92  742.04    152.43   749.66   216.55   734.54    214.61   158.73  24.56  157.07  24.61  1.65    34.77  
1 1 1 -5  10  2  o 10 173.57  26.81  898.88    258.57   898.88   258.57   0.00      0.00     173.57  26.81  ?       ?      0.00    26.81  
1 1 1 -5  10  3  o 16 343.33  54.06  3688.41   1030.22  3688.41  1030.22  0.00      0.00     343.33  54.06  ?       ?      0.00    54.06  
1 1 1 -5  10  4  f 0  199.85  30.59  1197.42   339.75   0.00     0.00     1197.42   339.75   ?       ?      199.85  30.59  0.00    30.59  
1 1 1 -5  10  5  o 1  346.43  36.85  3595.28   721.62   3308.41  1020.89  3881.73   1020.14  323.06  57.14  353.28  51.84  -30.22  77.15  
1 1 1 -5  10  6  o 11 209.08  22.57  1284.93   266.56   1063.03  378.61   1503.04   375.36   186.35  36.70  224.51  29.86  -38.16  47.31  
1 1 1 -5  10  7  o 10 339.77  34.52  3447.18   664.01   3816.34  941.15   3081.30   936.96   351.73  47.85  312.46  54.20  39.28   72.30  
1 1 1 -5  10  8  o 15 209.40  22.81  1290.64   269.80   1126.88  387.36   1444.93   376.00   191.83  36.51  219.65  30.65  -27.82  47.67  
1 1 1 -5  10  9  o 7  126.99  16.16  473.72    115.16   598.57   191.33   402.79    144.22   141.26  24.48  115.70  22.52  25.56   33.26  
1 1 1 -5  10  10 o 8  489.98  55.51  7645.40   1533.97  7280.22  2171.69  8009.03   2167.04  447.40  87.69  475.62  82.35  -28.22  120.30 
1 1 1 -5  10  11 o 12 228.72  22.92  1545.69   296.85   1851.06  433.34   1275.69   407.48   247.71  31.16  203.19  36.26  44.53   47.81  
1 1 1 -5  10  12 o 4  332.30  55.28  3646.04   1017.51  0.00     0.00     3646.04   1017.51  ?       ?      332.30  55.28  0.00    55.28  
1 1 1 -5  10  13 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  10  14 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  10  15 o 13 63.88   13.83  122.71    49.24    -438.44  352.33   133.89    49.73    67.44   32.25  66.84   13.43  0.60    34.93  
1 1 1 -5  10  16 o 9  286.71  34.60  2526.70   558.01   0.00     0.00     2526.70   558.01   ?       ?      286.71  34.60  0.00    34.60  
1 1 1 -5  10  17 o 6  372.75  41.32  4396.88   869.41   0.00     0.00     4396.88   869.41   ?       ?      372.75  41.32  0.00    41.32  
1 1 1 -5  10  18 o 16 43.77   15.68  47.75     50.00    0.00     0.00     47.75     50.00    ?       ?      43.77   15.68  0.00    15.68  
1 1 1 -5  10  19 o 19 89.74   16.52  243.70    81.95    0.00     0.00     243.70    81.95    ?       ?      89.74   16.52  0.00    16.52  
1 1 1 -5  10  20 o 4  267.73  49.78  2636.84   736.97   0.00     0.00     2636.84   736.97   ?       ?      267.73  49.78  0.00    49.78  
1 1 1 -5  10  21 o 19 97.96   13.13  286.08    71.97    0.00     0.00     286.08    71.97    ?       ?      97.96   13.13  0.00    13.13  
1 1 1 -5  10  22 o 14 48.09   15.45  67.61     48.38    0.00     0.00     67.61     48.38    ?       ?      48.09   15.45  0.00    15.45  
1 1 1 -5  10  23 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  10  24 o 13 137.08  23.81  617.78    180.59   0.00     0.00     617.78    180.59   ?       ?      137.08  23.81  0.00    23.81  
1 1 1 -5  10  25 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  10  26 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  10  27 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  10  28 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  11  1  x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  11  2  o 8  158.80  17.92  738.64    160.50   858.68   239.47   640.76    216.25   169.84  25.34  145.92  26.80  23.92   36.88  
1 1 1 -5  11  3  o 12 235.65  25.63  1638.82   341.12   1320.46  481.96   1958.40   482.89   206.46  42.09  255.48  33.75  -49.02  53.95  
1 1 1 -5  11  4  f 0  480.41  83.62  7969.52   2222.46  7969.52  2222.46  0.00      0.00     480.41  83.62  ?       ?      0.00    83.62  
1 1 1 -5  11  5  o 14 388.25  63.68  4902.54   1370.19  4902.54  1370.19  0.00      0.00     388.25  63.68  ?       ?      0.00    63.68  
1 1 1 -5  11  6  x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  11  7  o 14 286.24  30.86  2451.81   499.07   2303.53  710.78   2596.01   700.91   270.10  47.58  289.09  43.59  -18.99  64.53  
1 1 1 -5  11  8  o 5  432.47  48.21  5877.78   1176.53  5648.55  1667.96  6104.77   1659.80  400.65  75.28  420.81  71.25  -20.15  103.65 
1 1 1 -5  11  9  o 2  159.79  18.61  752.77    167.48   953.55   271.46   629.36    212.82   177.67  27.50  143.87  26.75  33.80   38.37  
1 1 1 -5  11  10 o 12 137.52  22.24  567.91    169.58   0.00     0.00     567.91    169.58   ?       ?      137.52  22.24  0.00    22.24  
1 1 1 -5  11  11 o 4  100.73  17.68  303.85    98.50    322.54   237.19   299.96    108.27   104.45  34.26  99.66   19.62  4.79    39.49  
1 1 1 -5  11  12 o 11 223.19  24.36  1486.54   307.02   1965.55  493.02   1183.12   392.39   252.38  34.97  194.22  36.53  58.16   50.57  
1 1 1 -5  11  13 o 12 230.54  24.67  1585.24   321.37   0.00     0.00     1585.24   321.37   ?       ?      230.54  24.67  0.00    24.67  
1 1 1 -5  11  14 o 5  130.69  18.31  507.25    133.63   0.00     0.00     507.25    133.63   ?       ?      130.69  18.31  0.00    18.31  
1 1 1 -5  11  15 o 6  36.55   18.16  -355.06   147.20   0.00     0.00     -355.06   147.20   ?       ?      36.55   18.16  0.00    18.16  
1 1 1 -5  11  16 o 15 331.67  59.26  3885.09   1086.81  0.00     0.00     3885.09   1086.81  ?       ?      331.67  59.26  0.00    59.26  
1 1 1 -5  11  17 o 17 264.16  45.46  2358.09   664.49   0.00     0.00     2358.09   664.49   ?       ?      264.16  45.46  0.00    45.46  
1 1 1 -5  11  18 o 7  179.28  30.31  1024.05   300.87   0.00     0.00     1024.05   300.87   ?       ?      179.28  30.31  0.00    30.31  
1 1 1 -5  11  19 f 0  73.69   14.02  164.30    57.15    0.00     0.00     164.30    57.15    ?       ?      73.69   14.02  0.00    14.02  
1 1 1 -5  11  20 o 13 44.49   15.77  51.83     50.40    0.00     0.00     51.83     50.40    ?       ?      44.49   15.77  0.00    15.77  
1 1 1 -5  11  21 o 17 141.29  16.91  606.24    134.43   0.00     0.00     606.24    134.43   ?       ?      141.29  16.91  0.00    16.91  
1 1 1 -5  11  22 f 0  54.62   17.00  90.75     58.96    0.00     0.00     90.75     58.96    ?       ?      54.62   17.00  0.00    17.00  
1 1 1 -5  11  23 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  11  24 o 3  71.54   18.71  166.01    77.68    0.00     0.00     166.01    77.68    ?       ?      71.54   18.71  0.00    18.71  
1 1 1 -5  11  25 o 11 64.73   19.99  137.48    81.76    0.00     0.00     137.48    81.76    ?       ?      64.73   19.99  0.00    19.99  
1 1 1 -5  11  26 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  11  27 o 16 57.10   18.25  108.09    67.58    0.00     0.00     108.09    67.58    ?       ?      57.10   18.25  0.00    18.25  
1 1 1 -5  12  1  o 9  197.62  21.95  1153.29   244.83   1169.15  362.00   1139.92   332.39   195.57  33.45  193.89  30.90  1.68    45.53  
1 1 1 -5  12  2  o 8  54.83   20.91  61.46     91.34    0.00     0.00     61.46     91.34    ?       ?      54.83   20.91  0.00    20.91  
1 1 1 -5  12  3  o 7  266.36  42.21  2212.28   623.95   0.00     0.00     2212.28   623.95   ?       ?      266.36  42.21  0.00    42.21  
1 1 1 -5  12  4  o 17 201.68  31.96  1239.02   357.64   0.00     0.00     1239.02   357.64   ?       ?      201.68  31.96  0.00    31.96  
1 1 1 -5  12  5  o 12 120.83  18.18  433.66    122.20   96.48    211.08   603.65    149.88   77.77   31.15  142.86  18.73  -65.09  36.34  
1 1 1 -5  12  6  o 16 149.99  20.43  668.34    171.30   279.89   282.92   893.18    215.25   103.04  37.26  173.32  22.14  -70.29  43.34  
1 1 1 -5  12  7  o 12 153.77  35.92  742.80    311.35   742.80   311.35   0.00      0.00     153.77  35.92  ?       ?      0.00    35.92  
1 1 1 -5  12  8  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  12  9  o 15 280.51  49.02  2550.04   760.66   2550.04  760.66   0.00      0.00     280.51  49.02  ?       ?      0.00    49.02  
1 1 1 -5  12  10 o 19 169.68  28.88  877.87    271.21   0.00     0.00     877.87    271.21   ?       ?      169.68  28.88  0.00    28.88  
1 1 1 -5  12  11 o 11 85.59   38.66  -161.00   404.16   -161.00  404.16   0.00      0.00     85.59   38.66  ?       ?      0.00    38.66  
1 1 1 -5  12  12 o 12 599.41  37.29  11015.68  1276.96  17099.92 1837.96  5338.16   1775.46  738.93  43.52  368.58  85.56  370.35  95.99  
1 1 1 -5  12  13 o 13 189.82  26.74  1090.39   283.27   -1285.35 628.26   1696.62   317.36   77.19   38.20  238.73  23.46  -161.54 44.83  
1 1 1 -5  12  14 o 5  183.32  18.23  993.05    189.27   945.87   518.93   1000.29   203.28   166.71  50.15  183.59  19.59  -16.87  53.84  
1 1 1 -5  12  15 o 10 265.53  27.09  2151.82   407.16   1692.53  801.45   2311.60   472.70   209.68  62.15  273.07  30.68  -63.39  69.31  
1 1 1 -5  12  16 o 2  64.47   15.76  126.71    57.81    0.00     0.00     126.71    57.81    ?       ?      64.47   15.76  0.00    15.76  
1 1 1 -5  12  17 o 17 62.07   14.61  117.48    51.17    -348.58  336.45   128.52    51.77    66.45   31.70  65.00   14.27  1.45    34.76  
1 1 1 -5  12  18 o 4  78.18   14.79  185.58    63.93    0.00     0.00     185.58    63.93    ?       ?      78.18   14.79  0.00    14.79  
1 1 1 -5  12  19 o 5  151.49  18.09  697.65    154.21   0.00     0.00     697.65    154.21   ?       ?      151.49  18.09  0.00    18.09  
1 1 1 -5  12  20 o 5  68.38   25.60  126.47    135.48   0.00     0.00     126.47    135.48   ?       ?      68.38   25.60  0.00    25.60  
1 1 1 -5  12  21 o 13 118.46  29.25  488.08    197.67   0.00     0.00     488.08    197.67   ?       ?      118.46  29.25  0.00    29.25  
1 1 1 -5  12  22 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  12  23 o 15 48.84   17.05  68.68     58.75    0.00     0.00     68.68     58.75    ?       ?      48.84   17.05  0.00    17.05  
1 1 1 -5  12  24 o 12 52.03   19.50  74.03     78.71    0.00     0.00     74.03     78.71    ?       ?      52.03   19.50  0.00    19.50  
1 1 1 -5  12  25 o 10 42.29   17.72  23.98     72.35    0.00     0.00     23.98     72.35    ?       ?      42.29   17.72  0.00    17.72  
1 1 1 -5  12  26 o 4  92.88   19.96  297.18    103.28   0.00     0.00     297.18    103.28   ?       ?      92.88   19.96  0.00    19.96  
1 1 1 -5  13  1  o 14 323.50  35.98  3169.64   656.98   2836.04  940.48   3487.56   918.14   294.28  57.73  332.13  49.68  -37.85  76.16  
1 1 1 -5  13  2  o 7  233.64  26.51  1624.42   349.32   1547.24  516.61   1689.43   474.13   222.29  42.02  234.84  36.34  -12.55  55.56  
1 1 1 -5  13  3  o 18 101.13  22.22  310.09    125.50   61.22    263.72   382.94    142.69   81.81   34.02  112.50  22.87  -30.68  41.00  
1 1 1 -5  13  4  o 6  240.17  28.68  1727.90   387.60   1332.59  579.59   2047.71   521.33   202.49  50.13  258.80  36.07  -56.31  61.76  
1 1 1 -5  13  5  o 4  51.21   22.55  -32.86    128.63   0.00     0.00     -32.86    128.63   ?       ?      51.21   22.55  0.00    22.55  
1 1 1 -5  13  6  o 1  265.82  42.94  2216.58   632.96   0.00     0.00     2216.58   632.96   ?       ?      265.82  42.94  0.00    42.94  
1 1 1 -5  13  7  o 19 211.77  35.04  1381.09   411.07   0.00     0.00     1381.09   411.07   ?       ?      211.77  35.04  0.00    35.04  
1 1 1 -5  13  8  o 13 504.25  40.56  7843.63   1164.29  13463.99 1691.50  2783.33   1605.01  656.05  45.19  263.25  89.20  392.80  99.99  
1 1 1 -5  13  9  o 16 51.53   23.96  -145.63   171.07   -2358.10 426.84   277.74    186.72   ?       ?      96.55   30.28  0.00    30.28  
1 1 1 -5  13  10 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  13  11 o 5  219.48  26.48  1455.25   326.87   1570.80  569.66   1398.53   399.10   217.58  46.98  211.83  33.97  5.75    57.98  
1 1 1 -5  13  12 o 13 192.84  27.22  1137.81   292.98   841.14   535.46   1264.57   350.02   157.02  51.48  201.60  31.25  -44.58  60.22  
1 1 1 -5  13  13 o 1  227.08  21.24  1543.85   273.63   1630.94  609.10   1521.82   306.28   214.92  50.27  224.10  24.19  -9.17   55.79  
1 1 1 -5  13  14 o 19 205.83  28.33  1323.29   325.87   1172.38  609.28   1383.75   385.67   175.59  54.64  207.35  33.55  -31.75  64.11  
1 1 1 -5  13  15 o 10 125.33  16.97  471.93    118.97   230.05   506.03   486.08    122.40   109.04  46.33  127.14  17.21  -18.10  49.43  
1 1 1 -5  13  16 o 17 168.49  18.08  854.44    172.14   1125.49  496.18   817.35    183.54   172.20  48.27  163.96  19.91  8.24    52.21  
1 1 1 -5  13  17 o 4  82.28   15.12  206.09    68.80    344.41   440.13   202.63    69.65    108.85  44.47  81.48   15.46  27.37   47.08  
1 1 1 -5  13  18 o 8  82.17   17.46  210.05    79.82    0.00     0.00     210.05    79.82    ?       ?      82.17   17.46  0.00    17.46  
1 1 1 -5  13  19 o 17 168.16  19.93  881.32    188.66   0.00     0.00     881.32    188.66   ?       ?      168.16  19.93  0.00    19.93  
1 1 1 -5  13  20 o 10 50.27   16.50  74.98     54.99    0.00     0.00     74.98     54.99    ?       ?      50.27   16.50  0.00    16.50  
1 1 1 -5  13  21 o 8  91.85   30.22  303.94    184.43   0.00     0.00     303.94    184.43   ?       ?      91.85   30.22  0.00    30.22  
1 1 1 -5  13  22 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  13  23 o 17 56.57   19.26  100.33    74.81    0.00     0.00     100.33    74.81    ?       ?      56.57   19.26  0.00    19.26  
1 1 1 -5  13  24 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  13  25 o 11 76.80   32.49  241.62    246.88   0.00     0.00     241.62    246.88   ?       ?      76.80   32.49  0.00    32.49  
1 1 1 -5  14  1  o 4  205.26  24.67  1256.62   284.83   1385.25  445.51   1167.68   370.43   210.56  38.27  194.40  34.45  16.16   51.49  
1 1 1 -5  14  2  o 12 94.77   24.24  274.16    132.42   240.91   280.58   283.69    150.19   99.01   36.88  96.43   26.38  2.58    45.34  
1 1 1 -5  14  3  o 15 309.61  34.88  2927.60   609.15   2919.17  899.20   2934.75   828.12   296.92  54.77  301.24  49.61  -4.33   73.90  
1 1 1 -5  14  4  o 15 54.31   23.01  8.33      124.14   -56.28   378.09   16.13     131.42   87.78   38.65  56.62   23.81  31.16   45.40  
1 1 1 -5  14  5  o 7  54.88   22.92  20.57     120.44   -163.80  340.01   47.02     128.79   77.31   35.13  59.60   24.17  17.71   42.64  
1 1 1 -5  14  6  o 3  152.43  28.18  713.80    237.49   0.00     0.00     713.80    237.49   ?       ?      152.43  28.18  0.00    28.18  
1 1 1 -5  14  7  o 19 158.73  25.46  766.06    224.13   905.96   493.31   729.67    251.59   164.51  48.76  153.41  29.64  11.09   57.06  
1 1 1 -5  14  8  o 10 181.83  31.72  1031.82   319.10   0.00     0.00     1031.82   319.10   ?       ?      181.83  31.72  0.00    31.72  
1 1 1 -5  14  9  x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  14  10 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  14  11 o 6  359.50  34.32  4115.62   699.65   3738.60  1257.10  4284.82   842.14   291.78  74.73  358.83  41.66  -67.05  85.55  
1 1 1 -5  14  12 o 9  187.38  18.41  1049.64   195.49   1670.17  542.96   957.23    209.54   218.62  44.77  177.84  20.93  40.78   49.42  
1 1 1 -5  14  13 o 7  165.07  18.99  821.32    176.70   520.42   555.73   855.16    186.37   127.49  50.71  168.19  19.67  -40.70  54.39  
1 1 1 -5  14  14 f 0  92.38   18.37  262.82    93.97    482.19   546.15   256.12    95.39    122.92  49.79  91.02   18.88  31.90   53.25  
1 1 1 -5  14  15 o 9  63.75   19.80  123.39    80.03    0.00     0.00     123.39    80.03    ?       ?      63.75   19.80  0.00    19.80  
1 1 1 -5  14  16 o 13 54.82   18.85  85.15     71.71    240.47   507.05   81.98     72.44    103.56  45.20  54.25   18.93  49.31   49.00  
1 1 1 -5  14  17 o 11 101.81  19.01  325.32    107.00   0.00     0.00     325.32    107.00   ?       ?      101.81  19.01  0.00    19.01  
1 1 1 -5  14  18 o 16 63.86   17.04  128.43    63.65    0.00     0.00     128.43    63.65    ?       ?      63.86   17.04  0.00    17.04  
1 1 1 -5  14  19 o 15 60.45   17.38  115.38    63.55    0.00     0.00     115.38    63.55    ?       ?      60.45   17.38  0.00    17.38  
1 1 1 -5  14  20 o 15 108.49  17.61  372.53    105.93   0.00     0.00     372.53    105.93   ?       ?      108.49  17.61  0.00    17.61  
1 1 1 -5  14  21 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  14  22 o 6  40.02   17.01  13.95     68.19    0.00     0.00     13.95     68.19    ?       ?      40.02   17.01  0.00    17.01  
1 1 1 -5  14  23 o 19 39.50   17.48  -5.00     78.19    0.00     0.00     -5.00     78.19    ?       ?      39.50   17.48  0.00    17.48  
1 1 1 -5  15  1  o 9  250.95  50.34  2156.37   700.02   2156.37  700.02   0.00      0.00     250.95  50.34  ?       ?      0.00    50.34  
1 1 1 -5  15  2  o 8  191.26  47.64  1252.05   521.06   1252.05  521.06   0.00      0.00     191.26  47.64  ?       ?      0.00    47.64  
1 1 1 -5  15  3  o 12 195.28  26.61  1166.22   290.52   1206.37  513.24   1147.28   352.41   187.32  47.63  190.44  33.46  -3.12   58.21  
1 1 1 -5  15  4  o 14 300.79  36.36  2873.68   615.15   2697.46  917.29   3017.71   829.27   269.39  60.77  295.86  50.65  -26.47  79.10  
1 1 1 -5  15  5  o 6  195.00  26.81  1168.38   292.23   1322.48  525.80   1099.51   351.52   195.40  47.37  185.37  34.30  10.03   58.48  
1 1 1 -5  15  6  o 9  150.06  28.55  706.91    236.95   0.00     0.00     706.91    236.95   ?       ?      150.06  28.55  0.00    28.55  
1 1 1 -5  15  7  o 13 70.41   26.91  112.69    151.60   0.00     0.00     112.69    151.60   ?       ?      70.41   26.91  0.00    26.91  
1 1 1 -5  15  8  o 1  120.17  29.43  462.77    201.37   0.00     0.00     462.77    201.37   ?       ?      120.17  29.43  0.00    29.43  
1 1 1 -5  15  9  o 1  186.66  26.23  1082.41   273.30   904.90   520.91   1149.83   321.04   156.40  50.74  190.10  30.45  -33.70  59.18  
1 1 1 -5  15  10 o 1  86.73   14.93  226.75    71.64    -350.67  433.97   242.93    72.64    77.54   36.70  89.93   14.57  -12.39  39.49  
1 1 1 -5  15  11 o 10 188.11  20.82  1077.28   221.09   0.00     0.00     1077.28   221.09   ?       ?      188.11  20.82  0.00    20.82  
1 1 1 -5  15  12 o 19 132.07  31.14  581.34    232.24   0.00     0.00     581.34    232.24   ?       ?      132.07  31.14  0.00    31.14  
1 1 1 -5  15  13 o 5  151.59  34.54  795.13    293.83   0.00     0.00     795.13    293.83   ?       ?      151.59  34.54  0.00    34.54  
1 1 1 -5  15  14 o 16 146.76  34.62  760.57    286.89   658.54   678.09   782.82    316.63   126.51  53.69  146.53  37.49  -20.02  65.49  
1 1 1 -5  15  15 o 4  80.50   32.76  159.37    237.71   0.00     0.00     159.37    237.71   ?       ?      80.50   32.76  0.00    32.76  
1 1 1 -5  15  16 o 8  52.76   18.21  79.98     66.96    445.95   602.15   75.39     67.38    109.84  48.55  51.84   18.24  57.99   51.86  
1 1 1 -5  15  17 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  15  18 f 0  102.43  20.08  340.71    113.85   0.00     0.00     340.71    113.85   ?       ?      102.43  20.08  0.00    20.08  
1 1 1 -5  15  19 o 11 83.19   19.17  227.03    89.65    0.00     0.00     227.03    89.65    ?       ?      83.19   19.17  0.00    19.17  
1 1 1 -5  15  20 o 6  104.60  21.50  370.98    124.82   0.00     0.00     370.98    124.82   ?       ?      104.60  21.50  0.00    21.50  
1 1 1 -5  15  21 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  15  22 f 0  68.84   19.66  164.20    81.53    0.00     0.00     164.20    81.53    ?       ?      68.84   19.66  0.00    19.66  
1 1 1 -5  16  1  o 9  210.20  28.32  1378.10   333.05   1397.32  568.29   1368.05   411.04   195.97  50.27  204.43  36.36  -8.46   62.04  
1 1 1 -5  16  2  o 1  295.96  36.16  2841.02   601.63   2855.29  904.64   2829.71   805.61   271.64  59.65  279.24  52.17  -7.60   79.25  
1 1 1 -5  16  3  f 0  196.83  53.61  1465.79   621.97   1465.79  621.97   0.00      0.00     196.83  53.61  ?       ?      0.00    53.61  
1 1 1 -5  16  4  o 2  122.63  48.31  450.95    500.02   450.95   500.02   0.00      0.00     122.63  48.31  ?       ?      0.00    48.31  
1 1 1 -5  16  5  o 16 109.13  46.73  210.15    521.61   210.15   521.61   0.00      0.00     109.13  46.73  ?       ?      0.00    46.73  
1 1 1 -5  16  6  o 11 155.41  27.80  768.23    238.89   550.57   581.90   812.35    261.98   129.58  51.77  158.80  29.83  -29.22  59.75  
1 1 1 -5  16  7  o 7  172.55  29.52  959.00    281.93   1085.51  641.81   928.75    313.83   161.97  56.35  166.97  33.90  -5.00   65.76  
1 1 1 -5  16  8  o 12 169.56  24.75  901.94    233.78   823.42   525.53   921.31    261.03   144.73  50.95  169.62  27.77  -24.90  58.02  
1 1 1 -5  16  9  o 5  162.06  18.05  795.16    165.06   1321.42  543.26   741.63    173.25   181.65  50.35  155.62  19.84  26.03   54.12  
1 1 1 -5  16  10 o 13 164.73  18.49  826.56    171.87   1310.62  564.29   777.06    180.44   176.19  52.13  158.78  20.26  17.41   55.93  
1 1 1 -5  16  11 o 6  94.26   16.80  273.46    87.56    184.93   688.76   274.92    88.28    108.33  49.52  94.48   16.90  13.85   52.33  
1 1 1 -5  16  12 o 11 171.48  20.66  916.92    199.27   0.00     0.00     916.92    199.27   ?       ?      171.48  20.66  0.00    20.66  
1 1 1 -5  16  13 o 16 79.11   18.23  197.81    81.08    180.34   815.59   197.98    81.48    107.68  50.77  79.12   18.30  28.56   53.97  
1 1 1 -5  16  14 o 3  133.98  20.12  567.87    149.95   0.00     0.00     567.87    149.95   ?       ?      133.98  20.12  0.00    20.12  
1 1 1 -5  16  15 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  16  16 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  16  17 o 18 133.63  43.42  859.90    381.29   0.00     0.00     859.90    381.29   ?       ?      133.63  43.42  0.00    43.42  
1 1 1 -5  16  18 o 3  105.33  40.67  551.62    348.68   0.00     0.00     551.62    348.68   ?       ?      105.33  40.67  0.00    40.67  
1 1 1 -5  16  19 o 17 107.84  21.41  399.09    127.87   0.00     0.00     399.09    127.87   ?       ?      107.84  21.41  0.00    21.41  
1 1 1 -5  16  20 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  17  1  o 1  123.86  29.81  504.93    209.40   0.00     0.00     504.93    209.40   ?       ?      123.86  29.81  0.00    29.81  
1 1 1 -5  17  2  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  17  3  o 7  64.70   26.05  77.26     148.47   0.00     0.00     77.26     148.47   ?       ?      64.70   26.05  0.00    26.05  
1 1 1 -5  17  4  o 2  68.92   26.98  107.20    155.10   431.75   583.19   82.50     160.89   118.87  50.09  66.85   27.04  52.02   56.92  
1 1 1 -5  17  5  o 16 66.20   27.54  61.83     172.88   40.07    637.70   63.56     179.61   103.79  47.52  67.27   28.03  36.52   55.18  
1 1 1 -5  17  6  x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  17  7  o 2  273.85  37.02  2627.24   567.07   2701.12  914.18   2581.03   722.98   231.08  65.77  250.84  51.92  -19.76  83.79  
1 1 1 -5  17  8  o 4  201.91  27.72  1332.74   312.85   1732.10  682.57   1226.53   352.00   191.62  57.49  188.26  33.81  3.36    66.70  
1 1 1 -5  17  9  o 6  85.61   17.27  228.30    81.92    0.00     0.00     228.30    81.92    ?       ?      85.61   17.27  0.00    17.27  
1 1 1 -5  17  10 o 4  113.18  16.99  394.79    106.98   0.00     0.00     394.79    106.98   ?       ?      113.18  16.99  0.00    16.99  
1 1 1 -5  17  11 o 18 45.08   17.51  43.28     64.89    -577.25  873.37   46.73     65.07    92.48   45.63  45.76   17.60  46.72   48.91  
1 1 1 -5  17  12 o 2  52.89   18.75  78.90     71.26    591.92   875.79   75.48     71.50    114.23  53.46  52.24   18.75  61.99   56.66  
1 1 1 -5  17  13 o 3  213.47  27.20  1554.15   325.74   0.00     0.00     1554.15   325.74   ?       ?      213.47  27.20  0.00    27.20  
1 1 1 -5  17  14 o 16 86.35   18.29  240.28    87.84    687.91   841.99   235.35    88.32    109.05  51.47  85.32   18.56  23.73   54.71  
1 1 1 -5  17  15 o 3  67.06   18.87  147.54    75.71    0.00     0.00     147.54    75.71    ?       ?      67.06   18.87  0.00    18.87  
1 1 1 -5  17  16 o 14 96.43   20.42  312.26    109.49   812.11   871.24   304.24    110.36   101.71  49.16  94.87   20.84  6.84    53.39  
1 1 1 -5  17  17 o 9  101.13  40.59  550.06    359.33   0.00     0.00     550.06    359.33   ?       ?      101.13  40.59  0.00    40.59  
1 1 1 -5  18  1  o 2  83.26   29.09  215.76    171.08   682.74   601.40   174.64    178.45   128.92  52.24  78.54   29.38  50.38   59.94  
1 1 1 -5  18  2  o 16 97.68   30.10  321.10    185.46   0.00     0.00     321.10    185.46   ?       ?      97.68   30.10  0.00    30.10  
1 1 1 -5  18  3  o 13 60.85   25.56  44.91     151.15   -587.04  748.81   71.75     154.33   90.55   44.17  64.09   26.28  26.45   51.40  
1 1 1 -5  18  4  o 13 92.41   31.13  285.29    195.51   0.00     0.00     285.29    195.51   ?       ?      92.41   31.13  0.00    31.13  
1 1 1 -5  18  5  o 17 131.99  34.09  624.93    260.08   0.00     0.00     624.93    260.08   ?       ?      131.99  34.09  0.00    34.09  
1 1 1 -5  18  6  x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -5  18  7  o 19 61.68   16.28  119.07    58.50    0.00     0.00     119.07    58.50    ?       ?      61.68   16.28  0.00    16.28  
1 1 1 -5  18  8  o 4  115.92  16.93  416.03    109.36   -33.80   701.65   427.22    110.71   95.92   45.76  117.51  16.90  -21.59  48.78  
1 1 1 -5  18  9  o 6  85.04   16.02  225.73    75.35    -41.26   717.14   228.71    75.77    94.59   45.43  85.62   16.00  8.98    48.17  
1 1 1 -5  18  10 o 4  99.43   21.21  324.37    117.36   1273.06  987.10   310.77    118.20   125.84  58.17  96.97   21.77  28.87   62.11  
1 1 1 -5  18  11 f 0  37.17   16.58  -18.46    71.87    0.00     0.00     -18.46    71.87    ?       ?      37.17   16.58  0.00    16.58  
1 1 1 -5  18  12 o 18 71.49   20.30  169.73    87.19    -30.04   1142.77  170.90    87.45    95.50   47.92  71.72   20.32  23.78   52.05  
1 1 1 -5  18  13 o 5  45.73   17.55  51.14     64.62    -129.47  1018.70  51.87     64.75    90.19   45.25  45.89   17.58  44.30   48.54  
1 1 1 -5  18  14 o 9  74.80   19.75  188.42    86.07    1006.52  1055.41  182.94    86.36    102.13  50.35  73.63   19.94  28.50   54.15  
1 1 1 -5  19  1  o 4  74.29   28.53  155.11    170.97   -404.12  705.95   189.95    176.22   88.77   43.21  78.78   29.25  9.99    52.18  
1 1 1 -5  19  2  o 3  65.20   26.95  79.62     164.19   0.00     0.00     79.62     164.19   ?       ?      65.20   26.95  0.00    26.95  
1 1 1 -5  19  3  o 11 63.86   27.29  50.35     177.41   925.48   890.02   14.14     181.04   124.95  56.80  61.29   26.87  63.67   62.84  
1 1 1 -5  19  4  o 15 120.76  56.54  872.67    980.45   872.67   980.45   0.00      0.00     120.76  56.54  ?       ?      0.00    56.54  
1 1 1 -5  19  5  o 9  68.84   15.81  149.14    61.18    123.69   789.48   149.29    61.36    99.87   47.89  68.87   15.85  31.00   50.44  
1 1 1 -5  19  6  o 10 54.85   16.46  93.73     55.94    429.48   767.99   91.94     56.09    105.68  49.66  54.40   16.51  51.29   52.33  
1 1 1 -5  19  7  o 11 56.06   16.37  98.79     55.95    0.00     0.00     98.79     55.95    ?       ?      56.06   16.37  0.00    16.37  
1 1 1 -5  19  8  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  -19 1  f 0  122.77  25.23  485.52    171.85   485.52   171.85   0.00      0.00     122.77  25.23  ?       ?      0.00    25.23  
1 1 1 -4  -19 2  o 15 81.87   14.94  204.05    67.63    210.94   115.89   200.50    83.27    81.47   23.49  80.19   18.47  1.28    29.88  
1 1 1 -4  -18 1  o 10 139.39  24.83  610.01    191.41   610.01   191.41   0.00      0.00     139.39  24.83  ?       ?      0.00    24.83  
1 1 1 -4  -18 2  o 19 63.92   22.29  113.68    100.41   113.68   100.41   0.00      0.00     63.92   22.29  ?       ?      0.00    22.29  
1 1 1 -4  -18 3  o 9  127.31  25.17  512.30    177.44   512.30   177.44   0.00      0.00     127.31  25.17  ?       ?      0.00    25.17  
1 1 1 -4  -18 4  o 1  147.68  26.61  692.10    217.33   692.10   217.33   0.00      0.00     147.68  26.61  ?       ?      0.00    26.61  
1 1 1 -4  -18 5  o 18 234.62  42.48  1937.67   551.04   1937.67  551.04   0.00      0.00     234.62  42.48  ?       ?      0.00    42.48  
1 1 1 -4  -18 6  o 1  91.56   23.28  265.53    122.60   265.53   122.60   0.00      0.00     91.56   23.28  ?       ?      0.00    23.28  
1 1 1 -4  -18 7  o 1  79.90   22.81  200.08    109.78   193.20   110.21   1077.40   1244.96  78.64   22.98  154.44  68.95  -75.81  72.67  
1 1 1 -4  -17 1  o 1  204.74  22.47  1269.54   259.80   1075.08  353.38   1498.29   383.26   181.61  35.17  217.43  31.63  -35.82  47.30  
1 1 1 -4  -17 2  o 8  30.17   11.29  19.84     26.38    264.07   97.92    0.73      27.39    92.88   19.01  25.43   10.79  67.44   21.86  
1 1 1 -4  -17 3  o 8  53.26   19.01  73.15     73.40    18.76    114.55   111.05    95.62    52.93   22.24  63.28   21.76  -10.35  31.12  
1 1 1 -4  -17 4  o 6  206.53  21.55  1287.01   251.71   1233.38  342.65   1349.88   370.99   197.04  31.34  205.57  32.52  -8.53   45.16  
1 1 1 -4  -17 5  o 1  227.22  25.17  1582.40   322.86   1498.54  459.74   1664.00   453.52   212.01  39.22  225.89  36.19  -13.88  53.37  
1 1 1 -4  -17 6  o 7  123.72  15.31  455.24    106.40   408.19   157.46   494.78    144.35   114.09  24.75  127.45  20.42  -13.36  32.09  
1 1 1 -4  -17 7  o 11 188.23  28.77  1115.79   301.03   1194.47  312.57   108.71    1118.26  194.84  28.81  134.10  61.96  60.73   68.33  
1 1 1 -4  -17 8  o 19 115.40  23.52  415.86    150.51   409.03   151.98   762.45    1082.71  114.28  23.93  150.87  65.94  -36.58  70.15  
1 1 1 -4  -17 9  o 10 126.39  23.09  496.70    161.36   526.92   162.95   -1032.49  1159.07  130.47  22.57  111.15  54.38  19.32   58.88  
1 1 1 -4  -17 10 o 5  96.20   22.67  290.77    123.10   290.57   123.74   310.42    1216.23  96.14   22.77  137.87  64.02  -41.73  67.95  
1 1 1 -4  -17 11 o 10 129.04  24.40  522.95    174.12   522.95   174.12   0.00      0.00     129.04  24.40  ?       ?      0.00    24.40  
1 1 1 -4  -16 1  o 2  350.34  22.56  3650.60   451.30   3650.60  451.30   0.00      0.00     350.34  22.56  ?       ?      0.00    22.56  
1 1 1 -4  -16 2  o 11 151.88  16.40  681.05    140.76   801.96   207.32   577.66    191.71   163.03  22.77  137.12  25.29  25.91   34.03  
1 1 1 -4  -16 3  o 18 134.98  15.65  538.20    119.00   529.21   170.77   546.68    165.92   131.62  23.46  134.18  22.32  -2.56   32.39  
1 1 1 -4  -16 4  o 12 235.26  25.35  1675.31   336.94   1650.41  478.80   1699.74   474.25   226.46  38.19  230.56  37.09  -4.10   53.23  
1 1 1 -4  -16 5  o 14 66.13   16.03  132.83    60.22    122.06   95.69    139.90    77.48    65.53   21.77  67.96   19.08  -2.43   28.95  
1 1 1 -4  -16 6  o 16 137.47  15.49  558.70    120.12   595.28   173.15   524.77    166.77   139.89  22.31  130.94  23.03  8.96    32.06  
1 1 1 -4  -16 7  o 16 164.07  24.90  824.89    227.16   842.50   235.09   576.73    882.34   165.58  25.55  146.39  61.64  19.19   66.73  
1 1 1 -4  -16 8  o 7  272.17  47.53  2543.29   715.56   2543.29  715.56   0.00      0.00     272.17  47.53  ?       ?      0.00    47.53  
1 1 1 -4  -16 9  o 9  101.81  22.27  320.73    126.53   319.93   127.66   364.79    952.20   101.63  22.48  139.15  61.30  -37.52  65.29  
1 1 1 -4  -16 10 o 3  193.52  25.67  1152.17   278.12   1199.93  287.33   443.27    1106.98  197.38  25.99  145.55  64.99  51.83   70.00  
1 1 1 -4  -16 11 o 4  108.84  22.18  366.78    133.90   355.27   134.84   1181.89   1135.00  106.93  22.67  169.09  70.47  -62.15  74.02  
1 1 1 -4  -16 12 o 11 214.06  33.15  1480.18   394.23   1432.23  413.18   1967.13   1316.76  208.67  35.78  193.06  77.63  15.61   85.48  
1 1 1 -4  -16 13 o 8  115.58  21.74  413.63    138.93   413.63   138.93   0.00      0.00     115.58  21.74  ?       ?      0.00    21.74  
1 1 1 -4  -15 1  o 16 17.65   6.65   6.49      9.17     0.00     0.00     6.49      9.17     ?       ?      17.65   6.65   0.00    6.65   
1 1 1 -4  -15 2  o 12 333.27  20.73  3266.06   394.62   7902.34  716.10   1244.18   472.90   516.90  24.20  196.32  43.14  320.58  49.47  
1 1 1 -4  -15 3  o 5  311.01  43.38  3075.10   753.41   2316.26  1158.16  3631.83   992.01   245.93  75.12  329.95  54.26  -84.01  92.67  
1 1 1 -4  -15 4  o 9  462.14  43.01  6742.16   1128.03  8390.31  1658.83  5324.46   1538.49  496.69  59.35  379.97  73.19  116.71  94.23  
1 1 1 -4  -15 5  o 1  175.07  17.83  903.03    176.72   965.58   243.40   833.29    257.00   179.21  24.28  164.99  28.14  14.22   37.17  
1 1 1 -4  -15 6  o 5  147.26  15.38  637.03    128.06   834.58   182.28   444.46    179.97   167.79  19.27  119.90  26.82  47.89   33.03  
1 1 1 -4  -15 7  f 0  216.34  19.61  1383.76   240.87   1487.00  336.76   1275.63   344.65   221.54  27.04  203.55  30.43  17.98   40.70  
1 1 1 -4  -15 8  o 3  362.60  30.46  4014.93   628.18   4067.04  731.67   3868.81   1225.17  360.93  35.78  320.00  68.74  40.93   77.50  
1 1 1 -4  -15 9  o 1  289.79  27.46  2551.45   451.42   2427.60  500.61   3090.36   1044.28  280.11  31.69  286.58  64.98  -6.47   72.29  
1 1 1 -4  -15 10 f 0  129.69  22.91  513.96    164.30   471.10   167.10   1763.50   902.26   123.57  24.42  211.08  66.61  -87.51  70.94  
1 1 1 -4  -15 11 o 8  66.29   21.70  126.66    95.17    115.56   95.66    1209.08   944.42   64.29   21.78  177.26  67.31  -112.97 70.75  
1 1 1 -4  -15 12 o 16 161.10  22.65  788.29    203.66   780.43   206.99   1026.95   1140.41  160.07  23.20  168.51  70.46  -8.44   74.18  
1 1 1 -4  -15 13 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  -15 14 o 9  124.23  21.05  472.00    144.78   472.00   144.78   0.00      0.00     124.23  21.05  ?       ?      0.00    21.05  
1 1 1 -4  -15 15 f 0  284.19  26.31  2495.40   424.30   2235.48  442.87   5401.90   1480.96  266.54  29.43  341.67  77.32  -75.13  82.73  
1 1 1 -4  -15 16 o 2  181.24  27.62  1035.32   278.29   1035.32  278.29   0.00      0.00     181.24  27.62  ?       ?      0.00    27.62  
1 1 1 -4  -14 1  o 13 514.68  52.05  8264.77   1516.74  11748.09 2146.74  4792.78   2143.25  603.82  62.85  351.62  100.91 252.20  118.88 
1 1 1 -4  -14 2  o 10 416.25  35.81  5197.03   847.34   5048.41  1055.96  5465.76   1419.93  404.50  46.31  410.24  62.24  -5.74   77.58  
1 1 1 -4  -14 3  o 8  197.51  21.14  1148.09   235.92   971.63   318.98   1361.21   350.55   178.53  32.31  212.99  29.46  -34.46  43.72  
1 1 1 -4  -14 4  o 6  447.70  40.25  6114.88   1023.47  5760.89  1267.00  6779.63   1736.23  425.52  53.01  446.97  69.96  -21.45  87.78  
1 1 1 -4  -14 5  f 0  483.36  40.86  7168.17   1123.20  7288.78  1387.29  6938.67   1913.66  478.86  51.26  440.45  78.57  38.41   93.81  
1 1 1 -4  -14 6  o 3  92.47   20.62  259.22    106.64   1159.77  585.55   228.33    108.45   187.49  52.39  86.68   21.81  100.80  56.75  
1 1 1 -4  -14 7  o 12 97.96   18.75  288.71    101.63   120.79   564.61   294.33    103.31   115.20  48.95  98.90   18.88  16.29   52.46  
1 1 1 -4  -14 8  o 12 280.03  30.52  2371.96   482.76   2924.60  816.63   2075.07   598.55   300.22  49.08  255.94  42.21  44.28   64.73  
1 1 1 -4  -14 9  o 1  134.43  51.48  479.13    555.40   479.13   555.40   0.00      0.00     134.43  51.48  ?       ?      0.00    51.48  
1 1 1 -4  -14 10 o 4  233.52  26.20  1641.05   345.12   1641.05  345.12   0.00      0.00     233.52  26.20  ?       ?      0.00    26.20  
1 1 1 -4  -14 11 o 11 188.30  25.59  1074.19   269.47   1190.67  282.87   -68.88    886.11   198.47  25.41  127.22  57.37  71.24   62.74  
1 1 1 -4  -14 12 o 6  103.85  20.17  327.94    115.89   327.94   115.89   0.00      0.00     103.85  20.17  ?       ?      0.00    20.17  
1 1 1 -4  -14 13 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  -14 14 o 8  87.73   18.92  235.10    92.49    239.09   92.85    -290.82   1066.08  88.49   18.85  127.12  59.33  -38.63  62.25  
1 1 1 -4  -14 15 o 9  108.88  20.33  361.98    122.38   349.24   123.21   1298.09   1056.14  106.75  20.85  178.37  70.23  -71.62  73.26  
1 1 1 -4  -14 16 o 14 52.29   18.35  72.39     68.14    72.52    68.24    26.11     1256.50  52.33   18.36  138.57  64.59  -86.24  67.15  
1 1 1 -4  -14 17 o 16 84.34   19.36  219.66    91.77    214.09   92.02    1265.20   1261.38  83.21   19.59  168.70  72.46  -85.49  75.06  
1 1 1 -4  -14 18 o 1  139.96  21.30  600.30    165.72   600.68   167.08   576.93    1297.75  139.93  21.49  147.13  67.53  -7.20   70.86  
1 1 1 -4  -13 1  o 17 249.02  38.91  1896.35   538.05   1896.35  538.05   0.00      0.00     249.02  38.91  ?       ?      0.00    38.91  
1 1 1 -4  -13 2  o 10 244.30  38.04  1818.18   516.16   1818.18  516.16   0.00      0.00     244.30  38.04  ?       ?      0.00    38.04  
1 1 1 -4  -13 3  o 3  290.80  45.49  2608.84   734.59   2608.84  734.59   0.00      0.00     290.80  45.49  ?       ?      0.00    45.49  
1 1 1 -4  -13 4  o 9  489.31  84.88  8235.85   2297.93  8235.85  2297.93  0.00      0.00     489.31  84.88  ?       ?      0.00    84.88  
1 1 1 -4  -13 5  o 6  222.47  35.09  1496.46   433.31   1496.46  433.31   0.00      0.00     222.47  35.09  ?       ?      0.00    35.09  
1 1 1 -4  -13 6  o 12 524.66  94.77  9860.62   2749.21  9860.62  2749.21  0.00      0.00     524.66  94.77  ?       ?      0.00    94.77  
1 1 1 -4  -13 7  o 12 687.33  58.39  14962.34  2281.97  15464.31 3225.50  14459.32  3228.89  663.66  86.74  636.02  91.03  27.64   125.73 
1 1 1 -4  -13 8  o 17 286.19  24.98  2416.17   406.30   2570.86  570.57   2257.04   578.71   291.73  34.75  271.74  38.15  20.00   51.60  
1 1 1 -4  -13 9  o 16 106.37  20.57  340.71    121.07   350.63   123.17   57.33     658.33   107.93  20.63  120.63  52.08  -12.69  56.02  
1 1 1 -4  -13 10 o 13 101.15  20.51  309.20    115.02   309.20   115.02   0.00      0.00     101.15  20.51  ?       ?      0.00    20.51  
1 1 1 -4  -13 11 o 7  507.10  63.35  8779.72   1803.98  9071.32  2518.40  8472.41   2585.35  469.80  96.61  442.05  103.68 27.75   141.71 
1 1 1 -4  -13 12 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  -13 13 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  -13 14 o 18 296.98  60.50  3167.81   996.30   3167.81  996.30   0.00      0.00     296.98  60.50  ?       ?      0.00    60.50  
1 1 1 -4  -13 15 o 10 182.91  23.00  1009.04   236.13   924.55   243.22   2395.04   985.08   174.20  25.04  247.21  67.52  -73.01  72.01  
1 1 1 -4  -13 16 o 18 64.12   18.85  123.38    74.00    123.75   74.21    57.89     989.90   64.21   18.88  132.95  60.23  -68.74  63.12  
1 1 1 -4  -13 17 o 5  319.93  28.27  3149.24   513.80   2904.42  560.92   4425.57   1280.74  303.81  32.67  330.54  69.69  -26.74  76.97  
1 1 1 -4  -13 18 f 0  174.94  22.12  929.77    217.17   921.16   222.18   1114.62   1029.25  173.81  22.82  166.65  68.04  7.17    71.76  
1 1 1 -4  -13 19 f 0  163.37  22.72  819.02    207.31   815.31   210.09   956.45    1279.65  162.81  23.13  158.11  70.29  4.69    73.99  
1 1 1 -4  -13 20 o 12 50.55   20.00  45.80     86.04    41.83    86.21    1016.76   1348.11  49.98   19.94  157.97  71.04  -107.99 73.78  
1 1 1 -4  -12 1  o 18 194.73  19.54  1109.60   215.48   924.44   274.52   1406.74   347.76   175.64  28.18  217.41  28.55  -41.77  40.12  
1 1 1 -4  -12 2  o 4  220.06  22.92  1423.60   285.32   1384.82  404.26   1462.09   402.76   214.04  34.04  220.42  32.83  -6.38   47.29  
1 1 1 -4  -12 3  o 8  354.36  31.83  3730.80   640.70   3528.26  790.38   4118.95   1094.15  340.68  41.25  361.50  54.41  -20.83  68.28  
1 1 1 -4  -12 4  o 19 527.29  47.23  8530.15   1414.65  8101.18  1736.93  9375.33   2438.08  502.95  61.43  519.00  84.75  -16.05  104.68 
1 1 1 -4  -12 5  o 4  314.55  28.42  2925.14   507.62   2671.97  635.45   3371.61   843.86   297.07  38.14  330.77  45.66  -33.71  59.49  
1 1 1 -4  -12 6  o 14 239.91  21.93  1686.20   298.63   1756.46  389.05   1585.42   465.94   243.28  28.39  228.44  36.78  14.84   46.46  
1 1 1 -4  -12 7  o 17 688.22  51.95  14555.15  2037.21  14581.78 2881.00  14528.52  2881.10  663.78  77.04  662.36  77.22  1.42    109.07 
1 1 1 -4  -12 8  o 12 321.52  50.53  3207.87   901.99   3207.87  901.99   0.00      0.00     321.52  50.53  ?       ?      0.00    50.53  
1 1 1 -4  -12 9  o 16 120.02  16.71  424.15    112.00   516.32   113.33   -3426.46  732.56   132.90  15.12  ?       ?      0.00    15.12  
1 1 1 -4  -12 10 o 14 214.04  33.52  1385.75   398.42   1385.75  398.42   0.00      0.00     214.04  33.52  ?       ?      0.00    33.52  
1 1 1 -4  -12 11 o 6  304.22  37.87  2819.72   647.17   2915.97  811.74   2651.81   1072.12  304.35  48.05  278.56  67.71  25.79   83.03  
1 1 1 -4  -12 12 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  -12 13 o 16 151.45  21.99  685.25    185.60   685.25   185.60   0.00      0.00     151.45  21.99  ?       ?      0.00    21.99  
1 1 1 -4  -12 14 o 3  113.26  19.52  385.02    122.34   379.92   123.89   585.09    776.45   112.39  19.93  150.86  59.96  -38.47  63.19  
1 1 1 -4  -12 15 o 9  140.10  20.26  587.10    158.19   586.72   160.96   597.88    856.73   139.95  20.66  152.78  62.19  -12.84  65.53  
1 1 1 -4  -12 16 o 3  253.57  52.14  2210.71   733.67   2210.71  733.67   0.00      0.00     253.57  52.14  ?       ?      0.00    52.14  
1 1 1 -4  -12 17 o 3  109.25  42.40  300.05    380.31   300.05   380.31   0.00      0.00     109.25  42.40  ?       ?      0.00    42.40  
1 1 1 -4  -12 18 o 6  145.04  44.98  715.07    413.25   715.07   413.25   0.00      0.00     145.04  44.98  ?       ?      0.00    44.98  
1 1 1 -4  -12 19 f 0  186.43  22.66  1054.40   237.50   1034.61  243.35   1451.59   1090.22  184.27  23.54  183.18  71.59  1.09    75.36  
1 1 1 -4  -12 20 o 16 98.24   20.48  297.97    111.74   298.55   112.30   240.32    1119.23  98.32   20.56  137.14  62.86  -38.82  66.13  
1 1 1 -4  -12 21 o 9  51.31   19.66  56.43     81.03    56.43    81.03    0.00      0.00     51.31   19.66  ?       ?      0.00    19.66  
1 1 1 -4  -11 1  o 3  626.25  52.72  11917.81  1877.65  12121.53 2300.98  11511.78  3248.42  622.61  65.35  574.92  102.17 47.69   121.28 
1 1 1 -4  -11 2  o 3  702.28  60.75  15224.56  2425.18  15340.01 2971.37  14994.17  4197.33  691.61  76.10  639.37  118.73 52.24   141.02 
1 1 1 -4  -11 3  o 12 370.17  38.53  4083.82   806.86   4014.68  1141.28  4152.92   1140.87  359.32  57.25  366.12  56.06  -6.80   80.13  
1 1 1 -4  -11 4  o 10 515.33  43.93  7966.71   1287.27  7811.98  1579.15  8273.17   2222.39  503.93  55.51  502.00  79.78  1.93    97.19  
1 1 1 -4  -11 5  o 6  179.14  18.75  938.09    190.00   937.05   268.90   939.12    268.49   177.29  27.30  177.50  27.22  -0.22   38.55  
1 1 1 -4  -11 6  o 19 193.60  16.79  1091.05   184.80   1243.58  240.94   873.08    288.01   206.10  20.64  170.07  30.63  36.03   36.93  
1 1 1 -4  -11 7  o 5  817.50  60.50  21080.14  2819.01  21333.81 3986.47  20826.41  3986.89  781.13  90.58  769.54  92.07  11.59   129.16 
1 1 1 -4  -11 8  o 2  354.64  31.68  3733.32   638.20   3534.94  789.23   4108.12   1084.80  341.22  41.12  361.57  53.91  -20.35  67.80  
1 1 1 -4  -11 9  o 2  612.88  45.39  11395.77  1585.80  12737.15 2756.58  10732.27  1938.73  615.58  79.89  584.44  58.57  31.15   99.06  
1 1 1 -4  -11 10 o 9  370.77  41.11  4146.19   860.38   4146.19  860.38   0.00      0.00     370.77  41.11  ?       ?      0.00    41.11  
1 1 1 -4  -11 11 o 8  491.22  23.59  7032.32   663.22   7032.32  663.22   0.00      0.00     491.22  23.59  ?       ?      0.00    23.59  
1 1 1 -4  -11 12 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  -11 13 o 19 577.93  48.41  10363.41  1591.36  7406.51  2193.32  13650.25  2312.46  451.75  87.74  647.63  62.99  -195.88 108.01 
1 1 1 -4  -11 14 f 0  248.75  39.07  1917.60   539.51   1917.60  539.51   0.00      0.00     248.75  39.07  ?       ?      0.00    39.07  
1 1 1 -4  -11 15 o 6  93.16   17.88  260.82    92.15    267.10   92.87    -142.05   743.43   94.32   17.80  118.15  52.97  -23.83  55.88  
1 1 1 -4  -11 16 o 12 51.67   18.03  69.70     65.73    63.62    66.03    747.76    697.13   50.44   18.03  156.75  58.19  -106.31 60.91  
1 1 1 -4  -11 17 o 7  95.03   18.50  272.93    97.31    269.79   98.27    429.64    694.55   94.41   18.79  136.90  55.89  -42.49  58.96  
1 1 1 -4  -11 18 o 15 182.86  21.56  1001.98   222.02   963.29   229.40   1573.80   881.99   178.79  22.87  201.76  66.07  -22.98  69.91  
1 1 1 -4  -11 19 o 10 61.90   20.65  108.17    86.08    112.24   86.49    -318.09   885.29   62.73   20.70  116.82  54.37  -54.08  58.18  
1 1 1 -4  -11 20 o 10 147.06  43.26  740.17    389.59   740.17   389.59   0.00      0.00     147.06  43.26  ?       ?      0.00    43.26  
1 1 1 -4  -11 21 o 3  198.69  45.12  1384.50   502.85   1384.50  502.85   0.00      0.00     198.69  45.12  ?       ?      0.00    45.12  
1 1 1 -4  -11 22 o 17 112.00  39.99  403.91    324.82   403.91   324.82   0.00      0.00     112.00  39.99  ?       ?      0.00    39.99  
1 1 1 -4  -10 1  o 1  341.90  30.07  3447.99   584.25   4286.13  835.82   2647.11   817.02   378.22  39.06  291.93  50.58  86.29   63.91  
1 1 1 -4  -10 2  o 7  108.48  15.54  346.24    94.01    436.11   203.95   322.00    105.94   119.85  29.78  104.04  18.41  15.81   35.01  
1 1 1 -4  -10 3  o 11 696.74  78.58  15722.33  3088.24  16895.77 4367.55  14549.02  4367.31  680.72  115.92 616.81  127.55 63.91   172.35 
1 1 1 -4  -10 4  o 3  317.68  27.72  2958.59   500.43   2890.32  615.74   3091.44   858.90   312.05  34.97  318.27  48.54  -6.22   59.83  
1 1 1 -4  -10 5  o 8  387.76  40.19  4481.21   881.60   4650.36  1246.92  4312.14   1246.63  387.82  57.77  371.97  60.45  15.86   83.62  
1 1 1 -4  -10 6  o 19 669.41  52.88  13567.22  2015.46  14789.66 2470.07  11132.08  3486.24  691.82  62.88  558.06  112.71 133.76  129.06 
1 1 1 -4  -10 7  o 7  443.37  32.68  5783.39   825.95   6330.35  1014.96  4711.05   1421.15  461.78  38.64  385.32  66.66  76.47   77.05  
1 1 1 -4  -10 8  o 16 122.82  12.99  439.29    90.19    494.00   123.77   377.35    131.69   129.70  17.03  112.33  21.20  17.37   27.19  
1 1 1 -4  -10 9  o 1  325.47  24.43  3100.07   453.11   2977.91  637.67   3224.66   643.96   315.50  35.84  328.88  34.63  -13.38  49.84  
1 1 1 -4  -10 10 o 11 428.32  38.14  5502.79   927.94   5344.55  1140.38  5812.90   1596.42  416.61  48.59  421.69  68.28  -5.08   83.81  
1 1 1 -4  -10 11 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  -10 12 o 4  33.19   16.07  -154.60   94.01    -154.60  94.01    0.00      0.00     33.19   16.07  ?       ?      0.00    16.07  
1 1 1 -4  -10 13 o 3  702.44  21.30  14327.01  857.74   10826.42 1138.69  18918.67  1304.13  605.65  32.87  803.82  28.31  -198.17 43.38  
1 1 1 -4  -10 14 o 2  489.97  37.05  7179.35   1034.37  6972.60  1242.26  7646.72   1867.79  477.81  45.85  483.04  69.34  -5.24   83.13  
1 1 1 -4  -10 15 o 3  283.19  26.73  2376.46   429.33   2323.59  485.40   2566.47   920.26   278.55  30.87  278.87  59.31  -0.33   66.86  
1 1 1 -4  -10 16 o 15 281.86  31.00  2395.65   493.38   2395.65  493.38   0.00      0.00     281.86  31.00  ?       ?      0.00    31.00  
1 1 1 -4  -10 17 o 17 76.65   17.54  177.74    75.52    181.43   76.12    -56.19    605.80   77.45   17.53  110.08  48.68  -32.63  51.74  
1 1 1 -4  -10 18 o 16 289.53  38.22  2629.05   619.72   2718.76  759.01   2449.65   1073.37  288.20  47.53  254.16  70.90  34.04   85.36  
1 1 1 -4  -10 19 o 10 122.15  22.28  454.36    150.48   425.25   153.50   1171.88   762.11   117.74  23.53  179.83  61.45  -62.10  65.81  
1 1 1 -4  -10 20 o 15 275.09  33.03  2371.17   511.24   2071.46  596.35   3202.16   992.99   249.84  43.14  293.74  60.89  -43.90  74.62  
1 1 1 -4  -10 21 o 1  339.19  35.82  3678.16   687.03   3678.16  687.03   0.00      0.00     339.19  35.82  ?       ?      0.00    35.82  
1 1 1 -4  -10 22 o 1  256.49  25.95  2022.63   376.81   2022.63  376.81   0.00      0.00     256.49  25.95  ?       ?      0.00    25.95  
1 1 1 -4  -10 23 o 14 195.94  22.85  1176.62   252.25   1176.62  252.25   0.00      0.00     195.94  22.85  ?       ?      0.00    22.85  
1 1 1 -4  -10 24 f 0  78.25   33.18  72.34     258.69   72.34    258.69   0.00      0.00     78.25   33.18  ?       ?      0.00    33.18  
1 1 1 -4  -9  1  o 13 286.14  29.79  2442.03   482.14   2592.09  682.01   2292.11   681.68   289.66  42.26  270.60  45.50  19.07   62.09  
1 1 1 -4  -9  2  o 18 291.86  23.87  2503.18   396.46   2557.51  487.30   2396.82   681.85   293.32  29.33  277.97  44.21  15.35   53.05  
1 1 1 -4  -9  3  o 11 343.31  28.35  3480.83   553.76   3593.18  679.86   3259.37   954.52   346.49  34.64  320.95  53.70  25.54   63.91  
1 1 1 -4  -9  4  o 13 89.67   14.34  237.70    71.32    469.97   172.60   189.87    78.32    124.85  24.95  79.49   17.63  45.37   30.55  
1 1 1 -4  -9  5  o 5  320.07  30.22  3024.30   548.66   3457.06  785.72   2612.49   766.47   338.55  41.28  291.37  47.46  47.18   62.90  
1 1 1 -4  -9  6  o 9  626.07  63.19  12214.32  2240.14  13453.10 3173.23  10983.61  3162.87  633.51  89.76  560.24  102.11 73.28   135.95 
1 1 1 -4  -9  7  o 12 129.25  18.86  492.48    135.83   210.78   264.09   593.80    158.39   96.12   35.79  141.97  19.99  -45.85  40.99  
1 1 1 -4  -9  8  o 7  87.73   16.50  229.13    80.02    812.24   235.81   153.23    85.07    165.40  25.67  71.77   19.94  93.63   32.50  
1 1 1 -4  -9  9  o 9  266.61  23.70  2076.13   358.99   2705.93  536.51   1565.59   483.05   302.91  31.30  227.76  38.30  75.15   49.47  
1 1 1 -4  -9  10 o 10 442.01  46.73  5905.52   1167.86  5905.52  1167.86  0.00      0.00     442.01  46.73  ?       ?      0.00    46.73  
1 1 1 -4  -9  11 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  -9  12 o 8  32.68   15.04  -50.15    65.10    -50.15   65.10    0.00      0.00     32.68   15.04  ?       ?      0.00    15.04  
1 1 1 -4  -9  13 o 13 344.47  22.19  3462.94   436.56   2877.57  503.72   5229.42   875.05   312.17  28.42  418.11  36.83  -105.94 46.52  
1 1 1 -4  -9  14 f 0  534.75  44.82  8651.04   1363.16  8319.00  1654.03  9354.10   2406.83  516.57  56.71  526.66  82.30  -10.09  99.94  
1 1 1 -4  -9  15 o 15 224.11  29.82  1497.02   374.12   1690.17  408.98   506.38    926.19   238.12  30.63  161.43  65.04  76.70   71.89  
1 1 1 -4  -9  16 o 12 378.40  23.43  4192.98   506.57   3478.49  590.99   6171.69   983.50   342.16  30.40  452.47  38.22  -110.30 48.84  
1 1 1 -4  -9  17 o 7  353.93  26.11  3707.78   526.74   3380.95  605.39   4726.25   1068.69  335.43  31.82  385.92  49.37  -50.49  58.73  
1 1 1 -4  -9  18 o 13 191.66  22.62  1092.69   244.06   1053.20  259.93   1386.73   709.24   187.47  24.76  201.29  58.14  -13.82  63.19  
1 1 1 -4  -9  19 f 0  141.49  19.50  596.38    154.20   599.57   158.45   539.42    670.09   141.74  20.03  142.87  56.04  -1.13   59.51  
1 1 1 -4  -9  20 o 1  62.11   20.42  109.46    84.23    109.46   84.23    0.00      0.00     62.11   20.42  ?       ?      0.00    20.42  
1 1 1 -4  -9  21 o 14 258.36  43.62  2219.79   624.00   2219.79  624.00   0.00      0.00     258.36  43.62  ?       ?      0.00    43.62  
1 1 1 -4  -9  22 o 8  47.95   18.37  47.49     70.77    47.49    70.77    0.00      0.00     47.95   18.37  ?       ?      0.00    18.37  
1 1 1 -4  -9  23 o 10 56.97   18.63  93.31     70.11    93.31    70.11    0.00      0.00     56.97   18.63  ?       ?      0.00    18.63  
1 1 1 -4  -9  24 o 17 181.75  19.99  999.82    205.08   977.64   211.46   1351.14   841.44   179.26  20.94  173.65  64.02  5.61    67.36  
1 1 1 -4  -9  25 o 2  40.13   16.48  18.05     60.87    17.45    61.00    159.79    933.46   40.07   16.48  122.27  56.53  -82.20  58.89  
1 1 1 -4  -8  1  o 5  402.94  70.61  5648.23   1573.71  5648.23  1573.71  0.00      0.00     402.94  70.61  ?       ?      0.00    70.61  
1 1 1 -4  -8  2  o 16 119.37  18.14  423.22    120.41   423.22   120.41   0.00      0.00     119.37  18.14  ?       ?      0.00    18.14  
1 1 1 -4  -8  3  o 2  99.44   15.38  292.80    84.98    292.80   84.98    0.00      0.00     99.44   15.38  ?       ?      0.00    15.38  
1 1 1 -4  -8  4  o 5  261.40  40.59  2111.69   589.32   2111.69  589.32   0.00      0.00     261.40  40.59  ?       ?      0.00    40.59  
1 1 1 -4  -8  5  o 11 423.57  72.36  6087.12   1696.27  0.00     0.00     6087.12   1696.27  ?       ?      423.57  72.36  0.00    72.36  
1 1 1 -4  -8  6  o 13 122.18  12.87  435.21    88.91    413.27   124.05   458.40    127.49   117.96  18.96  124.48  18.39  -6.52   26.42  
1 1 1 -4  -8  7  o 15 221.02  16.53  1419.23   208.27   1488.03  260.16   1296.45   347.55   225.67  20.30  208.28  29.93  17.39   36.16  
1 1 1 -4  -8  8  f 0  559.72  41.06  9349.68   1310.02  10494.36 1605.80  7071.88   2265.21  589.20  47.89  454.88  89.93  134.32  101.89 
1 1 1 -4  -8  9  o 9  842.36  99.89  24221.93  4736.43  26458.22 6698.46  21985.83  6698.18  807.50  150.02 705.13  167.89 102.37  225.16 
1 1 1 -4  -8  10 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  -8  11 o 2  783.15  172.80 27128.54  7560.12  27128.54 7560.12  0.00      0.00     783.15  172.80 ?       ?      0.00    172.80 
1 1 1 -4  -8  12 o 15 458.76  75.84  6865.37   1927.54  6865.37  1927.54  0.00      0.00     458.76  75.84  ?       ?      0.00    75.84  
1 1 1 -4  -8  13 o 12 587.53  112.52 13092.26  3656.85  13092.26 3656.85  0.00      0.00     587.53  112.52 ?       ?      0.00    112.52 
1 1 1 -4  -8  14 o 15 262.78  46.29  2147.26   672.84   2147.26  672.84   0.00      0.00     262.78  46.29  ?       ?      0.00    46.29  
1 1 1 -4  -8  15 f 0  486.13  32.92  6998.68   913.35   6174.03  1101.26  8815.99   1634.81  451.57  43.00  532.57  54.23  -81.00  69.21  
1 1 1 -4  -8  16 o 3  447.84  26.05  5870.82   666.77   4879.45  788.58   8357.02   1248.80  405.23  34.22  527.12  41.61  -121.89 53.87  
1 1 1 -4  -8  17 o 9  285.78  25.48  2404.23   413.68   2361.59  462.10   2576.35   928.33   282.21  28.93  281.95  59.24  0.26    65.93  
1 1 1 -4  -8  18 f 0  175.94  21.46  916.02    212.30   916.02   212.30   0.00      0.00     175.94  21.46  ?       ?      0.00    21.46  
1 1 1 -4  -8  19 o 14 112.72  18.76  379.97    117.15   375.74   119.35   491.80    613.39   111.96  19.26  138.86  53.86  -26.90  57.20  
1 1 1 -4  -8  20 o 14 221.80  21.98  1460.70   276.13   1460.70  276.13   0.00      0.00     221.80  21.98  ?       ?      0.00    21.98  
1 1 1 -4  -8  21 f 0  186.97  29.87  1081.05   309.86   1081.05  309.86   0.00      0.00     186.97  29.87  ?       ?      0.00    29.87  
1 1 1 -4  -8  22 o 15 232.22  24.00  1629.99   315.40   1629.99  315.40   0.00      0.00     232.22  24.00  ?       ?      0.00    24.00  
1 1 1 -4  -8  23 o 13 181.83  20.57  994.52    210.92   994.52   210.92   0.00      0.00     181.83  20.57  ?       ?      0.00    20.57  
1 1 1 -4  -8  24 o 6  260.16  23.14  2058.34   342.01   2063.02  371.11   2031.97   881.14   259.08  25.27  217.39  65.34  41.69   70.06  
1 1 1 -4  -8  25 o 5  98.94   18.71  300.76    102.36   302.69   103.30   196.11    759.09   99.23   18.82  118.78  53.37  -19.55  56.59  
1 1 1 -4  -8  26 o 12 91.88   18.69  261.56    95.23    252.11   95.89    947.90    816.95   90.03   19.14  146.76  60.34  -56.72  63.31  
1 1 1 -4  -7  1  o 11 242.96  25.06  1751.66   344.49   1513.85  486.82   1990.16   487.54   220.22  39.98  255.81  34.04  -35.59  52.51  
1 1 1 -4  -7  2  o 3  204.34  21.03  1231.14   243.17   1153.46  343.47   1309.19   344.31   194.45  31.87  208.20  29.64  -13.75  43.53  
1 1 1 -4  -7  3  o 7  310.21  32.58  2904.25   571.60   2588.26  808.12   3220.61   808.60   282.63  51.71  319.97  45.28  -37.34  68.74  
1 1 1 -4  -7  4  o 12 562.04  47.85  9915.60   1529.13  10208.01 1873.17  9331.50   2647.45  557.84  59.41  484.55  98.54  73.29   115.06 
1 1 1 -4  -7  5  o 6  280.33  24.40  2322.67   388.79   2154.62  477.18   2654.55   670.59   267.28  31.72  292.63  41.05  -25.35  51.87  
1 1 1 -4  -7  6  o 12 351.16  57.69  4028.22   1122.65  4028.22  1122.65  0.00      0.00     351.16  57.69  ?       ?      0.00    57.69  
1 1 1 -4  -7  7  f 0  331.30  53.17  3504.82   976.95   3504.82  976.95   0.00      0.00     331.30  53.17  ?       ?      0.00    53.17  
1 1 1 -4  -7  8  o 17 177.07  26.68  937.84    262.78   937.84   262.78   0.00      0.00     177.07  26.68  ?       ?      0.00    26.68  
1 1 1 -4  -7  9  o 2  248.23  37.79  1868.38   521.53   1868.38  521.53   0.00      0.00     248.23  37.79  ?       ?      0.00    37.79  
1 1 1 -4  -7  10 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  -7  11 o 13 768.97  91.89  19715.08  3976.39  20393.37 5622.03  19036.09  5624.90  719.95  141.08 686.11  147.22 33.84   203.90 
1 1 1 -4  -7  12 o 5  174.91  15.44  888.57    153.42   1107.81  188.52   458.55    264.02   195.24  16.99  123.54  35.41  71.70   39.27  
1 1 1 -4  -7  13 o 17 87.69   14.03  227.01    68.25    280.68   75.86    -0.80     156.30   97.74   13.91  60.21   25.67  37.53   29.20  
1 1 1 -4  -7  14 o 16 282.80  24.10  2342.55   387.53   2199.19  460.47   2690.65   717.50   272.46  29.93  297.09  43.35  -24.63  52.68  
1 1 1 -4  -7  15 o 2  153.85  17.35  693.42    150.59   670.46   162.15   837.47    406.10   150.92  19.15  163.80  42.74  -12.88  46.84  
1 1 1 -4  -7  16 o 7  515.71  94.11  9572.23   2683.41  9572.23  2683.41  0.00      0.00     515.71  94.11  ?       ?      0.00    94.11  
1 1 1 -4  -7  17 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  -7  18 o 13 66.16   31.23  -335.53   310.09   -335.53  310.09   0.00      0.00     66.16   31.23  ?       ?      0.00    31.23  
1 1 1 -4  -7  19 o 13 591.52  47.99  10929.15  1615.55  10687.48 1965.86  11431.90  2835.42  571.27  60.88  549.45  93.22  21.82   111.34 
1 1 1 -4  -7  20 f 0  138.92  20.18  575.39    156.25   575.39   156.25   0.00      0.00     138.92  20.18  ?       ?      0.00    20.18  
1 1 1 -4  -7  21 f 0  166.07  19.85  819.04    185.48   819.04   185.48   0.00      0.00     166.07  19.85  ?       ?      0.00    19.85  
1 1 1 -4  -7  22 o 1  317.75  32.13  3117.06   578.11   3117.06  578.11   0.00      0.00     317.75  32.13  ?       ?      0.00    32.13  
1 1 1 -4  -7  23 o 16 55.16   18.29  85.72     67.56    78.66    68.04    574.00    565.71   53.68   18.36  135.71  51.96  -82.03  55.11  
1 1 1 -4  -7  24 o 3  58.70   18.00  102.31    66.42    100.35   66.83    260.88    600.98   58.28   18.09  117.74  50.28  -59.46  53.43  
1 1 1 -4  -7  25 o 4  149.81  15.65  667.18    132.57   652.07   135.08   1062.12   690.58   147.91  16.17  161.99  58.25  -14.08  60.46  
1 1 1 -4  -7  26 o 17 223.89  20.64  1524.66   262.36   1407.57  276.89   2552.65   820.44   213.67  22.93  247.71  58.62  -34.04  62.94  
1 1 1 -4  -7  27 o 5  185.74  36.62  1199.31   376.62   1199.31  376.62   0.00      0.00     185.74  36.62  ?       ?      0.00    36.62  
1 1 1 -4  -6  1  o 3  270.61  27.97  2176.25   428.22   1996.48  605.53   2356.10   605.67   253.26  43.20  277.39  39.12  -24.14  58.28  
1 1 1 -4  -6  2  o 13 102.36  10.61  305.05    61.43    298.10   86.88    312.00    86.88    100.35  15.59  102.78  15.18  -2.44   21.76  
1 1 1 -4  -6  3  o 6  48.17   9.67   69.21     25.82    0.00     0.00     69.21     25.82    ?       ?      48.17   9.67   0.00    9.67   
1 1 1 -4  -6  4  o 4  328.55  34.66  3263.95   643.85   3383.13  910.55   3144.77   910.52   325.94  50.28  312.64  52.60  13.30   72.76  
1 1 1 -4  -6  5  o 4  220.64  19.00  1426.33   238.37   1405.47  292.38   1467.67   411.62   217.77  23.77  219.25  33.79  -1.48   41.31  
1 1 1 -4  -6  6  o 12 61.49   7.41   110.33    25.62    114.68   35.60    105.66    36.90    62.26   10.32  59.57   11.20  2.69    15.23  
1 1 1 -4  -6  7  o 15 58.98   6.84   101.37    22.74    97.40    29.72    106.99    35.31    57.43   9.33   60.04   10.63  -2.61   14.15  
1 1 1 -4  -6  8  o 5  154.18  12.60  690.75    110.52   718.84   136.50   637.30    188.31   156.85  15.36  145.88  23.27  10.97   27.88  
1 1 1 -4  -6  9  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  -6  10 o 8  44.21   8.92   58.24     21.85    47.66    26.30    81.85     39.28    40.08   11.07  52.26   13.12  -12.18  17.16  
1 1 1 -4  -6  11 o 19 484.77  36.18  6988.37   999.61   7186.59  1414.34  6790.52   1412.98  483.08  51.81  468.42  53.51  14.66   74.48  
1 1 1 -4  -6  12 o 19 203.37  21.93  1211.74   252.03   1269.84  350.33   1149.42   362.85   206.38  30.49  195.39  33.56  10.98   45.34  
1 1 1 -4  -6  13 o 13 136.05  20.57  547.09    155.65   547.09   155.65   0.00      0.00     136.05  20.57  ?       ?      0.00    20.57  
1 1 1 -4  -6  14 o 2  230.08  32.41  1577.63   416.23   2263.58  583.21   865.51    594.23   274.77  37.99  169.75  54.11  105.02  66.12  
1 1 1 -4  -6  15 f 0  75.70   12.46  169.38    52.26    156.63   56.10    252.91    143.64   72.50   13.99  91.96   26.04  -19.46  29.56  
1 1 1 -4  -6  16 o 16 445.19  36.07  5924.99   913.92   5696.22  1109.97  6406.57   1610.46  431.46  45.50  444.39  65.05  -12.93  79.39  
1 1 1 -4  -6  17 o 10 416.65  32.50  5160.41   771.17   5044.50  927.29   5420.38   1388.70  408.31  40.08  410.53  60.76  -2.22   72.78  
1 1 1 -4  -6  18 f 0  443.93  41.91  5960.83   1055.52  6831.96  1274.01  4053.95   1884.91  472.08  47.66  332.18  94.41  139.91  105.76 
1 1 1 -4  -6  19 o 8  165.29  27.14  820.04    248.55   820.04   248.55   0.00      0.00     165.29  27.14  ?       ?      0.00    27.14  
1 1 1 -4  -6  20 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  -6  21 o 4  246.37  42.16  1931.72   574.86   1931.72  574.86   0.00      0.00     246.37  42.16  ?       ?      0.00    42.16  
1 1 1 -4  -6  22 o 19 91.85   30.87  244.18    192.19   244.18   192.19   0.00      0.00     91.85   30.87  ?       ?      0.00    30.87  
1 1 1 -4  -6  23 o 1  226.57  18.15  1516.23   234.14   1364.01  254.52   2353.97   597.09   213.80  21.01  270.01  39.71  -56.22  44.92  
1 1 1 -4  -6  24 o 15 260.61  20.97  2033.74   311.02   1962.18  344.38   2350.30   724.30   254.42  23.86  256.90  50.91  -2.48   56.23  
1 1 1 -4  -6  25 o 4  166.19  28.55  874.24    262.58   896.69   289.66   770.75    621.93   166.81  31.40  145.56  54.77  21.25   63.13  
1 1 1 -4  -6  26 o 10 59.01   25.03  22.80     147.14   11.33    151.36   220.15    627.92   58.62   25.14  113.92  49.99  -55.30  55.96  
1 1 1 -4  -6  27 o 13 65.27   26.06  84.50     147.39   87.24    150.37   17.39     744.40   65.99   26.33  109.00  50.43  -43.01  56.89  
1 1 1 -4  -6  28 o 14 154.46  29.39  791.58    251.11   829.56   263.25   408.12    836.52   157.64  30.19  121.26  55.10  36.38   62.83  
1 1 1 -4  -5  1  o 15 378.27  39.71  4312.25   849.57   4361.47  1201.49  4263.03   1201.47  370.76  58.38  366.00  59.20  4.76    83.14  
1 1 1 -4  -5  2  o 8  309.90  32.17  2860.89   564.06   2915.62  797.72   2806.17   797.69   306.96  46.74  300.54  47.84  6.42    66.88  
1 1 1 -4  -5  3  o 9  167.87  17.11  823.96    162.62   782.97   229.92   865.01    230.05   161.76  25.61  170.55  24.17  -8.79   35.22  
1 1 1 -4  -5  4  o 10 229.86  23.68  1558.37   308.00   1625.43  435.58   1491.31   435.57   231.75  33.73  221.20  35.50  10.55   48.97  
1 1 1 -4  -5  5  o 17 247.85  25.67  1819.87   360.03   1991.56  509.21   1648.27   509.10   255.92  35.63  230.80  39.86  25.12   53.46  
1 1 1 -4  -5  6  o 5  311.61  26.37  2875.32   467.30   2858.60  572.53   2908.69   808.80   308.12  32.88  303.21  48.07  4.91    58.23  
1 1 1 -4  -5  7  o 8  190.43  13.92  1053.92   151.11   1145.03  185.73   875.52    259.90   198.06  16.48  170.26  27.53  27.79   32.09  
1 1 1 -4  -5  8  o 7  611.08  71.35  12900.21  2455.80  12900.21 2455.80  0.00      0.00     611.08  71.35  ?       ?      0.00    71.35  
1 1 1 -4  -5  9  x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  -5  10 o 14 283.03  44.46  2505.95   698.65   0.00     0.00     2505.95   698.65   ?       ?      283.03  44.46  0.00    44.46  
1 1 1 -4  -5  11 o 12 114.59  8.77   379.98    57.24    391.12   81.49    369.12    80.42    115.79  12.45  112.42  12.68  3.38    17.78  
1 1 1 -4  -5  12 o 14 558.43  51.69  9633.78   1638.37  9633.78  1638.37  0.00      0.00     558.43  51.69  ?       ?      0.00    51.69  
1 1 1 -4  -5  13 o 4  116.51  9.72   393.12    64.43    329.41   74.72    577.83    127.23   106.23  12.49  140.61  16.05  -34.38  20.34  
1 1 1 -4  -5  14 o 4  487.39  35.01  7006.52   973.10   6990.88  1191.21  7037.88   1687.14  483.42  43.39  474.51  63.53  8.91    76.93  
1 1 1 -4  -5  15 o 12 450.41  36.59  6007.22   937.84   6436.80  1148.33  5146.80   1625.17  463.38  43.68  398.69  73.72  64.69   85.69  
1 1 1 -4  -5  16 o 4  664.84  50.66  13501.64  1919.00  12411.43 2346.64  15702.53  3334.20  624.00  66.53  679.33  87.53  -55.33  109.95 
1 1 1 -4  -5  17 o 9  327.06  35.91  3215.87   663.11   3255.14  906.53   3170.69   972.48   322.20  50.68  315.21  55.78  6.99    75.37  
1 1 1 -4  -5  18 o 14 434.62  74.11  6394.18   1782.89  6394.18  1782.89  0.00      0.00     434.62  74.11  ?       ?      0.00    74.11  
1 1 1 -4  -5  19 o 12 407.28  67.26  5435.99   1517.72  5435.99  1517.72  0.00      0.00     407.28  67.26  ?       ?      0.00    67.26  
1 1 1 -4  -5  20 o 12 268.80  26.05  2134.74   396.92   2320.77  451.43   1500.91   833.28   279.60  28.52  213.13  63.42  66.47   69.54  
1 1 1 -4  -5  21 o 11 90.05   18.04  243.96    89.98    246.63   91.63    171.61    476.78   90.51   18.26  111.19  45.95  -20.67  49.44  
1 1 1 -4  -5  22 o 12 310.08  25.46  2871.15   449.15   2724.85  527.71   3255.77   855.62   299.17  31.18  315.21  48.87  -16.04  57.97  
1 1 1 -4  -5  23 o 16 78.57   26.87  173.14    145.72   173.14   145.72   0.00      0.00     78.57   26.87  ?       ?      0.00    26.87  
1 1 1 -4  -5  24 o 2  148.92  29.46  698.60    242.93   698.60   242.93   0.00      0.00     148.92  29.46  ?       ?      0.00    29.46  
1 1 1 -4  -5  25 o 17 146.74  28.94  684.70    235.15   684.70   235.15   0.00      0.00     146.74  28.94  ?       ?      0.00    28.94  
1 1 1 -4  -5  26 o 4  166.89  28.02  884.43    258.97   833.76   281.93   1158.10   655.20   159.79  31.85  168.51  56.99  -8.72   65.29  
1 1 1 -4  -5  27 o 18 271.66  36.47  2493.50   554.36   2341.21  685.12   2782.28   943.43   247.80  49.89  246.51  65.54  1.29    82.37  
1 1 1 -4  -5  28 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  -4  1  f 0  197.25  29.50  1160.26   323.77   0.00     0.00     1160.26   323.77   ?       ?      197.25  29.50  0.00    29.50  
1 1 1 -4  -4  2  o 2  354.73  55.47  3922.22   1092.71  0.00     0.00     3922.22   1092.71  ?       ?      354.73  55.47  0.00    55.47  
1 1 1 -4  -4  3  o 14 368.10  58.18  4266.83   1188.67  0.00     0.00     4266.83   1188.67  ?       ?      368.10  58.18  0.00    58.18  
1 1 1 -4  -4  4  o 10 278.90  42.81  2380.57   663.52   0.00     0.00     2380.57   663.52   ?       ?      278.90  42.81  0.00    42.81  
1 1 1 -4  -4  5  o 10 150.05  22.44  669.16    187.34   0.00     0.00     669.16    187.34   ?       ?      150.05  22.44  0.00    22.44  
1 1 1 -4  -4  6  o 17 207.61  31.45  1301.21   363.12   0.00     0.00     1301.21   363.12   ?       ?      207.61  31.45  0.00    31.45  
1 1 1 -4  -4  7  o 16 218.44  17.72  1393.14   220.28   1411.69  270.10   1356.29   380.65   218.97  21.78  211.44  32.39  7.53    39.03  
1 1 1 -4  -4  8  o 18 455.14  83.81  7567.78   2109.09  7567.78  2109.09  0.00      0.00     455.14  83.81  ?       ?      0.00    83.81  
1 1 1 -4  -4  9  o 1  179.57  27.20  971.87    271.67   0.00     0.00     971.87    271.67   ?       ?      179.57  27.20  0.00    27.20  
1 1 1 -4  -4  10 o 17 145.13  12.73  612.96    104.96   558.24   129.17   719.34    180.09   137.74  16.67  155.72  20.65  -17.98  26.54  
1 1 1 -4  -4  11 o 6  333.62  35.62  3376.78   671.72   3376.78  671.72   0.00      0.00     333.62  35.62  ?       ?      0.00    35.62  
1 1 1 -4  -4  12 o 16 626.21  49.99  12234.25  1782.11  12211.51 2182.42  12279.75  3087.28  611.63  63.06  568.99  98.06  42.63   116.58 
1 1 1 -4  -4  13 o 3  278.84  17.74  2259.61   282.43   1957.09  345.02   2874.08   491.72   258.17  23.54  312.04  27.74  -53.88  36.38  
1 1 1 -4  -4  14 o 7  276.87  19.48  2229.03   307.63   2125.62  375.89   2438.76   535.33   269.31  24.58  286.34  33.18  -17.03  41.30  
1 1 1 -4  -4  15 o 13 320.77  25.73  3009.19   469.83   2808.97  570.19   3432.62   829.18   308.06  32.74  337.15  43.88  -29.09  54.75  
1 1 1 -4  -4  16 o 16 355.35  30.49  3717.06   616.01   3569.55  747.29   4029.84   1088.16  345.71  38.30  361.02  54.18  -15.30  66.34  
1 1 1 -4  -4  17 o 10 291.77  34.50  2547.09   566.66   2547.09  566.66   0.00      0.00     291.77  34.50  ?       ?      0.00    34.50  
1 1 1 -4  -4  18 o 7  162.97  13.92  772.25    129.03   725.27   137.83   1105.30   366.98   157.66  15.43  190.07  34.92  -32.41  38.17  
1 1 1 -4  -4  19 o 5  397.98  29.41  4689.50   667.07   4492.77  803.05   5127.44   1198.13  386.27  36.65  403.15  53.06  -16.88  64.49  
1 1 1 -4  -4  20 f 0  325.29  36.55  3188.47   670.80   3188.47  670.80   0.00      0.00     325.29  36.55  ?       ?      0.00    36.55  
1 1 1 -4  -4  21 o 2  196.46  30.94  1168.23   337.46   1520.45  407.87   403.97    600.82   224.08  32.67  135.17  53.05  88.91   62.30  
1 1 1 -4  -4  22 o 15 302.07  28.20  2736.23   483.44   2131.36  627.75   3617.79   757.85   258.57  43.86  341.20  39.41  -82.63  58.97  
1 1 1 -4  -4  23 o 19 142.90  48.71  653.42    478.77   0.00     0.00     653.42    478.77   ?       ?      142.90  48.71  0.00    48.71  
1 1 1 -4  -4  24 o 6  159.92  25.38  783.09    225.22   828.32   249.71   585.85    521.46   163.70  27.55  136.86  50.41  26.85   57.45  
1 1 1 -4  -4  25 o 7  220.07  28.52  1507.57   351.84   1353.00  421.57   1862.34   638.70   202.74  37.61  228.09  50.15  -25.35  62.68  
1 1 1 -4  -4  26 o 8  110.12  25.44  384.61    157.59   384.61   157.59   0.00      0.00     110.12  25.44  ?       ?      0.00    25.44  
1 1 1 -4  -4  27 o 7  123.41  24.91  483.65    170.38   483.65   170.38   0.00      0.00     123.41  24.91  ?       ?      0.00    24.91  
1 1 1 -4  -4  28 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  -4  29 o 1  138.77  25.04  624.50    192.17   624.50   192.17   0.00      0.00     138.77  25.04  ?       ?      0.00    25.04  
1 1 1 -4  -3  1  o 13 254.03  38.25  1939.35   540.57   0.00     0.00     1939.35   540.57   ?       ?      254.03  38.25  0.00    38.25  
1 1 1 -4  -3  2  o 9  113.04  11.57  371.51    74.02    345.98   104.71   397.02    104.65   108.14  17.46  116.24  16.12  -8.10   23.76  
1 1 1 -4  -3  3  o 17 516.52  55.25  8187.36   1612.73  7904.46  2280.73  8470.27   2280.75  487.56  84.55  507.81  80.95  -20.25  117.06 
1 1 1 -4  -3  4  o 5  362.67  37.72  3925.98   773.90   4126.22  1094.48  3725.76   1094.43  365.01  53.85  344.91  57.28  20.10   78.62  
1 1 1 -4  -3  5  o 18 278.94  28.63  2298.17   451.95   2170.59  639.11   2425.79   639.19   266.30  43.29  282.85  40.52  -16.55  59.30  
1 1 1 -4  -3  6  o 11 444.85  74.79  6614.48   1842.26  6614.48  1842.26  0.00      0.00     444.85  74.79  ?       ?      0.00    74.79  
1 1 1 -4  -3  7  o 9  403.50  67.36  5403.99   1505.23  5403.99  1505.23  0.00      0.00     403.50  67.36  ?       ?      0.00    67.36  
1 1 1 -4  -3  8  x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  -3  9  o 5  258.64  26.38  1988.83   386.22   2049.02  547.24   1929.10   545.14   257.96  38.10  249.62  39.34  8.34    54.77  
1 1 1 -4  -3  10 o 2  220.81  33.93  1492.77   416.36   0.00     0.00     1492.77   416.36   ?       ?      220.81  33.93  0.00    33.93  
1 1 1 -4  -3  11 o 17 416.78  46.50  5467.07   1093.69  5326.41  1547.56  5607.43   1545.86  389.22  71.91  401.93  69.51  -12.71  100.02 
1 1 1 -4  -3  12 o 6  413.78  72.87  5980.97   1667.81  5980.97  1667.81  0.00      0.00     413.78  72.87  ?       ?      0.00    72.87  
1 1 1 -4  -3  13 o 2  407.91  69.46  5622.86   1568.25  5622.86  1568.25  0.00      0.00     407.91  69.46  ?       ?      0.00    69.46  
1 1 1 -4  -3  14 o 13 124.35  12.26  449.91    86.36    574.80   104.19   175.67    154.39   140.59  13.06  80.70   27.66  59.89   30.59  
1 1 1 -4  -3  15 f 0  560.23  55.86  9692.11   1772.65  8704.95  2503.67  10684.39  2510.15  504.30  89.77  569.70  78.87  -65.39  119.49 
1 1 1 -4  -3  16 o 19 163.94  15.35  781.72    142.78   729.51   160.02   985.60    316.25   157.92  17.97  181.05  31.58  -23.13  36.33  
1 1 1 -4  -3  17 o 16 330.72  51.34  3381.22   943.19   3381.22  943.19   0.00      0.00     330.72  51.34  ?       ?      0.00    51.34  
1 1 1 -4  -3  18 o 2  439.09  46.68  5918.28   1158.58  5918.28  1158.58  0.00      0.00     439.09  46.68  ?       ?      0.00    46.68  
1 1 1 -4  -3  19 o 5  617.65  73.83  12977.43  2566.10  12977.43 2566.10  0.00      0.00     617.65  73.83  ?       ?      0.00    73.83  
1 1 1 -4  -3  20 o 18 146.12  16.64  625.83    137.11   639.72   144.44   499.21    436.18   147.61  17.38  132.94  46.44  14.68   49.59  
1 1 1 -4  -3  21 o 14 343.15  21.26  3439.90   416.69   2153.66  480.15   7363.97   838.65   268.04  31.82  499.06  29.40  -231.02 43.33  
1 1 1 -4  -3  22 o 18 171.03  24.74  876.54    235.89   684.72   270.00   1495.16   484.88   148.66  32.54  218.43  40.15  -69.77  51.68  
1 1 1 -4  -3  23 o 10 88.39   23.64  239.03    122.26   251.24   127.63   103.12    425.83   90.54   24.12  101.17  42.72  -10.62  49.06  
1 1 1 -4  -3  24 o 10 129.67  47.87  501.42    470.74   0.00     0.00     501.42    470.74   ?       ?      129.67  47.87  0.00    47.87  
1 1 1 -4  -3  25 o 2  357.46  85.06  5907.69   1720.11  0.00     0.00     5907.69   1720.11  ?       ?      357.46  85.06  0.00    85.06  
1 1 1 -4  -3  26 o 5  122.34  48.32  453.34    501.40   0.00     0.00     453.34    501.40   ?       ?      122.34  48.32  0.00    48.32  
1 1 1 -4  -3  27 o 12 81.66   19.48  207.53    90.05    205.26   91.36    284.96    533.84   81.16   19.79  111.64  47.52  -30.48  51.48  
1 1 1 -4  -3  28 o 1  196.22  59.83  1761.42   735.16   0.00     0.00     1761.42   735.16   ?       ?      196.22  59.83  0.00    59.83  
1 1 1 -4  -3  29 o 10 179.54  28.25  1063.63   281.56   1119.91  313.88   831.75    637.10   181.82  31.19  134.77  54.06  47.05   62.42  
1 1 1 -4  -3  30 o 19 84.17   22.56  230.74    111.22   230.74   111.22   0.00      0.00     84.17   22.56  ?       ?      0.00    22.56  
1 1 1 -4  -2  1  o 16 243.86  24.84  1741.57   342.94   1789.40  485.02   1693.74   484.97   244.75  35.56  237.69  36.72  7.06    51.12  
1 1 1 -4  -2  2  o 11 355.22  36.66  3740.78   736.91   3709.07  1042.15  3772.49   1042.14  347.49  54.00  350.73  53.45  -3.24   75.97  
1 1 1 -4  -2  3  f 0  308.75  31.73  2812.45   554.34   2774.52  783.97   2850.39   783.95   302.01  46.73  306.45  45.98  -4.44   65.56  
1 1 1 -4  -2  4  o 18 705.88  141.07 19810.17  5516.46  19810.17 5516.46  0.00      0.00     705.88  141.07 ?       ?      0.00    141.07 
1 1 1 -4  -2  5  f 0  228.40  34.33  1564.84   436.21   1564.84  436.21   0.00      0.00     228.40  34.33  ?       ?      0.00    34.33  
1 1 1 -4  -2  6  o 9  333.56  51.96  3455.35   962.57   3455.35  962.57   0.00      0.00     333.56  51.96  ?       ?      0.00    51.96  
1 1 1 -4  -2  7  o 9  486.10  84.64  8173.46   2276.27  8173.46  2276.27  0.00      0.00     486.10  84.64  ?       ?      0.00    84.64  
1 1 1 -4  -2  8  x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  -2  9  o 14 266.83  21.09  2087.87   320.43   2176.56  392.65   1911.07   554.39   271.17  25.52  248.42  40.25  22.74   47.66  
1 1 1 -4  -2  10 o 13 367.79  31.60  4058.67   660.70   3999.26  809.31   4177.37   1144.01  360.62  39.75  356.18  57.94  4.44    70.27  
1 1 1 -4  -2  11 o 15 369.53  39.78  4216.25   830.66   4173.91  1174.73  4258.59   1174.73  352.70  60.18  356.95  59.42  -4.25   84.57  
1 1 1 -4  -2  12 f 0  143.66  12.40  600.50    101.23   600.50   101.23   0.00      0.00     143.66  12.40  ?       ?      0.00    12.40  
1 1 1 -4  -2  13 o 10 320.54  24.72  3034.35   451.38   3112.84  552.58   2876.94   782.53   322.50  30.20  301.67  46.69  20.83   55.61  
1 1 1 -4  -2  14 o 7  809.58  65.40  21513.64  3013.61  19196.61 3690.37  26151.69  5221.22  725.20  90.62  792.23  118.43 -67.03  149.12 
1 1 1 -4  -2  15 o 13 542.65  99.70  10735.92  2991.47  10735.92 2991.47  0.00      0.00     542.65  99.70  ?       ?      0.00    99.70  
1 1 1 -4  -2  16 o 6  113.87  21.32  387.74    134.25   387.74   134.25   0.00      0.00     113.87  21.32  ?       ?      0.00    21.32  
1 1 1 -4  -2  17 o 19 618.56  115.80 14218.15  3961.00  14218.15 3961.00  0.00      0.00     618.56  115.80 ?       ?      0.00    115.80 
1 1 1 -4  -2  18 o 8  452.12  49.92  6287.83   1274.02  6287.83  1274.02  0.00      0.00     452.12  49.92  ?       ?      0.00    49.92  
1 1 1 -4  -2  19 o 7  363.38  39.56  4016.67   811.99   4016.67  811.99   0.00      0.00     363.38  39.56  ?       ?      0.00    39.56  
1 1 1 -4  -2  20 o 10 652.25  54.70  13529.19  2029.13  12227.19 2481.21  16158.28  3525.83  596.93  73.99  651.12  97.31  -54.19  122.24 
1 1 1 -4  -2  21 o 6  444.30  53.95  6252.41   1347.83  7289.34  1883.87  5165.02   1929.16  463.09  73.30  372.16  91.06  90.93   116.89 
1 1 1 -4  -2  22 o 7  90.95   21.22  250.70    108.73   283.94   112.34   -240.78   431.97   96.92   20.81  85.89   39.25  11.03   44.42  
1 1 1 -4  -2  23 o 6  178.85  24.72  961.94    246.98   1005.06  284.57   830.29    497.23   181.70  28.20  159.25  49.33  22.45   56.82  
1 1 1 -4  -2  24 o 7  93.62   19.33  266.58    100.46   269.54   103.70   221.31    405.31   94.05   19.83  105.97  42.90  -11.92  47.27  
1 1 1 -4  -2  25 o 5  222.96  36.61  1602.26   452.38   1602.26  452.38   0.00      0.00     222.96  36.61  ?       ?      0.00    36.61  
1 1 1 -4  -2  26 o 16 226.13  55.24  1954.86   710.78   0.00     0.00     1954.86   710.78   ?       ?      226.13  55.24  0.00    55.24  
1 1 1 -4  -2  27 o 14 210.88  54.75  1782.48   668.54   0.00     0.00     1782.48   668.54   ?       ?      210.88  54.75  0.00    54.75  
1 1 1 -4  -2  28 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  -2  29 o 11 115.78  47.56  484.44    506.76   0.00     0.00     484.44    506.76   ?       ?      115.78  47.56  0.00    47.56  
1 1 1 -4  -2  30 o 19 121.17  22.53  474.06    150.98   474.06   150.98   0.00      0.00     121.17  22.53  ?       ?      0.00    22.53  
1 1 1 -4  -1  1  o 12 288.78  43.64  2515.64   700.96   2515.64  700.96   0.00      0.00     288.78  43.64  ?       ?      0.00    43.64  
1 1 1 -4  -1  2  o 2  123.44  18.31  449.10    125.79   449.10   125.79   0.00      0.00     123.44  18.31  ?       ?      0.00    18.31  
1 1 1 -4  -1  3  o 17 478.34  77.19  7352.10   2047.56  7352.10  2047.56  0.00      0.00     478.34  77.19  ?       ?      0.00    77.19  
1 1 1 -4  -1  4  o 10 805.47  188.40 30723.81  8555.25  30723.81 8555.25  0.00      0.00     805.47  188.40 ?       ?      0.00    188.40 
1 1 1 -4  -1  5  o 1  396.35  62.48  4935.01   1374.50  4935.01  1374.50  0.00      0.00     396.35  62.48  ?       ?      0.00    62.48  
1 1 1 -4  -1  6  o 9  389.09  40.63  4540.57   894.06   4567.75  1264.40  4513.39   1264.38  381.21  59.74  378.66  60.18  2.55    84.79  
1 1 1 -4  -1  7  x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  -1  8  o 15 395.98  65.02  5122.83   1426.78  5122.83  1426.78  0.00      0.00     395.98  65.02  ?       ?      0.00    65.02  
1 1 1 -4  -1  9  o 6  207.33  18.46  1257.37   217.43   1142.43  266.40   1486.69   376.28   196.21  24.16  222.37  30.26  -26.16  38.72  
1 1 1 -4  -1  10 o 7  362.82  60.63  4373.66   1218.20  4373.66  1218.20  0.00      0.00     362.82  60.63  ?       ?      0.00    60.63  
1 1 1 -4  -1  11 o 11 394.70  69.22  5425.71   1511.15  5425.71  1511.15  0.00      0.00     394.70  69.22  ?       ?      0.00    69.22  
1 1 1 -4  -1  12 o 11 225.73  34.86  1568.35   437.21   1568.35  437.21   0.00      0.00     225.73  34.86  ?       ?      0.00    34.86  
1 1 1 -4  -1  13 o 11 264.31  41.59  2189.86   610.26   2189.86  610.26   0.00      0.00     264.31  41.59  ?       ?      0.00    41.59  
1 1 1 -4  -1  14 o 1  92.11   15.15  251.87    77.32    251.87   77.32    0.00      0.00     92.11   15.15  ?       ?      0.00    15.15  
1 1 1 -4  -1  15 o 12 201.00  17.36  1178.77   198.34   1164.87  239.33   1209.26   354.42   199.00  21.28  199.92  31.96  -0.92   38.39  
1 1 1 -4  -1  16 f 0  296.07  28.43  2586.79   477.31   2309.36  667.00   2877.98   683.34   274.48  43.80  308.73  39.46  -34.25  58.95  
1 1 1 -4  -1  17 o 5  295.76  23.68  2556.76   398.71   2293.24  482.93   3120.89   706.60   278.24  30.75  322.39  38.97  -44.15  49.64  
1 1 1 -4  -1  18 o 6  493.76  54.77  7558.24   1526.40  7791.06  2154.02  7323.40   2163.33  481.88  80.72  463.93  84.33  17.94   116.74 
1 1 1 -4  -1  19 o 9  519.67  97.59  10065.56  2804.59  10065.56 2804.59  0.00      0.00     519.67  97.59  ?       ?      0.00    97.59  
1 1 1 -4  -1  20 o 17 133.94  22.76  538.22    168.78   538.22   168.78   0.00      0.00     133.94  22.76  ?       ?      0.00    22.76  
1 1 1 -4  -1  21 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  -1  22 o 2  242.91  26.36  1753.27   361.65   928.46   436.45   3560.32   646.02   170.98  44.16  344.29  33.09  -173.31 55.18  
1 1 1 -4  -1  23 o 11 255.18  29.01  1962.72   417.47   1872.78  540.20   2096.10   657.81   244.21  39.91  254.88  46.68  -10.67  61.41  
1 1 1 -4  -1  24 f 0  250.07  28.15  1903.59   397.10   1748.34  515.14   2130.94   623.38   233.11  39.93  254.94  44.20  -21.83  59.56  
1 1 1 -4  -1  25 o 15 68.61   19.50  142.66    80.39    123.44   82.34    534.86    371.90   64.63   20.08  128.40  42.93  -63.77  47.40  
1 1 1 -4  -1  26 o 13 59.00   17.71  104.19    64.74    104.19   64.74    0.00      0.00     59.00   17.71  ?       ?      0.00    17.71  
1 1 1 -4  -1  27 o 12 66.80   16.93  137.39    64.99    143.61   65.97    -66.41    377.62   68.28   16.92  82.56   37.32  -14.29  40.98  
1 1 1 -4  -1  28 o 19 95.35   20.79  285.97    110.60   260.15   114.80   619.59    412.59   90.45   22.26  128.41  45.15  -37.96  50.34  
1 1 1 -4  -1  29 o 18 66.37   19.46  137.41    78.93    130.36   80.43    322.12    411.61   64.90   19.79  103.37  42.70  -38.46  47.06  
1 1 1 -4  -1  30 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  0   1  o 18 495.82  80.01  7899.17   2199.92  7899.17  2199.92  0.00      0.00     495.82  80.01  ?       ?      0.00    80.01  
1 1 1 -4  0   2  o 15 500.12  81.07  8071.99   2248.00  8071.99  2248.00  0.00      0.00     500.12  81.07  ?       ?      0.00    81.07  
1 1 1 -4  0   3  o 1  195.14  19.78  1111.19   218.49   1174.81  309.02   1047.59   308.96   199.19  27.78  187.48  29.70  11.72   40.66  
1 1 1 -4  0   4  o 19 560.18  60.02  9661.34   1899.95  9885.29  2686.96  9437.41   2686.91  546.19  88.74  531.39  91.37  14.80   127.37 
1 1 1 -4  0   5  o 8  794.98  192.76 31261.95  8705.02  0.00     0.00     31261.95  8705.02  ?       ?      794.98  192.76 0.00    192.76 
1 1 1 -4  0   6  o 4  138.92  20.61  570.55    159.38   570.55   159.38   0.00      0.00     138.92  20.61  ?       ?      0.00    20.61  
1 1 1 -4  0   7  o 2  415.64  67.38  5575.49   1552.75  0.00     0.00     5575.49   1552.75  ?       ?      415.64  67.38  0.00    67.38  
1 1 1 -4  0   8  f 0  551.40  61.44  9699.56   1911.86  9458.32  2703.78  9940.80   2703.78  510.66  95.75  527.16  92.73  -16.50  133.29 
1 1 1 -4  0   9  o 8  331.27  34.75  3305.31   651.00   3309.44  920.65   3301.18   920.66   322.95  51.38  322.50  51.46  0.46    72.72  
1 1 1 -4  0   10 o 6  180.28  16.14  949.18    165.27   842.35   202.57   1161.85   285.81   168.60  21.41  197.20  25.87  -28.60  33.58  
1 1 1 -4  0   11 o 19 446.36  49.60  6350.01   1249.45  6669.68  1767.01  6030.35   1766.98  433.67  73.61  406.68  78.53  26.99   107.63 
1 1 1 -4  0   12 o 8  173.36  17.58  883.01    172.57   883.01   172.57   0.00      0.00     173.36  17.58  ?       ?      0.00    17.58  
1 1 1 -4  0   13 o 5  301.16  27.11  2707.44   463.68   2707.44  463.68   0.00      0.00     301.16  27.11  ?       ?      0.00    27.11  
1 1 1 -4  0   14 o 1  155.16  17.26  707.55    151.13   707.55   151.13   0.00      0.00     155.16  17.26  ?       ?      0.00    17.26  
1 1 1 -4  0   15 o 1  570.61  127.55 14624.36  4073.08  14624.36 4073.08  0.00      0.00     570.61  127.55 ?       ?      0.00    127.55 
1 1 1 -4  0   16 o 19 446.67  46.57  6111.93   1176.55  5902.64  1661.63  6322.35   1666.17  422.25  71.07  439.43  68.26  -17.18  98.54  
1 1 1 -4  0   17 o 9  330.49  51.45  3388.73   944.45   3388.73  944.45   0.00      0.00     330.49  51.45  ?       ?      0.00    51.45  
1 1 1 -4  0   18 o 13 300.94  25.94  2658.93   443.83   2043.42  615.63   3325.06   640.45   258.26  43.04  334.34  33.83  -76.08  54.74  
1 1 1 -4  0   19 o 4  213.01  21.86  1333.63   263.46   1333.63  263.46   0.00      0.00     213.01  21.86  ?       ?      0.00    21.86  
1 1 1 -4  0   20 o 9  175.86  18.63  908.60    185.18   1103.96  215.31   353.58    362.92   193.81  19.62  115.82  42.15  77.98   46.49  
1 1 1 -4  0   21 o 7  49.20   16.73  64.91     56.45    58.25    57.47    246.42    300.19   47.83   16.85  101.55  38.08  -53.72  41.64  
1 1 1 -4  0   22 o 17 196.97  30.38  1174.16   332.54   1174.16  332.54   0.00      0.00     196.97  30.38  ?       ?      0.00    30.38  
1 1 1 -4  0   23 o 12 71.22   16.69  153.20    67.06    153.20   67.06    0.00      0.00     71.22   16.69  ?       ?      0.00    16.69  
1 1 1 -4  0   24 o 6  307.11  52.80  3212.86   897.30   3212.86  897.30   0.00      0.00     307.11  52.80  ?       ?      0.00    52.80  
1 1 1 -4  0   25 o 9  115.31  17.93  399.49    114.85   415.54   123.16   292.49    317.98   117.37  18.92  104.11  39.16  13.26   43.50  
1 1 1 -4  0   26 o 9  198.65  23.36  1204.32   261.25   1015.51  324.28   1553.45   440.97   177.06  33.12  217.39  36.64  -40.33  49.39  
1 1 1 -4  0   27 o 13 185.85  24.00  1072.79   250.10   1063.78  304.73   1091.37   437.74   181.14  30.38  173.04  43.98  8.10    53.45  
1 1 1 -4  0   28 o 5  108.67  17.41  361.07    104.93   385.97   110.46   131.11    335.64   112.31  17.72  88.40   37.66  23.91   41.62  
1 1 1 -4  0   29 o 17 71.47   18.14  160.39    74.52    162.43   76.27    117.61    349.57   71.88   18.41  86.98   37.75  -15.11  42.00  
1 1 1 -4  0   30 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  0   31 o 4  165.13  25.02  908.65    229.76   891.87   263.90   961.18    467.03   158.94  30.02  140.34  48.10  18.61   56.70  
1 1 1 -4  1   1  o 13 321.74  49.01  3146.49   876.62   3146.49  876.62   0.00      0.00     321.74  49.01  ?       ?      0.00    49.01  
1 1 1 -4  1   2  o 16 429.39  44.78  5518.33   1087.54  5390.59  1538.02  5646.06   1538.01  414.33  66.94  425.17  65.08  -10.85  93.37  
1 1 1 -4  1   3  o 17 414.96  43.12  5147.17   1012.12  5348.05  1431.37  4946.31   1431.32  414.69  62.03  397.05  65.05  17.64   89.88  
1 1 1 -4  1   4  o 19 349.76  53.95  3764.07   1048.44  3764.07  1048.44  0.00      0.00     349.76  53.95  ?       ?      0.00    53.95  
1 1 1 -4  1   5  o 10 767.59  89.30  19617.12  3861.77  19693.76 5461.38  19540.47  5461.35  704.24  140.02 700.41  140.72 3.83    198.51 
1 1 1 -4  1   6  x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  1   7  o 11 364.40  38.12  3979.69   785.57   3881.02  1110.97  4078.36   1110.95  351.00  57.10  360.88  55.39  -9.88   79.55  
1 1 1 -4  1   8  o 19 583.79  66.09  11034.25  2175.91  10875.73 3077.22  11192.77  3077.19  539.07  103.19 549.38  101.30 -10.31  144.61 
1 1 1 -4  1   9  o 12 271.34  28.19  2189.66   432.71   2108.66  611.95   2270.65   611.94   260.72  42.34  271.57  40.49  -10.85  58.58  
1 1 1 -4  1   10 o 4  270.45  28.13  2182.54   430.37   2133.31  608.63   2231.77   608.63   261.52  41.96  268.14  40.83  -6.63   58.54  
1 1 1 -4  1   11 o 2  60.17   5.01   104.75    17.16    125.57   21.82    70.97     27.79    65.84   5.83   48.71   10.26  17.13   11.80  
1 1 1 -4  1   12 f 0  55.24   12.78  91.75     39.71    91.75    39.71    0.00      0.00     55.24   12.78  ?       ?      0.00    12.78  
1 1 1 -4  1   13 o 6  120.91  11.84  426.26    81.10    426.26   81.10    0.00      0.00     120.91  11.84  ?       ?      0.00    11.84  
1 1 1 -4  1   14 o 11 154.50  14.83  697.74    129.90   697.74   129.90   0.00      0.00     154.50  14.83  ?       ?      0.00    14.83  
1 1 1 -4  1   15 o 5  447.07  49.52  6302.68   1249.53  6302.68  1249.53  0.00      0.00     447.07  49.52  ?       ?      0.00    49.52  
1 1 1 -4  1   16 o 9  406.22  32.12  4905.19   742.89   4481.95  908.75   5757.83   1289.82  383.58  41.95  427.90  53.69  -44.33  68.13  
1 1 1 -4  1   17 o 8  401.68  33.93  4791.72   775.01   4900.49  947.78   4572.26   1346.34  402.93  41.57  376.63  64.59  26.30   76.81  
1 1 1 -4  1   18 f 0  105.81  11.10  325.82    66.42    288.48   71.53    559.66    179.01   99.24   12.86  136.84  23.64  -37.61  26.91  
1 1 1 -4  1   19 o 16 318.02  33.92  3029.41   609.62   3029.41  609.62   0.00      0.00     318.02  33.92  ?       ?      0.00    33.92  
1 1 1 -4  1   20 o 11 209.11  35.82  1346.32   414.58   0.00     0.00     1346.32   414.58   ?       ?      209.11  35.82  0.00    35.82  
1 1 1 -4  1   21 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  1   22 o 2  68.98   34.75  -1895.67  634.36   0.00     0.00     -1895.67  634.36   ?       ?      68.98   34.75  0.00    34.75  
1 1 1 -4  1   23 o 1  34.54   14.91  -5.70     53.90    7.68     54.81    -394.35   295.48   37.02   15.46  61.16   29.32  -24.14  33.15  
1 1 1 -4  1   24 o 11 117.66  37.47  431.54    285.01   0.00     0.00     431.54    285.01   ?       ?      117.66  37.47  0.00    37.47  
1 1 1 -4  1   25 o 4  263.34  44.85  2337.57   653.81   2337.57  653.81   0.00      0.00     263.34  44.85  ?       ?      0.00    44.85  
1 1 1 -4  1   26 o 8  35.70   14.65  13.16     48.08    13.16    48.08    0.00      0.00     35.70   14.65  ?       ?      0.00    14.65  
1 1 1 -4  1   27 o 18 136.83  22.68  583.04    171.95   583.04   171.95   0.00      0.00     136.83  22.68  ?       ?      0.00    22.68  
1 1 1 -4  1   28 o 12 147.39  24.73  692.55    201.81   692.55   201.81   0.00      0.00     147.39  24.73  ?       ?      0.00    24.73  
1 1 1 -4  1   29 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  1   30 o 7  175.48  23.33  994.90    229.20   1043.35  292.29   917.54    369.34   173.35  30.48  150.46  41.44  22.89   51.45  
1 1 1 -4  1   31 o 1  75.31   19.17  183.99    83.06    201.96   88.08    39.59     249.66   78.78   19.57  69.99   31.08  8.79    36.73  
1 1 1 -4  2   1  o 3  143.67  21.33  609.65    170.62   609.65   170.62   0.00      0.00     143.67  21.33  ?       ?      0.00    21.33  
1 1 1 -4  2   2  o 8  316.27  32.55  2952.26   582.46   2725.51  823.71   3179.03   823.74   298.34  49.85  324.28  45.50  -25.95  67.50  
1 1 1 -4  2   3  o 15 533.08  56.98  8706.42   1716.78  8270.69  2427.89  9142.16   2427.90  498.94  87.98  529.13  82.63  -30.19  120.70 
1 1 1 -4  2   4  o 8  782.47  91.02  20434.35  4012.25  21567.17 5674.22  19301.55  5674.15  742.14  138.27 686.58  148.30 55.55   202.76 
1 1 1 -4  2   5  o 6  714.14  150.24 21417.65  5963.96  21417.65 5963.96  0.00      0.00     714.14  150.24 ?       ?      0.00    150.24 
1 1 1 -4  2   6  o 2  447.09  73.32  6522.98   1816.55  0.00     0.00     6522.98   1816.55  ?       ?      447.09  73.32  0.00    73.32  
1 1 1 -4  2   7  o 7  341.93  35.49  3494.44   686.58   3601.01  971.00   3387.89   970.95   340.17  51.32  328.82  53.26  11.35   73.96  
1 1 1 -4  2   8  o 2  404.06  42.87  4981.19   979.32   5070.76  1384.99  4891.63   1384.95  394.80  63.24  386.63  64.68  8.17    90.46  
1 1 1 -4  2   9  o 18 172.75  17.47  874.14    170.85   929.30   241.66   819.03    241.57   176.54  24.51  165.05  26.38  11.49   36.01  
1 1 1 -4  2   10 o 8  324.25  52.71  3402.33   947.54   3402.33  947.54   0.00      0.00     324.25  52.71  ?       ?      0.00    52.71  
1 1 1 -4  2   11 o 2  150.31  22.55  676.38    188.56   0.00     0.00     676.38    188.56   ?       ?      150.31  22.55  0.00    22.55  
1 1 1 -4  2   12 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  2   13 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  2   14 o 8  335.96  35.89  3453.36   681.50   3453.36  681.50   0.00      0.00     335.96  35.89  ?       ?      0.00    35.89  
1 1 1 -4  2   15 f 0  657.94  84.36  15806.83  3113.19  15806.83 3113.19  0.00      0.00     657.94  84.36  ?       ?      0.00    84.36  
1 1 1 -4  2   16 o 1  193.24  21.15  1098.65   230.82   1098.65  230.82   0.00      0.00     193.24  21.15  ?       ?      0.00    21.15  
1 1 1 -4  2   17 o 11 266.67  23.67  2085.68   358.64   2354.22  437.39   1534.65   626.54   282.48  27.31  220.19  50.63  62.29   57.52  
1 1 1 -4  2   18 o 19 568.74  66.13  10391.92  2118.75  10391.92 2118.75  0.00      0.00     568.74  66.13  ?       ?      0.00    66.13  
1 1 1 -4  2   19 o 18 534.58  102.22 10853.65  3022.53  10853.65 3022.53  0.00      0.00     534.58  102.22 ?       ?      0.00    102.22 
1 1 1 -4  2   20 o 8  105.82  14.70  330.10    86.90    249.15   99.79    584.14    176.78   90.79   19.71  139.56  22.86  -48.77  30.18  
1 1 1 -4  2   21 o 3  503.44  51.07  8123.73   1455.49  6313.90  2052.10  9955.88   2064.71  399.93  91.39  536.56  68.60  -136.63 114.27 
1 1 1 -4  2   22 o 15 66.37   33.54  -1968.27  617.15   0.00     0.00     -1968.27  617.15   ?       ?      66.37   33.54  0.00    33.54  
1 1 1 -4  2   23 o 2  220.91  40.54  1540.25   495.20   0.00     0.00     1540.25   495.20   ?       ?      220.91  40.54  0.00    40.54  
1 1 1 -4  2   24 o 3  95.02   33.11  256.75    221.58   0.00     0.00     256.75    221.58   ?       ?      95.02   33.11  0.00    33.11  
1 1 1 -4  2   25 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  2   26 o 18 231.71  25.00  1651.70   327.31   1452.10  447.13   1882.16   480.44   207.73  38.92  239.43  36.07  -31.70  53.07  
1 1 1 -4  2   27 o 16 70.25   27.84  104.50    166.99   0.00     0.00     104.50    166.99   ?       ?      70.25   27.84  0.00    27.84  
1 1 1 -4  2   28 o 5  122.34  21.46  470.50    145.26   470.50   145.26   0.00      0.00     122.34  21.46  ?       ?      0.00    21.46  
1 1 1 -4  2   29 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  2   30 f 0  85.43   17.02  229.26    80.52    258.65   88.30    84.19     196.18   90.62   17.61  68.93   29.05  21.69   33.97  
1 1 1 -4  2   31 o 18 163.29  22.10  872.45    201.86   952.96   259.54   749.17    321.14   164.48  28.52  132.88  39.33  31.61   48.58  
1 1 1 -4  3   1  o 11 244.97  36.85  1800.95   502.22   1800.95  502.22   0.00      0.00     244.97  36.85  ?       ?      0.00    36.85  
1 1 1 -4  3   2  o 12 691.58  134.72 18515.69  5156.09  18515.69 5156.09  0.00      0.00     691.58  134.72 ?       ?      0.00    134.72 
1 1 1 -4  3   3  x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  3   4  o 3  288.41  29.62  2454.50   483.46   2468.94  683.77   2440.07   683.67   285.07  43.13  283.26  43.43  1.81    61.20  
1 1 1 -4  3   5  x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  3   6  o 2  172.62  25.78  887.23    247.65   887.23   247.65   0.00      0.00     172.62  25.78  ?       ?      0.00    25.78  
1 1 1 -4  3   7  o 4  171.93  17.46  864.21    169.96   919.11   240.47   809.42    240.24   175.89  24.48  164.42  26.34  11.47   35.96  
1 1 1 -4  3   8  o 14 478.31  52.39  7210.32   1414.97  7512.84  2001.11  6907.81   2001.04  465.33  77.65  441.62  81.95  23.71   112.89 
1 1 1 -4  3   9  o 13 543.00  62.32  9754.95   1907.33  10536.14 2697.40  8973.80   2697.34  525.93  92.73  470.87  102.69 55.06   138.36 
1 1 1 -4  3   10 o 6  403.32  71.94  5762.27   1604.59  0.00     0.00     5762.27   1604.59  ?       ?      403.32  71.94  0.00    71.94  
1 1 1 -4  3   11 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  3   12 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  3   13 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  3   14 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  3   15 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  3   16 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  3   17 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  3   18 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  3   19 o 14 331.82  53.06  3506.12   976.66   3506.12  976.66   0.00      0.00     331.82  53.06  ?       ?      0.00    53.06  
1 1 1 -4  3   20 o 19 241.65  24.88  1735.24   340.22   1630.85  473.99   1846.17   488.63   229.50  37.25  245.11  35.78  -15.62  51.65  
1 1 1 -4  3   21 o 13 227.85  22.36  1536.27   288.70   1072.23  392.00   2086.32   426.79   184.51  38.27  263.52  28.67  -79.01  47.82  
1 1 1 -4  3   22 o 9  166.19  14.80  806.09    139.69   1759.91  163.13   -1815.88  270.47   246.67  11.55  ?       ?      0.00    11.55  
1 1 1 -4  3   23 o 1  60.50   14.21  110.30    48.52    145.27   50.41    -329.77   178.82   69.75   13.07  43.87   21.44  25.88   25.11  
1 1 1 -4  3   24 o 11 107.30  14.81  341.34    88.80    406.08   105.51   184.04    164.46   116.89  16.16  81.55   28.52  35.34   32.77  
1 1 1 -4  3   25 o 19 89.59   15.36  241.31    76.17    222.13   89.88    290.19    143.46   85.09   18.89  96.15   25.56  -11.06  31.78  
1 1 1 -4  3   26 o 13 108.71  26.64  377.77    164.92   0.00     0.00     377.77    164.92   ?       ?      108.71  26.64  0.00    26.64  
1 1 1 -4  3   27 o 11 80.93   26.42  203.60    141.06   0.00     0.00     203.60    141.06   ?       ?      80.93   26.42  0.00    26.42  
1 1 1 -4  3   28 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  3   29 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  3   30 o 6  160.12  30.32  906.15    268.50   906.15   268.50   0.00      0.00     160.12  30.32  ?       ?      0.00    30.32  
1 1 1 -4  3   31 o 2  147.85  29.38  790.94    240.60   790.94   240.60   0.00      0.00     147.85  29.38  ?       ?      0.00    29.38  
1 1 1 -4  4   1  o 16 256.38  26.31  1933.01   381.74   1766.79  539.81   2099.29   539.90   241.10  40.43  264.52  36.53  -23.42  54.49  
1 1 1 -4  4   2  f 0  496.79  83.69  8264.96   2301.95  8264.96  2301.95  0.00      0.00     496.79  83.69  ?       ?      0.00    83.69  
1 1 1 -4  4   3  o 6  334.71  52.08  3474.50   968.08   3474.50  968.08   0.00      0.00     334.71  52.08  ?       ?      0.00    52.08  
1 1 1 -4  4   4  x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  4   5  o 4  574.00  109.65 12501.33  3481.36  0.00     0.00     12501.33  3481.36  ?       ?      574.00  109.65 0.00    109.65 
1 1 1 -4  4   6  o 17 378.35  39.89  4336.63   853.27   4476.17  1206.75  4197.12   1206.67  374.07  58.08  360.54  60.44  13.53   83.82  
1 1 1 -4  4   7  f 0  133.44  19.92  528.58    147.90   0.00     0.00     528.58    147.90   ?       ?      133.44  19.92  0.00    19.92  
1 1 1 -4  4   8  o 4  306.57  32.14  2827.81   557.21   2803.85  788.05   2851.77   787.98   297.39  47.78  300.25  47.28  -2.86   67.21  
1 1 1 -4  4   9  o 11 313.75  50.97  3182.61   886.47   0.00     0.00     3182.61   886.47   ?       ?      313.75  50.97  0.00    50.97  
1 1 1 -4  4   10 o 17 293.85  30.74  2608.72   510.97   2817.26  722.68   2400.27   722.55   298.49  43.45  272.48  47.94  26.01   64.70  
1 1 1 -4  4   11 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  4   12 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  4   13 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  4   14 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  4   15 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  4   16 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  4   17 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  4   18 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  4   19 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  4   20 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  4   21 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  4   22 o 5  147.81  22.84  655.20    187.54   655.20   187.54   0.00      0.00     147.81  22.84  ?       ?      0.00    22.84  
1 1 1 -4  4   23 o 15 48.76   13.80  70.73     40.37    73.32    44.26    57.91     98.36    49.81   14.56  55.39   21.54  -5.58   26.00  
1 1 1 -4  4   24 o 19 265.67  45.27  2365.42   665.62   0.00     0.00     2365.42   665.62   ?       ?      265.67  45.27  0.00    45.27  
1 1 1 -4  4   25 o 15 227.65  38.88  1724.08   489.82   0.00     0.00     1724.08   489.82   ?       ?      227.65  38.88  0.00    38.88  
1 1 1 -4  4   26 o 9  87.64   14.04  230.63    68.26    221.62   83.69    248.53    117.97   84.89   17.75  88.77   22.97  -3.88   29.03  
1 1 1 -4  4   27 o 4  34.92   15.28  -9.72     58.21    -9.72    58.21    0.00      0.00     34.92   15.28  ?       ?      0.00    15.28  
1 1 1 -4  4   28 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  4   29 o 8  242.68  78.30  4430.86   1241.33  0.00     0.00     4430.86   1241.33  ?       ?      242.68  78.30  0.00    78.30  
1 1 1 -4  4   30 o 10 106.72  26.65  397.59    162.73   0.00     0.00     397.59    162.73   ?       ?      106.72  26.65  0.00    26.65  
1 1 1 -4  4   31 o 3  60.76   24.27  93.80     127.84   0.00     0.00     93.80     127.84   ?       ?      60.76   24.27  0.00    24.27  
1 1 1 -4  5   1  x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  5   2  o 12 124.82  12.89  453.84    91.06    440.51   128.97   467.10    128.60   121.89  19.06  125.73  18.36  -3.84   26.46  
1 1 1 -4  5   3  o 18 131.98  13.57  507.68    101.33   498.92   143.42   516.42    143.19   129.69  19.90  132.08  19.47  -2.39   27.84  
1 1 1 -4  5   4  x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  5   5  x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  5   6  o 12 371.91  39.64  4230.39   833.36   4216.00  1178.57  4244.77   1178.54  358.42  59.36  359.85  59.10  -1.43   83.76  
1 1 1 -4  5   7  o 14 154.18  15.80  695.87    137.88   727.00   195.17   664.85    194.80   156.15  22.41  148.90  23.57  7.25    32.53  
1 1 1 -4  5   8  o 15 166.28  17.06  811.57    160.55   817.06   227.23   806.10    226.88   164.88  24.77  163.71  24.93  1.18    35.14  
1 1 1 -4  5   9  o 4  156.76  16.11  720.99    142.88   715.59   202.27   726.36    201.86   154.31  23.58  155.56  23.32  -1.25   33.17  
1 1 1 -4  5   10 o 4  255.56  40.55  2063.56   575.04   0.00     0.00     2063.56   575.04   ?       ?      255.56  40.55  0.00    40.55  
1 1 1 -4  5   11 o 10 213.18  33.18  1402.93   392.90   1402.93  392.90   0.00      0.00     213.18  33.18  ?       ?      0.00    33.18  
1 1 1 -4  5   12 o 12 393.32  41.31  4854.07   918.93   0.00     0.00     4854.07   918.93   ?       ?      393.32  41.31  0.00    41.31  
1 1 1 -4  5   13 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  5   14 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  5   15 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  5   16 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  5   17 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  5   18 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  5   19 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  5   20 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  5   21 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  5   22 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  5   23 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  5   24 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  5   25 o 15 68.51   16.65  143.86    64.84    0.00     0.00     143.86    64.84    ?       ?      68.51   16.65  0.00    16.65  
1 1 1 -4  5   26 o 5  101.36  18.50  316.02    103.71   0.00     0.00     316.02    103.71   ?       ?      101.36  18.50  0.00    18.50  
1 1 1 -4  5   27 o 2  34.94   15.24  -7.73     57.53    -7.73    57.53    0.00      0.00     34.94   15.24  ?       ?      0.00    15.24  
1 1 1 -4  5   28 o 18 140.85  24.67  647.68    192.18   0.00     0.00     647.68    192.18   ?       ?      140.85  24.67  0.00    24.67  
1 1 1 -4  5   29 o 15 121.67  22.75  485.12    153.07   0.00     0.00     485.12    153.07   ?       ?      121.67  22.75  0.00    22.75  
1 1 1 -4  5   30 o 12 52.80   19.47  76.84     77.84    0.00     0.00     76.84     77.84    ?       ?      52.80   19.47  0.00    19.47  
1 1 1 -4  5   31 o 13 63.44   20.97  132.02    88.80    0.00     0.00     132.02    88.80    ?       ?      63.44   20.97  0.00    20.97  
1 1 1 -4  6   1  o 14 463.98  83.95  7731.52   2153.75  0.00     0.00     7731.52   2153.75  ?       ?      463.98  83.95  0.00    83.95  
1 1 1 -4  6   2  x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  6   3  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  6   4  o 19 408.36  71.03  5759.88   1604.64  0.00     0.00     5759.88   1604.64  ?       ?      408.36  71.03  0.00    71.03  
1 1 1 -4  6   5  o 2  220.38  33.90  1485.90   415.14   1485.90  415.14   0.00      0.00     220.38  33.90  ?       ?      0.00    33.90  
1 1 1 -4  6   6  x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  6   7  o 13 269.72  42.89  2301.48   641.93   2301.48  641.93   0.00      0.00     269.72  42.89  ?       ?      0.00    42.89  
1 1 1 -4  6   8  x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  6   9  o 19 385.56  43.93  4720.04   955.01   4075.99  1350.67  5363.94   1350.52  331.61  72.94  394.24  61.69  -62.63  95.53  
1 1 1 -4  6   10 o 1  77.48   9.42   175.62    41.06    181.10   63.62    171.70    53.75    77.75   14.79  76.02   12.77  1.73    19.54  
1 1 1 -4  6   11 o 19 363.25  41.13  4142.77   842.67   3731.42  1192.29  4553.33   1191.14  323.63  66.40  365.93  58.69  -42.30  88.62  
1 1 1 -4  6   12 o 8  167.55  14.89  820.24    141.71   640.77   251.28   903.95    171.60   143.64  31.35  175.45  17.26  -31.81  35.79  
1 1 1 -4  6   13 o 3  186.60  12.95  1011.03   137.83   1469.46  243.66   795.32    167.15   223.81  19.15  164.43  18.00  59.38   26.28  
1 1 1 -4  6   14 o 18 417.40  40.57  5324.16   959.96   0.00     0.00     5324.16   959.96   ?       ?      417.40  40.57  0.00    40.57  
1 1 1 -4  6   15 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  6   16 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  6   17 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  6   18 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  6   19 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  6   20 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  6   21 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  6   22 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  6   23 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  6   24 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  6   25 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  6   26 o 11 159.88  16.91  771.09    152.88   561.50   215.90   981.88    216.51   129.83  29.62  178.04  21.63  -48.21  36.68  
1 1 1 -4  6   27 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  6   28 o 7  63.55   12.67  123.72    44.61    101.18   64.79    144.03    61.52    57.29   17.82  67.74   16.06  -10.46  23.99  
1 1 1 -4  6   29 o 10 61.18   13.93  116.74    47.80    68.70    71.85    154.90    64.03    50.70   18.71  69.90   16.26  -19.20  24.79  
1 1 1 -4  6   30 o 8  90.93   13.44  254.83    68.02    252.15   102.12   256.96    91.20    86.66   20.79  88.78   18.50  -2.12   27.83  
1 1 1 -4  6   31 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  7   1  o 6  140.81  14.70  580.22    117.08   552.73   165.68   607.64    165.47   135.80  22.01  142.83  20.79  -7.03   30.27  
1 1 1 -4  7   2  f 0  332.31  35.45  3366.92   665.77   2954.95  941.49   3778.98   941.59   297.86  57.14  343.56  49.14  -45.69  75.36  
1 1 1 -4  7   3  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  7   4  o 8  202.72  31.17  1254.45   351.16   0.00     0.00     1254.45   351.16   ?       ?      202.72  31.17  0.00    31.17  
1 1 1 -4  7   5  o 16 214.83  33.25  1419.02   396.80   0.00     0.00     1419.02   396.80   ?       ?      214.83  33.25  0.00    33.25  
1 1 1 -4  7   6  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  7   7  o 17 94.98   10.70  263.61    57.31    234.10   82.14    291.60    80.00    88.28   16.82  99.28   14.46  -10.99  22.18  
1 1 1 -4  7   8  o 19 282.08  45.80  2565.65   716.32   2565.65  716.32   0.00      0.00     282.08  45.80  ?       ?      0.00    45.80  
1 1 1 -4  7   9  o 12 214.92  33.64  1428.09   401.45   1428.09  401.45   0.00      0.00     214.92  33.64  ?       ?      0.00    33.64  
1 1 1 -4  7   10 o 18 407.80  76.07  6153.42   1715.25  6153.42  1715.25  0.00      0.00     407.80  76.07  ?       ?      0.00    76.07  
1 1 1 -4  7   11 o 10 335.42  37.25  3461.82   705.15   3117.36  998.53   3804.49   995.94   303.21  59.49  341.22  52.53  -38.01  79.36  
1 1 1 -4  7   12 o 1  373.02  28.85  4147.65   613.07   4327.90  1064.65  4058.23   749.88   366.65  52.04  365.10  36.26  1.55    63.43  
1 1 1 -4  7   13 o 12 76.26   9.45   169.97    40.49    0.00     0.00     169.97    40.49    ?       ?      76.26   9.45   0.00    9.45   
1 1 1 -4  7   14 o 18 606.10  64.48  11931.26  2208.97  0.00     0.00     11931.26  2208.97  ?       ?      606.10  64.48  0.00    64.48  
1 1 1 -4  7   15 o 12 677.99  71.67  15200.45  2747.37  0.00     0.00     15200.45  2747.37  ?       ?      677.99  71.67  0.00    71.67  
1 1 1 -4  7   16 o 6  454.25  41.77  6276.65   1077.08  0.00     0.00     6276.65   1077.08  ?       ?      454.25  41.77  0.00    41.77  
1 1 1 -4  7   17 o 19 150.10  22.73  672.84    189.75   0.00     0.00     672.84    189.75   ?       ?      150.10  22.73  0.00    22.73  
1 1 1 -4  7   18 o 7  486.11  106.05 10327.14  2876.04  0.00     0.00     10327.14  2876.04  ?       ?      486.11  106.05 0.00    106.05 
1 1 1 -4  7   19 o 2  165.87  25.37  832.20    233.89   0.00     0.00     832.20    233.89   ?       ?      165.87  25.37  0.00    25.37  
1 1 1 -4  7   20 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  7   21 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  7   22 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  7   23 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  7   24 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  7   25 o 14 150.65  15.79  679.33    134.53   651.61   190.33   707.00    190.18   143.87  23.88  150.58  22.71  -6.71   32.95  
1 1 1 -4  7   26 o 14 116.25  19.17  420.17    123.45   420.17   123.45   0.00      0.00     116.25  19.17  ?       ?      0.00    19.17  
1 1 1 -4  7   27 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  7   28 o 2  119.25  13.15  429.37    88.56    309.19   125.96   546.86    124.54   96.20   23.10  132.88  16.69  -36.67  28.50  
1 1 1 -4  7   29 o 9  40.99   13.02  50.16     34.41    51.78    56.84    49.22     43.23    44.76   16.61  41.90   14.62  2.85    22.13  
1 1 1 -4  7   30 o 3  60.18   11.67  112.08    38.86    67.66    67.08    134.51    47.67    49.10   18.08  65.53   13.13  -16.43  22.34  
1 1 1 -4  8   1  o 3  204.45  21.31  1236.41   246.46   1137.40  348.74   1335.20   348.36   192.20  32.78  209.74  29.77  -17.54  44.28  
1 1 1 -4  8   2  x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  8   3  o 8  342.73  58.07  3951.99   1101.87  0.00     0.00     3951.99   1101.87  ?       ?      342.73  58.07  0.00    58.07  
1 1 1 -4  8   4  o 5  228.62  35.73  1620.54   453.63   1620.54  453.63   0.00      0.00     228.62  35.73  ?       ?      0.00    35.73  
1 1 1 -4  8   5  o 1  153.51  16.01  691.79    139.00   691.18   196.88   692.40    196.28   151.58  23.38  151.75  23.27  -0.17   32.99  
1 1 1 -4  8   6  o 3  509.81  144.03 15798.96  4400.13  0.00     0.00     15798.96  4400.13  ?       ?      509.81  144.03 0.00    144.03 
1 1 1 -4  8   7  o 10 186.32  28.65  1056.02   296.66   0.00     0.00     1056.02   296.66   ?       ?      186.32  28.65  0.00    28.65  
1 1 1 -4  8   8  o 9  250.10  39.43  1959.21   547.34   0.00     0.00     1959.21   547.34   ?       ?      250.10  39.43  0.00    39.43  
1 1 1 -4  8   9  o 14 419.27  47.20  5583.92   1116.32  5280.29  1579.15  5887.21   1578.27  381.86  74.71  409.12  69.70  -27.25  102.18 
1 1 1 -4  8   10 o 18 140.66  15.29  579.79    121.51   586.52   179.34   574.07    165.21   139.71  23.17  138.61  21.46  1.10    31.58  
1 1 1 -4  8   11 o 6  345.18  36.29  3615.56   708.46   3659.60  1004.42  3571.95   999.42   337.08  53.71  332.63  54.20  4.46    76.31  
1 1 1 -4  8   12 o 3  433.41  74.63  6426.45   1789.98  0.00     0.00     6426.45   1789.98  ?       ?      433.41  74.63  0.00    74.63  
1 1 1 -4  8   13 o 14 810.54  96.88  24071.73  4418.47  26422.13 6249.96  21723.30  6247.35  745.36  151.24 631.41  169.02 113.96  226.80 
1 1 1 -4  8   14 f 0  175.77  14.59  898.24    145.89   0.00     0.00     898.24    145.89   ?       ?      175.77  14.59  0.00    14.59  
1 1 1 -4  8   15 o 17 271.49  42.04  2273.68   634.12   0.00     0.00     2273.68   634.12   ?       ?      271.49  42.04  0.00    42.04  
1 1 1 -4  8   16 o 1  174.11  26.41  911.14    255.66   0.00     0.00     911.14    255.66   ?       ?      174.11  26.41  0.00    26.41  
1 1 1 -4  8   17 o 3  380.63  37.32  4457.84   805.10   0.00     0.00     4457.84   805.10   ?       ?      380.63  37.32  0.00    37.32  
1 1 1 -4  8   18 o 16 226.69  24.86  1538.25   318.23   0.00     0.00     1538.25   318.23   ?       ?      226.69  24.86  0.00    24.86  
1 1 1 -4  8   19 o 15 323.22  32.07  3177.35   587.27   0.00     0.00     3177.35   587.27   ?       ?      323.22  32.07  0.00    32.07  
1 1 1 -4  8   20 o 9  496.87  134.81 14123.30  3942.38  0.00     0.00     14123.30  3942.38  ?       ?      496.87  134.81 0.00    134.81 
1 1 1 -4  8   21 o 8  103.45  14.83  317.27    85.58    0.00     0.00     317.27    85.58    ?       ?      103.45  14.83  0.00    14.83  
1 1 1 -4  8   22 f 0  98.24   11.85  284.11    65.47    353.94   95.28    221.63    90.12    108.91  15.69  85.04   18.94  23.86   24.60  
1 1 1 -4  8   23 f 0  106.48  11.12  333.11    67.00    296.29   92.27    374.16    97.43    98.88   16.86  111.76  15.61  -12.88  22.98  
1 1 1 -4  8   24 o 3  87.63   11.03  227.12    54.25    249.40   74.72    202.27    78.91    90.89   14.83  80.97   17.49  9.93    22.93  
1 1 1 -4  8   25 o 13 61.65   10.95  114.25    37.32    120.62   51.32    107.10    54.38    62.60   14.56  58.92   15.77  3.68    21.46  
1 1 1 -4  8   26 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  8   27 o 11 55.10   15.61  94.64     51.63    94.64    51.63    0.00      0.00     55.10   15.61  ?       ?      0.00    15.61  
1 1 1 -4  8   28 o 19 78.02   10.48  182.79    45.74    138.30   63.97    229.32    65.41    65.72   16.87  86.35   13.65  -20.63  21.70  
1 1 1 -4  8   29 o 17 74.69   16.42  179.77    68.47    179.77   68.47    0.00      0.00     74.69   16.42  ?       ?      0.00    16.42  
1 1 1 -4  8   30 o 19 133.08  15.18  558.51    113.93   470.79   161.85   644.69    160.41   113.26  25.51  137.91  20.92  -24.66  32.99  
1 1 1 -4  9   1  o 1  253.70  39.80  2002.45   560.65   2002.45  560.65   0.00      0.00     253.70  39.80  ?       ?      0.00    39.80  
1 1 1 -4  9   2  x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  9   3  o 7  364.93  40.16  4116.95   827.44   3604.60  1170.18  4629.28   1170.16  323.27  65.31  375.34  56.02  -52.07  86.04  
1 1 1 -4  9   4  o 17 387.73  43.01  4690.25   941.25   4195.80  1331.37  5184.36   1330.90  345.58  69.52  393.10  60.95  -47.52  92.45  
1 1 1 -4  9   5  o 5  494.39  56.93  8015.29   1586.20  7835.25  2243.50  8195.25   2242.95  450.05  89.98  463.97  87.42  -13.92  125.45 
1 1 1 -4  9   6  o 4  141.53  15.12  586.64    120.95   600.35   173.95   573.80    168.30   141.65  22.11  138.47  21.90  3.18    31.12  
1 1 1 -4  9   7  o 8  474.55  53.59  7240.87   1434.50  7084.62  2029.27  7396.95   2028.12  438.11  83.74  450.63  81.39  -12.51  116.78 
1 1 1 -4  9   8  o 6  455.53  83.51  7549.33   2103.42  0.00     0.00     7549.33   2103.42  ?       ?      455.53  83.51  0.00    83.51  
1 1 1 -4  9   9  o 17 559.13  119.29 13327.67  3712.27  0.00     0.00     13327.67  3712.27  ?       ?      559.13  119.29 0.00    119.29 
1 1 1 -4  9   10 f 0  184.43  28.26  1021.23   289.65   0.00     0.00     1021.23   289.65   ?       ?      184.43  28.26  0.00    28.26  
1 1 1 -4  9   11 o 8  628.82  144.58 18346.89  5109.85  0.00     0.00     18346.89  5109.85  ?       ?      628.82  144.58 0.00    144.58 
1 1 1 -4  9   12 o 10 551.32  43.28  9228.22   1358.94  8136.08  2357.27  9771.85   1663.11  478.39  89.11  560.56  52.28  -82.17  103.32 
1 1 1 -4  9   13 o 19 222.86  21.90  1458.79   276.51   0.00     0.00     1458.79   276.51   ?       ?      222.86  21.90  0.00    21.90  
1 1 1 -4  9   14 o 4  495.70  48.43  7649.24   1360.55  0.00     0.00     7649.24   1360.55  ?       ?      495.70  48.43  0.00    48.43  
1 1 1 -4  9   15 o 7  190.42  29.10  1097.99   307.98   0.00     0.00     1097.99   307.98   ?       ?      190.42  29.10  0.00    29.10  
1 1 1 -4  9   16 o 17 312.06  51.65  3202.33   892.95   0.00     0.00     3202.33   892.95   ?       ?      312.06  51.65  0.00    51.65  
1 1 1 -4  9   17 o 10 215.77  33.80  1443.19   404.92   0.00     0.00     1443.19   404.92   ?       ?      215.77  33.80  0.00    33.80  
1 1 1 -4  9   18 o 4  212.07  33.21  1388.71   391.09   0.00     0.00     1388.71   391.09   ?       ?      212.07  33.21  0.00    33.21  
1 1 1 -4  9   19 o 4  497.45  34.53  7563.32   980.00   0.00     0.00     7563.32   980.00   ?       ?      497.45  34.53  0.00    34.53  
1 1 1 -4  9   20 o 12 202.92  23.44  1235.27   268.04   0.00     0.00     1235.27   268.04   ?       ?      202.92  23.44  0.00    23.44  
1 1 1 -4  9   21 o 14 118.21  37.23  450.65    281.96   0.00     0.00     450.65    281.96   ?       ?      118.21  37.23  0.00    37.23  
1 1 1 -4  9   22 o 17 220.98  25.52  1511.65   317.80   0.00     0.00     1511.65   317.80   ?       ?      220.98  25.52  0.00    25.52  
1 1 1 -4  9   23 o 14 66.66   10.38  132.16    38.43    154.37   50.67    102.11    58.94    71.60   12.80  57.97   16.76  13.63   21.09  
1 1 1 -4  9   24 o 18 106.95  16.85  349.49    100.05   360.31   104.29   224.52    354.46   108.45  17.34  95.30   39.52  13.14   43.16  
1 1 1 -4  9   25 o 13 131.44  21.62  549.58    157.50   549.58   157.50   0.00      0.00     131.44  21.62  ?       ?      0.00    21.62  
1 1 1 -4  9   26 o 9  107.76  19.88  371.26    118.45   0.00     0.00     371.26    118.45   ?       ?      107.76  19.88  0.00    19.88  
1 1 1 -4  9   27 o 2  140.13  14.27  598.84    113.18   535.41   164.24   656.21    156.18   126.43  23.49  143.30  19.49  -16.88  30.53  
1 1 1 -4  9   28 o 5  43.20   13.77  56.36     38.50    54.01    51.18    59.44     58.42    44.18   15.86  46.47   16.91  -2.29   23.19  
1 1 1 -4  9   29 o 8  137.98  26.74  702.94    204.12   702.94   204.12   0.00      0.00     137.98  26.74  ?       ?      0.00    26.74  
1 1 1 -4  10  1  o 4  585.30  121.67 14194.07  3954.53  14194.07 3954.53  0.00      0.00     585.30  121.67 ?       ?      0.00    121.67 
1 1 1 -4  10  2  x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  10  3  o 6  655.81  81.70  14942.27  3009.27  13251.87 4255.82  16632.54  4255.67  532.40  138.09 631.05  121.89 -98.65  184.19 
1 1 1 -4  10  4  o 16 531.92  60.18  9084.83   1805.52  8720.65  2553.76  9448.78   2553.00  485.50  95.03  511.40  90.26  -25.90  131.07 
1 1 1 -4  10  5  o 5  415.64  46.38  5326.93   1087.87  4536.04  1539.18  6116.38   1537.78  362.87  76.31  433.28  63.73  -70.41  99.42  
1 1 1 -4  10  6  o 1  462.89  80.64  7403.68   2065.11  7403.68  2065.11  0.00      0.00     462.89  80.64  ?       ?      0.00    80.64  
1 1 1 -4  10  7  o 18 229.44  23.49  1549.52   304.98   1660.59  435.51   1442.65   427.23   234.84  33.23  217.93  35.36  16.91   48.53  
1 1 1 -4  10  8  o 2  444.13  49.30  6095.66   1235.88  5523.83  1748.68  6666.34   1746.93  401.80  78.63  449.54  69.97  -47.75  105.25 
1 1 1 -4  10  9  o 2  207.04  31.75  1290.17   365.32   0.00     0.00     1290.17   365.32   ?       ?      207.04  31.75  0.00    31.75  
1 1 1 -4  10  10 o 14 702.77  56.13  15467.99  2245.52  16294.53 3891.81  15055.51  2749.32  656.33  106.97 675.71  71.98  -19.39  128.94 
1 1 1 -4  10  11 f 0  644.66  54.11  12998.01  1983.89  11184.83 3439.32  13902.14  2428.66  524.94  117.11 654.68  65.50  -129.74 134.18 
1 1 1 -4  10  12 o 6  297.94  46.82  2776.09   774.36   0.00     0.00     2776.09   774.36   ?       ?      297.94  46.82  0.00    46.82  
1 1 1 -4  10  13 o 9  132.77  23.79  531.51    174.63   0.00     0.00     531.51    174.63   ?       ?      132.77  23.79  0.00    23.79  
1 1 1 -4  10  14 o 17 173.60  28.56  917.13    274.77   0.00     0.00     917.13    274.77   ?       ?      173.60  28.56  0.00    28.56  
1 1 1 -4  10  15 o 17 489.78  123.73 12483.28  3479.39  0.00     0.00     12483.28  3479.39  ?       ?      489.78  123.73 0.00    123.73 
1 1 1 -4  10  16 o 3  120.64  15.40  429.41    104.20   0.00     0.00     429.41    104.20   ?       ?      120.64  15.40  0.00    15.40  
1 1 1 -4  10  17 o 18 230.59  25.73  1593.74   334.81   0.00     0.00     1593.74   334.81   ?       ?      230.59  25.73  0.00    25.73  
1 1 1 -4  10  18 o 1  360.72  26.69  3892.49   548.76   0.00     0.00     3892.49   548.76   ?       ?      360.72  26.69  0.00    26.69  
1 1 1 -4  10  19 o 6  301.65  31.49  2798.97   537.23   0.00     0.00     2798.97   537.23   ?       ?      301.65  31.49  0.00    31.49  
1 1 1 -4  10  20 o 9  67.41   16.72  138.62    64.40    0.00     0.00     138.62    64.40    ?       ?      67.41   16.72  0.00    16.72  
1 1 1 -4  10  21 o 8  156.50  25.71  767.20    222.94   0.00     0.00     767.20    222.94   ?       ?      156.50  25.71  0.00    25.71  
1 1 1 -4  10  22 o 10 104.18  19.02  334.30    109.56   0.00     0.00     334.30    109.56   ?       ?      104.18  19.02  0.00    19.02  
1 1 1 -4  10  23 o 4  110.45  20.48  381.99    125.09   0.00     0.00     381.99    125.09   ?       ?      110.45  20.48  0.00    20.48  
1 1 1 -4  10  24 o 15 53.56   17.82  84.28     64.12    0.00     0.00     84.28     64.12    ?       ?      53.56   17.82  0.00    17.82  
1 1 1 -4  10  25 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  10  26 o 5  60.27   17.98  115.49    66.93    0.00     0.00     115.49    66.93    ?       ?      60.27   17.98  0.00    17.98  
1 1 1 -4  10  27 o 7  121.13  22.91  498.12    153.47   0.00     0.00     498.12    153.47   ?       ?      121.13  22.91  0.00    22.91  
1 1 1 -4  10  28 o 8  77.58   20.44  206.52    92.27    0.00     0.00     206.52    92.27    ?       ?      77.58   20.44  0.00    20.44  
1 1 1 -4  10  29 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  11  1  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  11  2  o 3  392.96  42.33  4658.59   939.86   4212.14  1329.54  5104.54   1328.79  361.11  66.59  402.72  59.25  -41.62  89.13  
1 1 1 -4  11  3  o 9  296.44  46.10  2698.95   759.04   2698.95  759.04   0.00      0.00     296.44  46.10  ?       ?      0.00    46.10  
1 1 1 -4  11  4  o 1  654.41  137.33 17923.73  4994.18  17923.73 4994.18  0.00      0.00     654.41  137.33 ?       ?      0.00    137.33 
1 1 1 -4  11  5  o 6  574.83  107.78 12289.46  3425.90  12289.46 3425.90  0.00      0.00     574.83  107.78 ?       ?      0.00    107.78 
1 1 1 -4  11  6  o 1  158.77  27.45  757.15    241.16   757.15   241.16   0.00      0.00     158.77  27.45  ?       ?      0.00    27.45  
1 1 1 -4  11  7  o 12 586.87  114.97 13405.28  3734.61  0.00     0.00     13405.28  3734.61  ?       ?      586.87  114.97 0.00    114.97 
1 1 1 -4  11  8  o 11 501.23  89.62  8912.62   2484.14  0.00     0.00     8912.62   2484.14  ?       ?      501.23  89.62  0.00    89.62  
1 1 1 -4  11  9  o 6  285.22  33.76  2444.41   542.05   1613.45  774.72   3241.28   758.67   221.58  59.61  325.53  41.54  -103.95 72.66  
1 1 1 -4  11  10 o 19 185.61  15.75  1004.11   166.20   615.56   329.61   1136.60   192.46   140.63  39.31  197.29  17.16  -56.66  42.89  
1 1 1 -4  11  11 o 3  399.34  38.72  4881.49   876.62   5517.50  1250.02  4266.01   1229.68  413.31  53.97  356.37  62.38  56.94   82.49  
1 1 1 -4  11  12 o 10 166.78  14.85  812.45    140.74   293.01   340.36   919.58    154.57   108.29  40.56  177.43  15.33  -69.13  43.36  
1 1 1 -4  11  13 o 19 158.40  19.66  744.33    174.89   111.93   404.13   890.06    194.00   100.12  41.91  173.36  19.85  -73.23  46.37  
1 1 1 -4  11  14 o 12 355.93  24.34  3761.02   494.26   4883.62  891.96   3263.56   593.76   395.39  39.84  327.51  31.99  67.88   51.09  
1 1 1 -4  11  15 o 16 194.90  22.04  1129.31   242.29   0.00     0.00     1129.31   242.29   ?       ?      194.90  22.04  0.00    22.04  
1 1 1 -4  11  16 o 1  448.41  44.58  6386.24   1132.37  0.00     0.00     6386.24   1132.37  ?       ?      448.41  44.58  0.00    44.58  
1 1 1 -4  11  17 o 11 62.63   31.61  -1651.90  539.54   0.00     0.00     -1651.90  539.54   ?       ?      62.63   31.61  0.00    31.61  
1 1 1 -4  11  18 o 2  251.59  46.70  2133.71   649.59   0.00     0.00     2133.71   649.59   ?       ?      251.59  46.70  0.00    46.70  
1 1 1 -4  11  19 o 7  97.83   36.77  261.42    280.07   0.00     0.00     261.42    280.07   ?       ?      97.83   36.77  0.00    36.77  
1 1 1 -4  11  20 o 12 114.78  39.73  436.80    318.89   0.00     0.00     436.80    318.89   ?       ?      114.78  39.73  0.00    39.73  
1 1 1 -4  11  21 o 11 139.97  20.53  603.02    160.05   0.00     0.00     603.02    160.05   ?       ?      139.97  20.53  0.00    20.53  
1 1 1 -4  11  22 o 4  102.43  19.49  327.72    110.41   0.00     0.00     327.72    110.41   ?       ?      102.43  19.49  0.00    19.49  
1 1 1 -4  11  23 o 11 72.65   19.12  167.81    80.81    0.00     0.00     167.81    80.81    ?       ?      72.65   19.12  0.00    19.12  
1 1 1 -4  11  24 o 8  67.42   15.30  142.29    57.84    142.29   57.84    0.00      0.00     67.42   15.30  ?       ?      0.00    15.30  
1 1 1 -4  11  25 o 11 97.74   43.11  361.74    472.09   0.00     0.00     361.74    472.09   ?       ?      97.74   43.11  0.00    43.11  
1 1 1 -4  11  26 o 6  85.91   11.26  223.38    54.20    186.24   67.03    293.55    92.14    76.50   15.79  95.64   17.42  -19.15  23.51  
1 1 1 -4  11  27 o 4  115.68  13.75  415.32    89.51    395.39   119.02   441.26    135.80   108.70  19.80  113.45  21.64  -4.75   29.33  
1 1 1 -4  11  28 o 1  32.37   12.85  20.19     35.64    14.19    41.32    37.67     70.48    32.71   13.52  43.62   17.81  -10.92  22.36  
1 1 1 -4  12  1  o 8  338.13  53.74  3602.63   1008.32  0.00     0.00     3602.63   1008.32  ?       ?      338.13  53.74  0.00    53.74  
1 1 1 -4  12  2  o 6  307.16  48.31  2935.69   823.80   0.00     0.00     2935.69   823.80   ?       ?      307.16  48.31  0.00    48.31  
1 1 1 -4  12  3  o 1  625.46  139.40 17504.19  4877.07  0.00     0.00     17504.19  4877.07  ?       ?      625.46  139.40 0.00    139.40 
1 1 1 -4  12  4  o 18 245.57  27.59  1790.24   382.25   1601.70  555.02   1960.37   527.21   226.43  44.29  253.85  37.29  -27.42  57.89  
1 1 1 -4  12  5  o 1  310.24  49.57  3029.58   853.05   0.00     0.00     3029.58   853.05   ?       ?      310.24  49.57  0.00    49.57  
1 1 1 -4  12  6  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  12  7  o 15 318.31  52.04  3249.69   918.10   3249.69  918.10   0.00      0.00     318.31  52.04  ?       ?      0.00    52.04  
1 1 1 -4  12  8  o 1  458.58  87.53  7924.08   2220.26  7924.08  2220.26  0.00      0.00     458.58  87.53  ?       ?      0.00    87.53  
1 1 1 -4  12  9  o 18 164.06  22.38  802.66    205.27   545.94   342.40   946.69    256.46   132.54  40.91  177.36  25.96  -44.82  48.45  
1 1 1 -4  12  10 o 16 70.74   15.79  150.92    62.52    -617.24  306.74   184.22    63.86    55.51   27.32  78.48   14.71  -22.97  31.03  
1 1 1 -4  12  11 o 17 511.53  38.23  8071.23   1114.64  8979.27  1953.02  7632.57   1357.43  502.52  69.56  486.50  49.28  16.02   85.25  
1 1 1 -4  12  12 o 1  498.97  47.96  7975.20   1356.83  0.00     0.00     7975.20   1356.83  ?       ?      498.97  47.96  0.00    47.96  
1 1 1 -4  12  13 o 17 163.47  19.36  790.77    178.16   0.00     0.00     790.77    178.16   ?       ?      163.47  19.36  0.00    19.36  
1 1 1 -4  12  14 o 12 425.34  26.89  5394.02   653.12   8557.51  1190.61  4032.31   781.14   525.04  39.80  360.59  38.32  164.45  55.25  
1 1 1 -4  12  15 o 15 208.03  27.60  1312.28   321.46   0.00     0.00     1312.28   321.46   ?       ?      208.03  27.60  0.00    27.60  
1 1 1 -4  12  16 o 14 103.88  17.06  323.39    98.20    0.00     0.00     323.39    98.20    ?       ?      103.88  17.06  0.00    17.06  
1 1 1 -4  12  17 o 10 41.82   16.36  31.62     56.94    0.00     0.00     31.62     56.94    ?       ?      41.82   16.36  0.00    16.36  
1 1 1 -4  12  18 f 0  164.45  21.09  822.23    194.55   0.00     0.00     822.23    194.55   ?       ?      164.45  21.09  0.00    21.09  
1 1 1 -4  12  19 o 12 49.23   16.57  67.85     55.42    0.00     0.00     67.85     55.42    ?       ?      49.23   16.57  0.00    16.57  
1 1 1 -4  12  20 o 12 86.40   19.68  233.73    95.39    0.00     0.00     233.73    95.39    ?       ?      86.40   19.68  0.00    19.68  
1 1 1 -4  12  21 o 1  87.14   20.55  241.49    101.10   0.00     0.00     241.49    101.10   ?       ?      87.14   20.55  0.00    20.55  
1 1 1 -4  12  22 o 18 89.35   39.36  148.80    392.38   0.00     0.00     148.80    392.38   ?       ?      89.35   39.36  0.00    39.36  
1 1 1 -4  12  23 o 11 88.82   39.92  152.77    424.88   0.00     0.00     152.77    424.88   ?       ?      88.82   39.92  0.00    39.92  
1 1 1 -4  12  24 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  12  25 o 9  118.26  20.99  465.20    137.30   465.20   137.30   0.00      0.00     118.26  20.99  ?       ?      0.00    20.99  
1 1 1 -4  12  26 o 10 144.59  25.62  755.51    204.88   766.02   217.69   674.02    606.03   143.49  27.43  97.92   45.37  45.57   53.02  
1 1 1 -4  12  27 o 16 43.44   14.46  57.83     42.22    58.51    42.29    -138.44   720.37   43.64   14.47  75.91   38.08  -32.27  40.74  
1 1 1 -4  13  1  o 4  454.43  50.34  6529.92   1291.24  6617.26  1835.61  6444.36   1816.70  433.17  76.62  427.05  76.93  6.12    108.58 
1 1 1 -4  13  2  o 9  268.90  31.52  2178.32   477.30   1830.85  702.97   2475.53   650.14   236.51  53.08  282.40  41.33  -45.88  67.27  
1 1 1 -4  13  3  o 6  150.43  24.03  679.24    200.55   55.79    361.71   955.97    240.99   93.05   39.34  179.02  24.06  -85.97  46.11  
1 1 1 -4  13  4  o 19 253.39  41.42  2008.00   581.78   0.00     0.00     2008.00   581.78   ?       ?      253.39  41.42  0.00    41.42  
1 1 1 -4  13  5  x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  13  6  o 8  545.98  150.15 17405.58  4852.11  0.00     0.00     17405.58  4852.11  ?       ?      545.98  150.15 0.00    150.15 
1 1 1 -4  13  7  o 1  385.95  44.59  4681.53   969.72   4399.92  1399.87  4941.33   1344.59  351.32  71.84  380.57  63.80  -29.25  96.08  
1 1 1 -4  13  8  o 14 442.69  85.12  7435.33   2084.66  0.00     0.00     7435.33   2084.66  ?       ?      442.69  85.12  0.00    85.12  
1 1 1 -4  13  9  o 3  391.17  35.04  4652.81   778.51   3259.84  1380.83  5301.94   942.61   293.39  79.86  414.23  40.14  -120.84 89.38  
1 1 1 -4  13  10 o 1  100.79  20.82  307.55    116.46   0.00     0.00     307.55    116.46   ?       ?      100.79  20.82  0.00    20.82  
1 1 1 -4  13  11 o 1  455.33  24.19  6124.17   629.94   12412.33 1001.55  2008.52   810.27   646.48  27.05  242.09  58.88  404.39  64.79  
1 1 1 -4  13  12 o 8  149.79  30.08  693.58    249.69   -2234.87 649.57   1201.27   270.47   65.67   33.32  200.49  23.97  -134.82 41.05  
1 1 1 -4  13  13 o 6  196.60  22.41  1153.60   248.39   0.00     0.00     1153.60   248.39   ?       ?      196.60  22.41  0.00    22.41  
1 1 1 -4  13  14 o 3  154.75  18.21  711.50    158.70   550.06   464.43   732.85    168.87   133.02  47.78  156.80  19.16  -23.78  51.48  
1 1 1 -4  13  15 o 11 153.53  24.96  725.97    212.40   0.00     0.00     725.97    212.40   ?       ?      153.53  24.96  0.00    24.96  
1 1 1 -4  13  16 o 2  245.88  25.76  1863.18   358.21   0.00     0.00     1863.18   358.21   ?       ?      245.88  25.76  0.00    25.76  
1 1 1 -4  13  17 o 18 195.87  23.75  1183.98   261.60   0.00     0.00     1183.98   261.60   ?       ?      195.87  23.75  0.00    23.75  
1 1 1 -4  13  18 o 2  166.96  22.37  863.25    208.98   0.00     0.00     863.25    208.98   ?       ?      166.96  22.37  0.00    22.37  
1 1 1 -4  13  19 o 18 178.87  24.26  1012.66   242.70   0.00     0.00     1012.66   242.70   ?       ?      178.87  24.26  0.00    24.26  
1 1 1 -4  13  20 o 15 120.38  20.53  457.04    136.77   0.00     0.00     457.04    136.77   ?       ?      120.38  20.53  0.00    20.53  
1 1 1 -4  13  21 o 2  125.49  21.90  508.09    152.00   0.00     0.00     508.09    152.00   ?       ?      125.49  21.90  0.00    21.90  
1 1 1 -4  13  22 o 12 100.98  21.13  333.60    118.55   0.00     0.00     333.60    118.55   ?       ?      100.98  21.13  0.00    21.13  
1 1 1 -4  13  23 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  13  24 o 10 48.55   20.00  42.24     89.89    0.00     0.00     42.24     89.89    ?       ?      48.55   20.00  0.00    20.00  
1 1 1 -4  13  25 o 5  77.60   22.42  214.17    105.43   0.00     0.00     214.17    105.43   ?       ?      77.60   22.42  0.00    22.42  
1 1 1 -4  13  26 f 0  37.97   13.96  38.75     39.97    46.63    44.50    5.78      90.98    40.73   14.77  43.14   18.98  -2.41   24.05  
1 1 1 -4  14  1  o 2  653.47  68.06  14254.38  2515.81  18520.45 3573.44  10061.74  3542.55  711.46  89.47  464.09  128.55 247.37  156.62 
1 1 1 -4  14  2  o 9  275.96  46.13  2395.37   705.07   0.00     0.00     2395.37   705.07   ?       ?      275.96  46.13  0.00    46.13  
1 1 1 -4  14  3  o 19 282.34  46.93  2517.11   733.97   0.00     0.00     2517.11   733.97   ?       ?      282.34  46.93  0.00    46.93  
1 1 1 -4  14  4  f 0  537.09  119.15 12720.19  3577.63  12720.19 3577.63  0.00      0.00     537.09  119.15 ?       ?      0.00    119.15 
1 1 1 -4  14  5  o 3  478.96  39.40  7013.52   1073.88  12014.20 1553.67  2439.01   1485.99  623.40  43.69  253.42  85.83  369.99  96.31  
1 1 1 -4  14  6  f 0  208.75  38.97  1361.89   449.84   0.00     0.00     1361.89   449.84   ?       ?      208.75  38.97  0.00    38.97  
1 1 1 -4  14  7  o 12 296.12  51.45  2850.26   842.81   0.00     0.00     2850.26   842.81   ?       ?      296.12  51.45  0.00    51.45  
1 1 1 -4  14  8  o 18 180.65  39.08  1034.08   393.48   0.00     0.00     1034.08   393.48   ?       ?      180.65  39.08  0.00    39.08  
1 1 1 -4  14  9  x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  14  10 o 6  133.09  38.20  566.33    307.14   0.00     0.00     566.33    307.14   ?       ?      133.09  38.20  0.00    38.20  
1 1 1 -4  14  11 o 17 163.34  19.34  794.47    177.84   657.37   651.28   805.51    184.86   146.25  55.81  164.28  20.01  -18.03  59.29  
1 1 1 -4  14  12 o 18 115.46  17.55  399.73    112.67   554.30   541.10   392.72    115.19   134.33  50.96  114.25  18.17  20.08   54.11  
1 1 1 -4  14  13 o 5  93.25   19.63  266.92    101.76   0.00     0.00     266.92    101.76   ?       ?      93.25   19.63  0.00    19.63  
1 1 1 -4  14  14 o 15 123.00  20.57  463.08    140.14   558.39   477.85   454.11    146.58   129.16  48.13  121.32  21.85  7.85    52.86  
1 1 1 -4  14  15 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  14  16 o 7  160.04  26.70  816.73    236.67   0.00     0.00     816.73    236.67   ?       ?      160.04  26.70  0.00    26.70  
1 1 1 -4  14  17 o 3  122.47  21.53  470.42    145.85   0.00     0.00     470.42    145.85   ?       ?      122.47  21.53  0.00    21.53  
1 1 1 -4  14  18 o 13 35.38   15.57  -12.51    61.33    0.00     0.00     -12.51    61.33    ?       ?      35.38   15.57  0.00    15.57  
1 1 1 -4  14  19 o 3  41.79   17.02  25.51     64.19    0.00     0.00     25.51     64.19    ?       ?      41.79   17.02  0.00    17.02  
1 1 1 -4  14  20 o 5  140.25  22.29  638.68    173.47   0.00     0.00     638.68    173.47   ?       ?      140.25  22.29  0.00    22.29  
1 1 1 -4  14  21 o 6  90.83   21.90  275.37    112.84   0.00     0.00     275.37    112.84   ?       ?      90.83   21.90  0.00    21.90  
1 1 1 -4  14  22 o 7  46.29   19.21  31.99     83.85    0.00     0.00     31.99     83.85    ?       ?      46.29   19.21  0.00    19.21  
1 1 1 -4  14  23 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  14  24 f 0  83.25   21.91  246.53    106.12   0.00     0.00     246.53    106.12   ?       ?      83.25   21.91  0.00    21.91  
1 1 1 -4  14  25 o 4  50.88   20.88  61.10     97.61    0.00     0.00     61.10     97.61    ?       ?      50.88   20.88  0.00    20.88  
1 1 1 -4  15  1  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  15  2  f 0  215.65  30.55  1423.44   367.69   866.53   579.16   1799.48   475.90   161.88  53.56  240.48  35.54  -78.59  64.28  
1 1 1 -4  15  3  o 11 233.25  31.55  1669.48   411.66   1236.30  648.52   1961.82   532.76   189.00  55.88  249.51  38.43  -60.51  67.81  
1 1 1 -4  15  4  o 5  190.95  29.34  1118.15   311.37   727.10   533.81   1319.80   383.33   150.09  51.43  205.88  33.59  -55.79  61.43  
1 1 1 -4  15  5  o 12 71.99   30.10  45.40     208.08   0.00     0.00     45.40     208.08   ?       ?      71.99   30.10  0.00    30.10  
1 1 1 -4  15  6  f 0  200.05  19.77  1187.32   224.10   767.98   541.73   1273.90   246.15   152.00  51.82  206.85  21.02  -54.85  55.92  
1 1 1 -4  15  7  o 9  177.81  18.40  937.40    185.06   616.73   488.52   991.13    199.96   138.67  49.09  182.57  19.37  -43.90  52.78  
1 1 1 -4  15  8  o 8  219.10  21.68  1437.76   269.14   0.00     0.00     1437.76   269.14   ?       ?      219.10  21.68  0.00    21.68  
1 1 1 -4  15  9  o 3  253.28  25.03  1950.03   359.23   0.00     0.00     1950.03   359.23   ?       ?      253.28  25.03  0.00    25.03  
1 1 1 -4  15  10 o 3  115.15  18.83  401.62    120.15   0.00     0.00     401.62    120.15   ?       ?      115.15  18.83  0.00    18.83  
1 1 1 -4  15  11 o 18 252.78  26.62  1974.97   380.43   0.00     0.00     1974.97   380.43   ?       ?      252.78  26.62  0.00    26.62  
1 1 1 -4  15  12 o 5  146.16  37.00  725.10    310.69   0.00     0.00     725.10    310.69   ?       ?      146.16  37.00  0.00    37.00  
1 1 1 -4  15  13 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  15  14 o 17 97.07   36.12  287.73    268.95   0.00     0.00     287.73    268.95   ?       ?      97.07   36.12  0.00    36.12  
1 1 1 -4  15  15 o 18 112.74  37.39  450.03    282.11   0.00     0.00     450.03    282.11   ?       ?      112.74  37.39  0.00    37.39  
1 1 1 -4  15  16 o 3  77.87   33.81  69.53     280.73   0.00     0.00     69.53     280.73   ?       ?      77.87   33.81  0.00    33.81  
1 1 1 -4  15  17 o 13 73.13   18.34  169.75    76.87    0.00     0.00     169.75    76.87    ?       ?      73.13   18.34  0.00    18.34  
1 1 1 -4  15  18 o 16 76.60   18.33  187.44    79.53    0.00     0.00     187.44    79.53    ?       ?      76.60   18.33  0.00    18.33  
1 1 1 -4  15  19 o 3  104.37  21.04  356.27    121.68   0.00     0.00     356.27    121.68   ?       ?      104.37  21.04  0.00    21.04  
1 1 1 -4  15  20 o 6  91.16   20.44  275.01    104.33   0.00     0.00     275.01    104.33   ?       ?      91.16   20.44  0.00    20.44  
1 1 1 -4  15  21 o 5  124.54  24.64  543.00    169.88   0.00     0.00     543.00    169.88   ?       ?      124.54  24.64  0.00    24.64  
1 1 1 -4  15  22 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  15  23 o 16 76.39   22.35  211.34    104.22   0.00     0.00     211.34    104.22   ?       ?      76.39   22.35  0.00    22.35  
1 1 1 -4  16  1  o 5  228.16  31.33  1625.10   399.51   1324.36  632.56   1824.67   515.28   190.71  54.85  236.87  39.27  -46.16  67.46  
1 1 1 -4  16  2  o 19 174.30  50.00  1073.41   526.24   1073.41  526.24   0.00      0.00     174.30  50.00  ?       ?      0.00    50.00  
1 1 1 -4  16  3  x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  16  4  o 7  141.67  49.83  679.85    502.65   679.85   502.65   0.00      0.00     141.67  49.83  ?       ?      0.00    49.83  
1 1 1 -4  16  5  o 2  102.25  16.50  314.13    93.54    0.17     483.61   326.33    95.34    98.03   43.41  104.26  16.48  -6.24   46.43  
1 1 1 -4  16  6  o 4  356.97  31.98  4011.06   648.49   3025.47  1181.44  4436.05   775.81   258.26  75.17  370.16  37.01  -111.90 83.78  
1 1 1 -4  16  7  o 19 126.07  18.53  479.79    130.10   0.00     0.00     479.79    130.10   ?       ?      126.07  18.53  0.00    18.53  
1 1 1 -4  16  8  o 19 307.06  62.06  3783.61   1056.34  0.00     0.00     3783.61   1056.34  ?       ?      307.06  62.06  0.00    62.06  
1 1 1 -4  16  9  o 1  181.40  21.28  1002.38   217.39   668.02   691.74   1039.02   229.00   138.04  55.99  184.32  22.08  -46.28  60.19  
1 1 1 -4  16  10 o 7  88.12   19.22  240.86    94.49    148.24   696.12   242.60    95.37    113.49  51.04  88.41   19.33  25.08   54.58  
1 1 1 -4  16  11 f 0  162.36  20.68  809.63    188.37   0.00     0.00     809.63    188.37   ?       ?      162.36  20.68  0.00    20.68  
1 1 1 -4  16  12 o 5  143.86  19.30  635.44    155.34   884.55   647.54   620.23    160.01   142.02  55.27  141.65  20.25  0.37    58.86  
1 1 1 -4  16  13 o 9  76.36   18.44  183.18    79.91    -261.50  667.07   189.66    80.49    93.67   44.67  77.73   18.34  15.94   48.29  
1 1 1 -4  16  14 o 17 260.54  28.27  2245.33   416.00   1757.73  893.69   2380.21   470.03   167.33  64.98  264.08  31.63  -96.75  72.27  
1 1 1 -4  16  15 o 16 115.91  19.91  425.08    127.68   0.00     0.00     425.08    127.68   ?       ?      115.91  19.91  0.00    19.91  
1 1 1 -4  16  16 o 12 86.58   36.49  203.23    309.53   0.00     0.00     203.23    309.53   ?       ?      86.58   36.49  0.00    36.49  
1 1 1 -4  16  17 o 19 80.10   36.62  45.20     376.43   0.00     0.00     45.20     376.43   ?       ?      80.10   36.62  0.00    36.62  
1 1 1 -4  16  18 o 13 122.33  48.13  836.28    495.75   0.00     0.00     836.28    495.75   ?       ?      122.33  48.13  0.00    48.13  
1 1 1 -4  16  19 o 2  100.93  44.41  541.95    498.22   0.00     0.00     541.95    498.22   ?       ?      100.93  44.41  0.00    44.41  
1 1 1 -4  16  20 o 3  81.18   25.14  241.37    129.18   0.00     0.00     241.37    129.18   ?       ?      81.18   25.14  0.00    25.14  
1 1 1 -4  16  21 o 5  85.07   40.66  352.11    558.81   0.00     0.00     352.11    558.81   ?       ?      85.07   40.66  0.00    40.66  
1 1 1 -4  17  1  o 17 142.14  35.23  678.09    285.97   0.00     0.00     678.09    285.97   ?       ?      142.14  35.23  0.00    35.23  
1 1 1 -4  17  2  o 8  166.38  37.52  941.00    349.80   0.00     0.00     941.00    349.80   ?       ?      166.38  37.52  0.00    37.52  
1 1 1 -4  17  3  o 8  123.37  35.19  513.01    261.42   0.00     0.00     513.01    261.42   ?       ?      123.37  35.19  0.00    35.19  
1 1 1 -4  17  4  o 14 82.30   17.64  208.45    80.85    -2.30    556.73   212.99    81.72    100.35  45.34  83.21   17.65  17.14   48.66  
1 1 1 -4  17  5  o 3  298.66  27.00  2800.11   457.85   2158.64  911.13   3016.80   529.57   213.46  66.88  306.55  30.50  -93.09  73.50  
1 1 1 -4  17  6  o 7  131.67  21.41  537.37    156.27   362.31   578.64   551.14    162.30   116.44  49.52  133.12  22.01  -16.68  54.19  
1 1 1 -4  17  7  o 10 169.12  24.97  903.30    235.14   1068.33  628.95   876.48    253.53   156.91  55.69  164.84  27.78  -7.93   62.23  
1 1 1 -4  17  8  o 16 187.42  29.10  1146.47   302.93   1179.08  810.67   1141.18   326.58   154.89  61.36  184.79  31.94  -29.91  69.18  
1 1 1 -4  17  9  o 4  186.92  24.34  1106.51   254.96   0.00     0.00     1106.51   254.96   ?       ?      186.92  24.34  0.00    24.34  
1 1 1 -4  17  10 o 6  169.28  20.95  891.91    199.27   1488.08  885.05   860.07    204.52   160.57  63.95  165.51  22.08  -4.94   67.66  
1 1 1 -4  17  11 o 14 189.91  21.66  1131.70   231.94   1086.36  807.89   1135.77   242.13   141.37  59.22  189.48  22.71  -48.11  63.43  
1 1 1 -4  17  12 o 12 60.61   18.63  113.66    71.06    199.44   787.52   112.96    71.35    107.33  50.38  60.46   18.68  46.87   53.73  
1 1 1 -4  17  13 o 15 100.34  20.48  323.38    113.99   0.00     0.00     323.38    113.99   ?       ?      100.34  20.48  0.00    20.48  
1 1 1 -4  17  14 o 5  61.76   19.48  119.69    77.18    84.50    791.38   120.03    77.55    99.41   47.74  61.85   19.53  37.56   51.58  
1 1 1 -4  17  15 o 14 88.86   37.50  253.53    327.59   0.00     0.00     253.53    327.59   ?       ?      88.86   37.50  0.00    37.50  
1 1 1 -4  17  16 o 12 108.76  21.12  391.27    127.08   0.00     0.00     391.27    127.08   ?       ?      108.76  21.12  0.00    21.12  
1 1 1 -4  17  17 o 1  45.04   19.33  15.42     89.60    0.00     0.00     15.42     89.60    ?       ?      45.04   19.33  0.00    19.33  
1 1 1 -4  17  18 o 1  116.91  24.68  488.98    160.44   0.00     0.00     488.98    160.44   ?       ?      116.91  24.68  0.00    24.68  
1 1 1 -4  17  19 o 18 108.10  25.45  433.25    155.29   0.00     0.00     433.25    155.29   ?       ?      108.10  25.45  0.00    25.45  
1 1 1 -4  18  1  o 4  74.49   30.88  92.31     216.25   272.28   604.06   65.85     231.60   111.82  49.06  74.03   31.40  37.80   58.24  
1 1 1 -4  18  2  o 8  86.97   33.40  209.34    234.18   403.33   620.90   177.17    252.85   117.83  50.72  85.33   34.12  32.49   61.13  
1 1 1 -4  18  3  o 15 171.06  20.71  902.02    199.23   0.00     0.00     902.02    199.23   ?       ?      171.06  20.71  0.00    20.71  
1 1 1 -4  18  4  o 16 156.07  39.39  888.56    352.86   0.00     0.00     888.56    352.86   ?       ?      156.07  39.39  0.00    39.39  
1 1 1 -4  18  5  o 1  224.29  51.58  2076.76   650.31   0.00     0.00     2076.76   650.31   ?       ?      224.29  51.58  0.00    51.58  
1 1 1 -4  18  6  o 19 148.38  43.36  862.61    392.46   0.00     0.00     862.61    392.46   ?       ?      148.38  43.36  0.00    43.36  
1 1 1 -4  18  7  f 0  54.26   18.58  84.26     69.68    478.21   860.51   81.66     69.91    119.92  55.02  53.74   18.60  66.19   58.08  
1 1 1 -4  18  8  f 0  62.42   19.49  120.27    77.45    0.00     0.00     120.27    77.45    ?       ?      62.42   19.49  0.00    19.49  
1 1 1 -4  18  9  f 0  102.33  19.83  332.37    112.26   268.92   1008.06  333.17    112.96   112.81  54.10  102.40  19.93  10.41   57.65  
1 1 1 -4  18  10 o 14 107.75  21.81  376.49    130.30   516.92   1055.16  374.31    131.30   115.59  55.41  107.30  22.05  8.29    59.64  
1 1 1 -4  18  11 o 14 114.48  21.37  424.77    135.28   0.00     0.00     424.77    135.28   ?       ?      114.48  21.37  0.00    21.37  
1 1 1 -4  18  12 o 13 66.93   19.71  144.64    80.84    0.00     0.00     144.64    80.84    ?       ?      66.93   19.71  0.00    19.71  
1 1 1 -4  18  13 o 4  173.47  23.54  1004.48   228.39   1217.15  949.75   991.43    235.29   119.60  55.88  171.23  24.65  -51.63  61.07  
1 1 1 -4  18  14 o 1  114.22  20.90  432.47    131.97   -548.85  943.07   452.07    133.28   85.28   42.89  117.06  20.59  -31.78  47.57  
1 1 1 -4  18  15 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -4  18  16 o 17 74.35   21.27  191.08    95.34    0.00     0.00     191.08    95.34    ?       ?      74.35   21.27  0.00    21.27  
1 1 1 -4  19  1  o 12 129.54  37.78  630.06    298.24   768.85   783.59   606.55    322.52   127.83  55.98  125.51  39.85  2.32    68.72  
1 1 1 -4  19  2  o 3  76.08   17.84  182.31    76.54    234.87   771.10   181.79    76.92    108.96  50.72  75.95   17.93  33.02   53.80  
1 1 1 -4  19  3  o 14 47.12   16.30  61.97     53.69    269.02   774.03   60.97     53.82    109.14  50.81  46.90   16.32  62.24   53.37  
1 1 1 -4  19  4  o 16 48.52   16.64  66.79     55.92    -322.04  765.67   68.88     56.07    93.49   45.39  49.03   16.67  44.45   48.36  
1 1 1 -4  19  5  o 1  134.43  19.19  566.57    143.92   788.48   756.15   558.23    146.60   123.52  54.51  133.08  19.79  -9.56   57.99  
1 1 1 -4  19  6  o 9  106.02  19.43  357.40    113.87   0.00     0.00     357.40    113.87   ?       ?      106.02  19.43  0.00    19.43  
1 1 1 -4  19  7  o 8  159.48  29.55  889.65    260.53   0.00     0.00     889.65    260.53   ?       ?      159.48  29.55  0.00    29.55  
1 1 1 -4  19  8  o 2  125.81  46.22  766.78    437.98   0.00     0.00     766.78    437.98   ?       ?      125.81  46.22  0.00    46.22  
1 1 1 -4  19  9  o 12 164.04  52.12  1447.53   551.59   0.00     0.00     1447.53   551.59   ?       ?      164.04  52.12  0.00    52.12  
1 1 1 -4  19  10 o 13 92.05   40.39  296.36    409.52   0.00     0.00     296.36    409.52   ?       ?      92.05   40.39  0.00    40.39  
1 1 1 -4  19  11 o 18 33.11   15.21  -38.41    65.91    174.03   1071.08  -39.22    66.04    96.88   48.27  33.06   15.20  63.82   50.60  
1 1 1 -4  19  12 o 16 50.95   18.63  73.26     71.04    -1132.77 1171.10  77.72     71.17    84.02   42.83  51.84   18.69  32.18   46.73  
1 1 1 -3  -19 1  o 13 134.39  25.53  578.34    189.75   578.34   189.75   0.00      0.00     134.39  25.53  ?       ?      0.00    25.53  
1 1 1 -3  -19 2  o 10 94.15   23.28  283.07    125.12   283.07   125.12   0.00      0.00     94.15   23.28  ?       ?      0.00    23.28  
1 1 1 -3  -19 3  o 7  260.41  35.52  2296.69   517.16   2143.46  556.03   3279.16   1407.94  245.77  40.84  217.09  82.25  28.68   91.83  
1 1 1 -3  -19 4  o 4  167.56  41.76  1023.93   400.23   986.91   418.66   1416.84   1363.93  162.50  43.87  157.56  71.10  4.94    83.54  
1 1 1 -3  -18 1  o 1  199.45  21.38  1207.44   241.03   1142.37  330.18   1281.67   352.67   188.13  31.70  199.35  31.89  -11.22  44.96  
1 1 1 -3  -18 2  o 2  99.86   14.18  297.59    79.03    309.55   122.48   289.05    103.44   99.61   22.01  96.96   19.26  2.65    29.25  
1 1 1 -3  -18 3  o 5  200.85  29.73  1282.73   332.40   1284.17  349.66   1269.17   1071.38  199.80  31.53  167.82  69.06  31.98   75.92  
1 1 1 -3  -18 4  o 9  166.22  27.59  873.23    254.04   838.82   261.43   1455.97   1075.83  162.00  29.19  175.02  70.24  -13.03  76.06  
1 1 1 -3  -18 5  o 18 146.94  25.63  678.18    208.33   733.85   211.98   -897.00   1127.58  153.31  24.94  111.52  54.36  41.79   59.81  
1 1 1 -3  -18 6  o 5  61.30   22.06  99.18     99.07    95.92    99.44    536.35    1152.50  60.80   22.07  141.88  64.55  -81.07  68.22  
1 1 1 -3  -18 7  o 4  234.70  38.41  1870.31   499.60   1895.55  535.89   1702.63   1381.08  233.37  41.52  174.32  75.35  59.05   86.03  
1 1 1 -3  -18 8  o 11 165.69  25.55  862.56    235.22   815.67   238.40   2585.15   1445.06  160.34  26.85  200.34  81.05  -39.99  85.38  
1 1 1 -3  -18 9  o 7  137.42  24.34  593.02    184.99   584.24   186.37   1178.77   1522.46  136.19  24.75  158.54  72.90  -22.35  76.99  
1 1 1 -3  -17 1  o 19 193.37  20.90  1122.24   228.32   1001.89  310.41   1264.11   337.02   177.79  31.57  200.94  30.15  -23.15  43.65  
1 1 1 -3  -17 2  o 4  237.89  23.55  1711.56   317.34   1695.06  421.05   1733.25   482.86   231.58  32.57  230.75  37.76  0.83    49.86  
1 1 1 -3  -17 3  o 15 157.36  13.64  726.79    122.00   725.92   123.34   766.17    830.84   157.23  13.80  152.02  61.47  5.21    63.00  
1 1 1 -3  -17 4  o 14 177.59  28.60  985.68    281.69   1036.21  296.17   506.46    912.11   181.77  29.38  142.81  61.48  38.97   68.14  
1 1 1 -3  -17 5  o 8  86.17   23.28  230.41    117.85   225.91   118.84   495.38    911.54   85.36   23.51  142.06  61.31  -56.70  65.66  
1 1 1 -3  -17 6  o 15 132.37  22.81  538.24    167.05   564.98   169.60   -331.46   967.38   135.78  22.55  118.86  55.81  16.91   60.19  
1 1 1 -3  -17 7  o 18 144.80  51.46  737.45    537.29   852.22   635.46   449.67    1006.28  152.95  55.76  142.21  62.82  10.74   83.99  
1 1 1 -3  -17 8  o 2  141.40  22.94  614.39    179.81   598.77   182.03   1242.64   1154.29  139.29  23.61  171.57  71.25  -32.27  75.06  
1 1 1 -3  -17 9  o 19 177.67  29.55  1000.70   290.78   1000.70  290.78   0.00      0.00     177.67  29.55  ?       ?      0.00    29.55  
1 1 1 -3  -17 10 o 15 79.85   20.67  197.91    95.45    197.91   95.45    0.00      0.00     79.85   20.67  ?       ?      0.00    20.67  
1 1 1 -3  -17 11 o 9  57.22   19.42  92.00     76.05    90.72    76.17    487.67    1343.99  56.97   19.43  145.34  67.42  -88.37  70.16  
1 1 1 -3  -17 12 o 16 162.26  26.64  830.22    239.53   819.96   242.83   1200.93   1459.51  160.90  27.26  162.21  73.34  -1.31   78.24  
1 1 1 -3  -16 1  o 17 354.40  30.86  3823.85   621.53   3998.03  779.20   3519.17   1030.53  356.80  38.66  317.86  58.63  38.94   70.23  
1 1 1 -3  -16 2  o 10 172.04  16.81  871.14    163.91   1022.51  226.79   705.61    237.17   185.08  21.76  151.17  28.37  33.90   35.76  
1 1 1 -3  -16 3  o 10 236.90  31.23  1726.53   414.32   1649.83  475.22   1969.59   845.93   228.21  37.58  232.40  62.19  -4.19   72.66  
1 1 1 -3  -16 4  o 17 91.72   19.40  255.85    98.96    182.29   147.85   315.53    133.18   80.12   27.07  101.25  23.38  -21.13  35.77  
1 1 1 -3  -16 5  o 18 228.66  27.43  1591.18   352.85   1664.22  384.52   1201.75   887.89   232.96  29.41  181.37  65.94  51.59   72.20  
1 1 1 -3  -16 6  f 0  66.41   21.23  128.30    91.42    131.79   92.03    -130.42   792.60   67.13   21.28  118.03  53.64  -50.89  57.70  
1 1 1 -3  -16 7  o 3  42.92   18.55  -7.23     83.70    -10.77   84.06    404.22    906.72   42.58   18.50  142.15  61.25  -99.57  63.98  
1 1 1 -3  -16 8  o 6  134.88  21.86  552.78    163.44   546.28   165.67   789.14    998.56   133.91  22.34  159.14  66.19  -25.24  69.86  
1 1 1 -3  -16 9  f 0  235.39  28.54  1709.12   377.83   1557.08  400.43   2943.58   1141.00  222.44  32.30  264.78  72.81  -42.33  79.65  
1 1 1 -3  -16 10 o 8  143.95  22.07  630.39    176.58   648.44   178.75   -100.15   1137.14  146.06  22.00  133.82  62.06  12.24   65.84  
1 1 1 -3  -16 11 o 17 105.56  19.65  339.87    114.68   339.87   114.68   0.00      0.00     105.56  19.65  ?       ?      0.00    19.65  
1 1 1 -3  -16 12 o 7  83.24   19.33  213.31    90.57    216.75   90.82    -424.61   1235.95  83.93   19.26  128.31  61.08  -44.39  64.05  
1 1 1 -3  -16 13 o 4  95.34   19.31  279.19    102.04   279.19   102.04   0.00      0.00     95.34   19.31  ?       ?      0.00    19.31  
1 1 1 -3  -16 14 o 4  77.68   19.04  186.54    84.26    186.54   84.26    0.00      0.00     77.68   19.04  ?       ?      0.00    19.04  
1 1 1 -3  -15 1  o 16 457.03  43.08  6470.23   1117.04  6266.52  1378.81  6859.30   1905.51  439.12  55.97  436.29  78.99  2.83    96.81  
1 1 1 -3  -15 2  x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  -15 3  o 11 25.43   12.27  -83.86    53.64    0.00     0.00     -83.86    53.64    ?       ?      25.43   12.27  0.00    12.27  
1 1 1 -3  -15 4  o 8  320.44  45.17  3261.69   807.84   2343.27  1213.04  3993.63   1082.91  248.76  77.04  346.40  56.40  -97.64  95.48  
1 1 1 -3  -15 5  o 15 259.76  58.10  2307.25   844.59   2307.25  844.59   0.00      0.00     259.76  58.10  ?       ?      0.00    58.10  
1 1 1 -3  -15 6  o 19 204.50  55.19  1426.72   662.89   1426.72  662.89   0.00      0.00     204.50  55.19  ?       ?      0.00    55.19  
1 1 1 -3  -15 7  o 1  346.56  41.02  3780.36   800.32   3622.24  1020.88  4032.48   1289.12  327.10  56.40  332.53  69.76  -5.43   89.71  
1 1 1 -3  -15 8  o 6  154.93  23.10  723.01    199.20   723.01   199.20   0.00      0.00     154.93  23.10  ?       ?      0.00    23.10  
1 1 1 -3  -15 9  o 16 78.50   19.92  187.91    89.92    187.91   89.92    0.00      0.00     78.50   19.92  ?       ?      0.00    19.92  
1 1 1 -3  -15 10 o 3  107.59  19.88  350.72    118.25   351.73   119.17   286.64    950.08   107.72  20.01  141.44  61.80  -33.73  64.96  
1 1 1 -3  -15 11 o 17 62.57   18.76  116.49    72.70    119.66   72.90    -455.45   979.75   63.29   18.74  119.93  56.27  -56.65  59.31  
1 1 1 -3  -15 12 o 19 109.80  19.87  366.05    120.62   355.60   121.56   1038.36   975.04   108.06  20.34  169.78  67.28  -61.72  70.29  
1 1 1 -3  -15 13 o 15 126.09  20.52  482.16    143.42   482.16   143.42   0.00      0.00     126.09  20.52  ?       ?      0.00    20.52  
1 1 1 -3  -15 14 o 5  100.47  19.43  308.13    108.03   308.13   108.03   0.00      0.00     100.47  19.43  ?       ?      0.00    19.43  
1 1 1 -3  -15 15 o 15 141.31  62.98  416.64    1034.72  0.00     0.00     416.64    1034.72  ?       ?      141.31  62.98  0.00    62.98  
1 1 1 -3  -15 16 o 3  226.59  26.31  1591.86   335.84   1473.02  351.89   2806.03   1124.76  216.13  29.10  243.27  73.98  -27.13  79.49  
1 1 1 -3  -15 17 f 0  70.30   17.92  152.14    72.55    155.58   72.71    -612.30   1083.68  71.09   17.85  114.87  55.34  -43.78  58.15  
1 1 1 -3  -14 1  o 13 269.97  42.41  2239.32   635.56   2239.32  635.56   0.00      0.00     269.97  42.41  ?       ?      0.00    42.41  
1 1 1 -3  -14 2  o 1  267.91  42.07  2201.99   625.75   2201.99  625.75   0.00      0.00     267.91  42.07  ?       ?      0.00    42.07  
1 1 1 -3  -14 3  o 17 438.08  32.26  5690.58   805.67   5187.13  1345.05  5972.27   1006.13  402.98  59.97  445.22  39.78  -42.25  71.96  
1 1 1 -3  -14 4  o 13 233.79  29.76  1630.98   390.42   1453.17  547.07   1815.54   557.35   215.27  45.68  242.86  41.46  -27.59  61.70  
1 1 1 -3  -14 5  o 5  375.58  26.40  4152.25   565.50   4199.47  789.22   4102.42   810.69   373.17  37.34  368.02  38.96  5.15    53.97  
1 1 1 -3  -14 6  o 4  237.46  29.71  1689.27   396.20   2000.30  443.40   457.49    882.40   258.41  30.48  154.08  62.96  104.33  69.95  
1 1 1 -3  -14 7  o 4  204.59  25.27  1247.10   290.46   1196.35  310.57   1601.40   820.52   199.54  27.87  217.18  62.47  -17.64  68.41  
1 1 1 -3  -14 8  o 18 105.95  45.15  71.59     482.70   71.59    482.70   0.00      0.00     105.95  45.15  ?       ?      0.00    45.15  
1 1 1 -3  -14 9  o 9  361.57  67.94  4591.89   1358.47  4591.89  1358.47  0.00      0.00     361.57  67.94  ?       ?      0.00    67.94  
1 1 1 -3  -14 10 f 0  125.82  47.40  417.02    466.16   417.02   466.16   0.00      0.00     125.82  47.40  ?       ?      0.00    47.40  
1 1 1 -3  -14 11 o 7  105.87  18.89  336.99    110.57   336.99   110.57   0.00      0.00     105.87  18.89  ?       ?      0.00    18.89  
1 1 1 -3  -14 12 o 7  250.28  25.64  1883.18   363.15   1780.73  393.15   2478.72   947.86   241.85  28.89  260.53  63.88  -18.68  70.10  
1 1 1 -3  -14 13 o 7  186.01  23.16  1041.31   241.95   1032.58  253.84   1128.11   799.97   184.71  24.55  176.88  62.80  7.82    67.43  
1 1 1 -3  -14 14 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  -14 15 o 7  151.15  23.62  697.26    198.21   677.53   203.58   1056.74   868.93   148.54  24.74  169.25  64.50  -20.71  69.08  
1 1 1 -3  -14 16 o 18 207.26  25.87  1316.40   301.12   1336.77  317.95   1139.14   937.83   208.17  27.26  171.32  66.55  36.85   71.92  
1 1 1 -3  -14 17 o 15 170.70  23.63  891.92    225.33   817.22   232.38   2067.39   921.80   162.33  25.80  220.78  66.94  -58.45  71.74  
1 1 1 -3  -14 18 o 9  114.57  20.02  401.83    126.87   385.21   128.05   1292.30   937.42   111.90  20.70  171.84  66.60  -59.94  69.74  
1 1 1 -3  -14 19 o 13 92.50   17.81  261.57    91.12    261.57   91.12    0.00      0.00     92.50   17.81  ?       ?      0.00    17.81  
1 1 1 -3  -13 1  o 6  173.06  23.23  888.27    225.00   1804.40  321.84   12.45     314.68   247.80  22.88  85.20   36.38  162.60  42.98  
1 1 1 -3  -13 2  o 14 148.11  32.25  672.50    266.37   672.50   266.37   0.00      0.00     148.11  32.25  ?       ?      0.00    32.25  
1 1 1 -3  -13 3  o 7  454.88  32.02  6142.05   830.86   6435.36  1175.83  5849.54   1174.20  458.31  45.28  435.25  47.78  23.06   65.83  
1 1 1 -3  -13 4  o 11 261.96  31.33  2048.85   461.88   2051.27  580.71   2044.68   762.01   258.95  40.38  252.87  54.13  6.08    67.53  
1 1 1 -3  -13 5  o 18 434.75  53.96  5895.09   1317.78  6710.60  1822.78  5002.17   1907.33  450.35  73.00  374.68  89.84  75.66   115.76 
1 1 1 -3  -13 6  o 8  175.71  45.32  964.93    460.13   2400.12  538.98   -2892.35  883.60   283.40  33.79  78.84   39.88  204.56  52.27  
1 1 1 -3  -13 7  o 13 699.42  39.87  14630.33  1594.33  6128.70  2176.13  24481.39  2342.48  414.00  93.75  899.99  45.49  -485.99 104.20 
1 1 1 -3  -13 8  o 3  43.72   19.90  -67.52    109.52   -13.65   110.58   -2860.01  796.15   49.21   21.30  72.25   36.68  -23.04  42.42  
1 1 1 -3  -13 9  f 0  99.84   19.02  298.62    105.05   311.59   105.99   -425.86   791.95   102.09  18.78  114.96  52.76  -12.87  56.00  
1 1 1 -3  -13 10 o 16 437.61  41.24  5865.50   1023.79  5902.96  1226.23  5779.32   1860.12  432.59  50.32  398.17  84.02  34.43   97.94  
1 1 1 -3  -13 11 o 15 191.86  21.65  1089.26   234.24   1034.32  245.66   1639.49   777.38   186.40  23.48  219.54  59.99  -33.13  64.42  
1 1 1 -3  -13 12 o 6  265.66  51.02  2310.10   749.84   2310.10  749.84   0.00      0.00     265.66  51.02  ?       ?      0.00    51.02  
1 1 1 -3  -13 13 o 13 343.26  64.00  4113.22   1214.66  4113.22  1214.66  0.00      0.00     343.26  64.00  ?       ?      0.00    64.00  
1 1 1 -3  -13 14 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  -13 15 o 1  125.90  43.64  487.19    384.67   487.19   384.67   0.00      0.00     125.90  43.64  ?       ?      0.00    43.64  
1 1 1 -3  -13 16 o 19 240.66  23.03  1736.96   314.31   1524.28  339.72   3001.08   828.24   223.51  27.02  296.19  50.52  -72.67  57.30  
1 1 1 -3  -13 17 o 6  173.30  20.91  901.84    203.81   884.79   211.20   1132.57   776.98   171.24  21.99  173.66  61.87  -2.41   65.66  
1 1 1 -3  -13 18 o 7  291.72  23.55  2568.44   391.04   2263.30  427.44   4134.92   968.46   271.12  27.86  343.59  50.61  -72.48  57.77  
1 1 1 -3  -13 19 o 11 97.50   17.74  288.70    95.63    296.46   96.28    -278.47   822.93   98.86   17.61  111.20  51.97  -12.33  54.88  
1 1 1 -3  -13 20 o 12 81.30   18.69  203.95    85.42    203.95   85.42    0.00      0.00     81.30   18.69  ?       ?      0.00    18.69  
1 1 1 -3  -12 1  o 10 85.52   12.08  214.70    57.64    577.87   95.03    3.38      72.49    141.20  11.83  41.67   17.61  99.53   21.22  
1 1 1 -3  -12 2  o 12 236.28  18.57  1623.89   249.81   1691.12  312.50   1504.87   415.79   240.34  22.93  224.09  33.34  16.25   40.46  
1 1 1 -3  -12 3  o 13 270.61  20.03  2132.30   308.95   2033.50  436.99   2231.04   436.86   262.03  29.57  275.01  28.06  -12.98  40.76  
1 1 1 -3  -12 4  o 1  114.77  12.66  384.07    82.01    441.80   118.36   330.78    113.73   122.44  17.32  105.22  19.55  17.21   26.12  
1 1 1 -3  -12 5  o 12 556.38  39.11  9273.93   1241.19  9432.23  1753.85  9115.10   1756.78  549.04  56.45  538.67  57.71  10.36   80.73  
1 1 1 -3  -12 6  o 8  481.70  36.47  6933.53   1001.05  7245.56  1412.97  6619.06   1418.46  483.15  51.75  459.51  54.85  23.64   75.41  
1 1 1 -3  -12 7  o 19 203.41  21.16  1214.36   243.51   1183.94  264.33   1384.99   626.01   200.32  23.43  208.23  52.42  -7.90   57.41  
1 1 1 -3  -12 8  o 5  196.46  25.66  1144.15   282.50   1144.15  282.50   0.00      0.00     196.46  25.66  ?       ?      0.00    25.66  
1 1 1 -3  -12 9  o 11 166.02  39.04  850.60    365.83   1189.43  403.01   -735.91   872.05   197.50  36.90  113.90  53.32  83.60   64.85  
1 1 1 -3  -12 10 o 2  667.25  36.08  13208.10  1376.95  5147.00  1853.46  23137.00  2057.01  385.62  85.93  879.76  40.84  -494.14 95.14  
1 1 1 -3  -12 11 o 18 190.17  30.81  1088.64   324.84   1372.21  356.31   -307.38   790.58   214.29  29.77  119.36  53.97  94.93   61.64  
1 1 1 -3  -12 12 o 16 508.76  61.37  8387.25   1756.14  8821.90  2441.51  7921.30   2527.86  492.48  89.66  454.45  99.65  38.04   134.05 
1 1 1 -3  -12 13 o 18 246.03  47.13  1931.55   641.43   1931.55  641.43   0.00      0.00     246.03  47.13  ?       ?      0.00    47.13  
1 1 1 -3  -12 14 o 14 136.67  52.65  473.49    583.33   0.00     0.00     473.49    583.33   ?       ?      136.67  52.65  0.00    52.65  
1 1 1 -3  -12 15 o 15 244.89  20.80  1768.64   289.62   1410.64  315.16   3712.53   734.38   216.89  25.82  346.59  37.51  -129.70 45.53  
1 1 1 -3  -12 16 o 10 197.02  35.44  1219.37   386.10   1186.57  467.26   1289.96   685.48   190.41  43.68  191.95  57.62  -1.54   72.30  
1 1 1 -3  -12 17 o 19 270.56  51.22  2495.65   766.41   2495.65  766.41   0.00      0.00     270.56  51.22  ?       ?      0.00    51.22  
1 1 1 -3  -12 18 o 1  187.72  43.37  1181.86   457.94   1181.86  457.94   0.00      0.00     187.72  43.37  ?       ?      0.00    43.37  
1 1 1 -3  -12 19 o 3  218.43  25.20  1453.40   310.19   1453.40  310.19   0.00      0.00     218.43  25.20  ?       ?      0.00    25.20  
1 1 1 -3  -12 20 o 13 103.35  18.82  324.98    107.57   324.98   107.57   0.00      0.00     103.35  18.82  ?       ?      0.00    18.82  
1 1 1 -3  -12 21 o 13 282.38  26.51  2464.99   424.74   2449.14  463.45   2548.14   1061.63  279.27  29.35  234.35  71.99  44.92   77.74  
1 1 1 -3  -12 22 o 13 169.39  21.36  876.16    203.11   868.50   208.00   1033.31   942.28   168.32  22.06  156.49  64.62  11.82   68.28  
1 1 1 -3  -11 1  o 5  283.40  43.31  2439.77   682.21   2439.77  682.21   0.00      0.00     283.40  43.31  ?       ?      0.00    43.31  
1 1 1 -3  -11 2  o 16 290.65  23.78  2466.74   393.38   2521.52  486.37   2363.14   668.94   292.61  29.35  279.13  43.14  13.48   52.17  
1 1 1 -3  -11 3  o 10 192.73  16.72  1079.49   183.11   1141.64  233.21   979.57    295.69   197.58  20.88  181.10  29.45  16.48   36.10  
1 1 1 -3  -11 4  o 19 165.99  14.44  799.73    136.20   815.49   191.87   783.72    193.37   166.71  20.48  163.26  21.13  3.44    29.42  
1 1 1 -3  -11 5  o 5  262.87  17.80  2003.83   267.08   2043.86  373.89   1962.13   381.63   264.23  24.94  258.61  26.06  5.62    36.08  
1 1 1 -3  -11 6  o 14 152.26  13.81  673.28    119.36   703.01   165.81   641.30    171.95   154.82  19.06  147.43  20.90  7.39    28.29  
1 1 1 -3  -11 7  o 17 486.20  35.78  7006.15   991.58   6979.10  1398.20  7033.53   1406.44  477.18  51.88  478.99  51.98  -1.81   73.44  
1 1 1 -3  -11 8  o 16 382.85  61.29  4664.64   1301.65  4664.64  1301.65  0.00      0.00     382.85  61.29  ?       ?      0.00    61.29  
1 1 1 -3  -11 9  o 18 515.44  57.12  8344.46   1661.84  8344.46  1661.84  0.00      0.00     515.44  57.12  ?       ?      0.00    57.12  
1 1 1 -3  -11 10 o 18 484.73  40.51  7072.77   1116.91  6989.69  1351.82  7251.48   1982.65  476.05  50.22  464.71  77.01  11.34   91.94  
1 1 1 -3  -11 11 o 15 502.71  88.74  8731.26   2467.31  8731.26  2467.31  0.00      0.00     502.71  88.74  ?       ?      0.00    88.74  
1 1 1 -3  -11 12 o 11 458.72  25.09  6145.37   658.14   4727.75  769.81   9996.26   1268.78  399.24  33.91  579.19  38.38  -179.95 51.21  
1 1 1 -3  -11 13 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  -11 14 o 9  423.98  40.71  5466.46   978.67   4626.41  1327.51  6466.59   1448.49  374.98  63.96  449.68  57.42  -74.70  85.95  
1 1 1 -3  -11 15 o 19 259.34  40.80  2092.12   587.34   2092.12  587.34   0.00      0.00     259.34  40.80  ?       ?      0.00    40.80  
1 1 1 -3  -11 16 o 3  99.02   17.96  293.91    98.33    305.08   99.93    -45.45    550.80   100.95  17.90  106.10  46.68  -5.15   50.00  
1 1 1 -3  -11 17 o 10 182.89  22.43  997.48    230.52   1072.05  249.04   551.27    609.22   189.38  23.40  141.48  53.98  47.90   58.84  
1 1 1 -3  -11 18 o 18 55.11   18.13  85.32     66.36    83.66    66.85    198.39    551.19   54.80   18.20  116.22  48.82  -61.42  52.10  
1 1 1 -3  -11 19 o 4  278.43  30.51  2388.35   479.67   2388.35  479.67   0.00      0.00     278.43  30.51  ?       ?      0.00    30.51  
1 1 1 -3  -11 20 o 17 101.09  37.00  285.40    280.31   285.40   280.31   0.00      0.00     101.09  37.00  ?       ?      0.00    37.00  
1 1 1 -3  -11 21 o 19 209.51  41.72  1478.08   484.11   1478.08  484.11   0.00      0.00     209.51  41.72  ?       ?      0.00    41.72  
1 1 1 -3  -11 22 o 12 154.95  37.54  808.45    330.38   808.45   330.38   0.00      0.00     154.95  37.54  ?       ?      0.00    37.54  
1 1 1 -3  -11 23 o 7  105.66  17.85  339.83    104.43   342.53   105.21   160.85    857.18   106.07  17.92  122.40  55.68  -16.32  58.49  
1 1 1 -3  -10 1  o 17 111.37  13.67  363.29    85.58    388.30   146.05   350.22    105.60   113.42  23.21  108.63  17.53  4.79    29.09  
1 1 1 -3  -10 2  o 5  428.30  40.23  5538.46   977.58   6437.41  1387.43  4652.17   1377.63  453.22  54.41  377.12  66.04  76.10   85.57  
1 1 1 -3  -10 3  o 6  292.34  37.54  2574.63   615.52   1785.62  880.93   3327.31   860.40   233.83  63.85  328.95  46.89  -95.12  79.21  
1 1 1 -3  -10 4  o 14 200.97  20.98  1182.78   238.45   1319.28  364.48   1080.63   315.30   210.05  31.17  190.03  29.89  20.02   43.18  
1 1 1 -3  -10 5  o 16 213.39  24.46  1338.86   294.20   1199.84  438.32   1452.83   396.88   198.11  39.92  220.56  32.30  -22.46  51.35  
1 1 1 -3  -10 6  o 3  228.62  17.71  1517.64   230.65   1720.37  288.69   1159.82   383.54   242.99  20.90  196.00  35.39  46.99   41.10  
1 1 1 -3  -10 7  o 7  157.72  13.72  721.66    122.95   680.06   169.57   767.78    178.53   152.14  19.89  161.86  19.61  -9.71   27.93  
1 1 1 -3  -10 8  o 17 405.45  40.00  4892.73   918.92   4892.73  918.92   0.00      0.00     405.45  40.00  ?       ?      0.00    40.00  
1 1 1 -3  -10 9  o 17 328.88  39.64  3238.41   733.29   3238.41  733.29   0.00      0.00     328.88  39.64  ?       ?      0.00    39.64  
1 1 1 -3  -10 10 o 11 622.80  48.13  11761.64  1707.32  11317.42 2086.19  12662.58  2971.00  601.10  61.31  611.86  87.04  -10.77  106.46 
1 1 1 -3  -10 11 o 7  203.77  25.78  1229.81   294.78   1482.08  342.60   510.68    578.44   223.60  27.25  142.23  52.96  81.38   59.56  
1 1 1 -3  -10 12 o 14 443.08  47.18  6015.86   1181.54  6015.86  1181.54  0.00      0.00     443.08  47.18  ?       ?      0.00    47.18  
1 1 1 -3  -10 13 o 5  353.62  62.30  4005.45   1218.43  0.00     0.00     4005.45   1218.43  ?       ?      353.62  62.30  0.00    62.30  
1 1 1 -3  -10 14 o 7  665.92  38.30  13203.11  1457.89  9838.97  1770.34  20292.28  2569.90  563.45  55.45  810.58  55.56  -247.13 78.50  
1 1 1 -3  -10 15 o 15 298.19  27.58  2623.46   466.78   2623.46  466.78   0.00      0.00     298.19  27.58  ?       ?      0.00    27.58  
1 1 1 -3  -10 16 o 11 338.09  35.85  3454.00   685.17   3781.39  818.87   2689.72   1251.16  351.07  41.43  275.15  76.47  75.93   86.97  
1 1 1 -3  -10 17 o 2  383.81  32.96  4445.71   719.21   4328.26  861.50   4715.81   1306.47  373.92  40.80  372.83  63.30  1.09    75.31  
1 1 1 -3  -10 18 o 9  265.70  33.35  2159.52   497.44   2265.69  630.97   1985.16   808.58   267.36  42.53  239.87  59.11  27.49   72.82  
1 1 1 -3  -10 19 o 2  237.85  26.71  1705.93   358.35   1429.87  420.20   2442.06   686.18   213.63  35.51  274.27  45.15  -60.64  57.44  
1 1 1 -3  -10 20 o 14 238.06  32.33  1762.27   430.41   1837.79  513.71   1584.36   788.43   239.41  38.70  206.11  61.78  33.30   72.89  
1 1 1 -3  -10 21 o 10 219.55  21.05  1441.16   262.02   1402.77  280.50   1704.07   734.06   215.75  23.00  213.60  58.26  2.15    62.64  
1 1 1 -3  -10 22 o 11 180.37  32.56  1040.23   324.69   941.73   362.91   1435.37   726.86   168.21  38.43  191.75  59.68  -23.54  70.98  
1 1 1 -3  -10 23 o 1  84.51   31.73  186.04    208.52   216.67   217.20   -174.29   745.03   88.57   32.55  108.91  50.41  -20.34  60.00  
1 1 1 -3  -10 24 f 0  204.70  40.18  1446.65   455.32   1446.65  455.32   0.00      0.00     204.70  40.18  ?       ?      0.00    40.18  
1 1 1 -3  -10 25 o 3  90.94   31.71  254.10    203.30   254.10   203.30   0.00      0.00     90.94   31.71  ?       ?      0.00    31.71  
1 1 1 -3  -9  1  o 11 197.35  20.37  1147.33   227.45   1044.79  321.25   1250.41   322.09   185.01  31.37  203.82  28.29  -18.81  42.24  
1 1 1 -3  -9  2  o 4  190.58  14.25  1056.02   154.74   1123.46  192.24   931.92    260.76   196.03  17.26  176.09  26.63  19.95   31.73  
1 1 1 -3  -9  3  o 7  306.35  25.35  2771.24   441.77   2591.17  542.23   3126.73   761.85   293.44  32.75  317.78  42.85  -24.35  53.93  
1 1 1 -3  -9  4  o 15 278.19  20.70  2263.94   328.24   2441.81  467.01   2090.29   461.45   286.55  28.78  264.16  31.02  22.39   42.31  
1 1 1 -3  -9  5  o 7  405.60  34.73  4919.35   800.82   4961.24  1383.91  4898.26   981.92   389.77  64.07  400.31  43.42  -10.54  77.40  
1 1 1 -3  -9  6  o 18 329.57  27.21  3196.94   510.17   3296.57  626.82   3001.44   878.08   332.71  33.26  309.89  51.14  22.81   61.01  
1 1 1 -3  -9  7  o 8  427.38  69.25  5888.36   1641.02  0.00     0.00     5888.36   1641.02  ?       ?      427.38  69.25  0.00    69.25  
1 1 1 -3  -9  8  o 3  435.36  70.32  6053.01   1697.55  6053.01  1697.55  0.00      0.00     435.36  70.32  ?       ?      0.00    70.32  
1 1 1 -3  -9  9  f 0  368.71  58.12  4210.27   1189.53  4210.27  1189.53  0.00      0.00     368.71  58.12  ?       ?      0.00    58.12  
1 1 1 -3  -9  10 o 11 278.13  44.27  2345.14   683.20   2345.14  683.20   0.00      0.00     278.13  44.27  ?       ?      0.00    44.27  
1 1 1 -3  -9  11 o 4  168.52  20.94  834.01    198.18   834.01   198.18   0.00      0.00     168.52  20.94  ?       ?      0.00    20.94  
1 1 1 -3  -9  12 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  -9  13 o 15 167.87  20.38  828.97    192.37   944.23   216.92   404.38    416.33   179.08  21.53  124.74  45.18  54.34   50.05  
1 1 1 -3  -9  14 o 2  414.27  39.83  5170.75   935.57   5170.75  935.57   0.00      0.00     414.27  39.83  ?       ?      0.00    39.83  
1 1 1 -3  -9  15 o 14 236.94  32.53  1680.35   430.81   1680.35  430.81   0.00      0.00     236.94  32.53  ?       ?      0.00    32.53  
1 1 1 -3  -9  16 o 4  31.25   15.83  -509.69   143.08   -608.87  146.99   1278.84   624.21   ?       ?      200.63  53.30  0.00    53.30  
1 1 1 -3  -9  17 o 17 318.35  37.31  3065.86   668.88   3188.97  885.72   2902.48   1020.39  318.58  50.08  297.21  61.82  21.37   79.56  
1 1 1 -3  -9  18 o 12 430.17  34.91  5592.39   854.63   5359.03  1033.35  6097.51   1520.30  415.01  44.05  425.73  64.20  -10.71  77.86  
1 1 1 -3  -9  19 o 13 271.00  23.97  2179.21   369.10   2136.76  421.50   2318.76   764.30   266.79  27.94  264.86  52.12  1.93    59.14  
1 1 1 -3  -9  20 o 7  172.34  16.76  873.09    163.72   823.44   171.40   1389.84   552.99   166.98  18.17  204.37  47.96  -37.40  51.29  
1 1 1 -3  -9  21 o 9  271.84  36.80  2335.37   559.53   2550.96  705.85   1970.82   917.87   277.65  45.89  226.60  66.34  51.05   80.66  
1 1 1 -3  -9  22 o 12 158.51  58.15  888.17    692.71   0.00     0.00     888.17    692.71   ?       ?      158.51  58.15  0.00    58.15  
1 1 1 -3  -9  23 o 18 306.33  76.89  4165.13   1349.91  0.00     0.00     4165.13   1349.91  ?       ?      306.33  76.89  0.00    76.89  
1 1 1 -3  -9  24 f 0  127.05  30.17  522.23    216.78   533.45   226.30   397.28    755.16   128.07  31.10  129.52  55.85  -1.45   63.92  
1 1 1 -3  -9  25 o 2  152.50  32.78  770.93    278.45   770.93   278.45   0.00      0.00     152.50  32.78  ?       ?      0.00    32.78  
1 1 1 -3  -9  26 o 19 88.12   29.82  241.95    179.37   241.54   183.88   250.07    814.94   88.25   30.19  120.32  54.56  -32.08  62.36  
1 1 1 -3  -8  1  o 16 477.39  39.97  6987.86   1085.26  7014.99  1329.49  6933.69   1878.81  470.06  50.04  440.51  77.10  29.55   91.92  
1 1 1 -3  -8  2  o 13 286.81  27.92  2453.96   453.89   2453.96  453.89   0.00      0.00     286.81  27.92  ?       ?      0.00    27.92  
1 1 1 -3  -8  3  o 18 434.31  78.88  6799.47   1894.19  6799.47  1894.19  0.00      0.00     434.31  78.88  ?       ?      0.00    78.88  
1 1 1 -3  -8  4  f 0  374.17  63.19  4697.85   1309.06  4697.85  1309.06  0.00      0.00     374.17  63.19  ?       ?      0.00    63.19  
1 1 1 -3  -8  5  o 10 80.58   12.87  192.09    57.55    192.09   57.55    0.00      0.00     80.58   12.87  ?       ?      0.00    12.87  
1 1 1 -3  -8  6  o 10 347.42  56.63  3912.83   1090.56  3912.83  1090.56  0.00      0.00     347.42  56.63  ?       ?      0.00    56.63  
1 1 1 -3  -8  7  o 18 135.04  17.23  536.62    130.56   689.46   177.64   357.04    192.55   152.60  20.82  108.33  29.96  44.27   36.48  
1 1 1 -3  -8  8  o 7  167.93  14.81  820.51    141.28   753.26   177.02   938.50    234.48   159.98  19.69  178.00  23.52  -18.02  30.68  
1 1 1 -3  -8  9  o 5  221.61  16.98  1427.17   214.39   1406.25  263.00   1468.59   370.14   219.22  21.16  222.08  29.78  -2.85   36.54  
1 1 1 -3  -8  10 o 4  239.98  19.73  1676.36   269.41   1616.28  322.26   1815.83   490.99   234.77  24.26  246.14  35.80  -11.37  43.24  
1 1 1 -3  -8  11 o 11 467.46  75.33  7008.10   1952.74  7008.10  1952.74  0.00      0.00     467.46  75.33  ?       ?      0.00    75.33  
1 1 1 -3  -8  12 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  -8  13 o 3  233.70  38.59  1651.38   499.61   1651.38  499.61   0.00      0.00     233.70  38.59  ?       ?      0.00    38.59  
1 1 1 -3  -8  14 o 14 656.99  138.51 18146.24  5059.13  18146.24 5059.13  0.00      0.00     656.99  138.51 ?       ?      0.00    138.51 
1 1 1 -3  -8  15 f 0  434.22  48.40  5808.05   1186.08  5808.05  1186.08  0.00      0.00     434.22  48.40  ?       ?      0.00    48.40  
1 1 1 -3  -8  16 o 3  401.56  34.18  4797.57   780.42   4688.92  943.98   5032.19   1387.21  393.24  42.49  395.55  63.22  -2.31   76.17  
1 1 1 -3  -8  17 o 5  555.86  54.65  9585.65   1721.46  8421.24  2406.46  10805.98  2463.58  492.96  88.28  570.52  77.20  -77.56  117.27 
1 1 1 -3  -8  18 o 3  521.93  38.66  8183.93   1150.08  7613.59  1395.26  9392.76   2031.28  496.27  49.64  536.39  67.46  -40.12  83.75  
1 1 1 -3  -8  19 o 12 267.81  33.47  2172.65   503.40   2340.72  660.19   1939.21   778.08   273.47  43.51  241.63  57.02  31.84   71.72  
1 1 1 -3  -8  20 o 1  282.72  35.41  2457.96   562.18   2655.41  733.42   2176.68   875.38   287.87  45.92  250.09  61.43  37.78   76.70  
1 1 1 -3  -8  21 o 4  249.63  58.08  2173.08   816.53   0.00     0.00     2173.08   816.53   ?       ?      249.63  58.08  0.00    58.08  
1 1 1 -3  -8  22 o 19 114.06  30.39  409.79    202.52   455.80   216.49   87.46     573.01   120.05  31.15  111.35  48.33  8.71    57.50  
1 1 1 -3  -8  23 o 16 270.03  33.55  2301.73   508.93   2087.83  637.79   2676.65   844.39   247.10  46.67  271.26  56.08  -24.16  72.96  
1 1 1 -3  -8  24 o 6  134.66  30.53  582.71    230.54   582.71   230.54   0.00      0.00     134.66  30.53  ?       ?      0.00    30.53  
1 1 1 -3  -8  25 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  -8  26 o 18 131.15  56.38  544.19    764.82   0.00     0.00     544.19    764.82   ?       ?      131.15  56.38  0.00    56.38  
1 1 1 -3  -8  27 o 4  248.30  36.11  2101.51   499.64   1962.02  590.38   2453.56   937.91   228.27  46.63  221.82  67.57  6.45    82.10  
1 1 1 -3  -7  1  o 11 162.91  16.68  776.48    153.76   779.35   217.47   773.60    217.42   161.57  24.19  160.94  24.29  0.63    34.28  
1 1 1 -3  -7  2  o 5  492.03  42.97  7425.33   1201.51  7463.83  1471.69  7348.40   2080.63  484.77  53.79  453.07  83.06  31.70   98.95  
1 1 1 -3  -7  3  o 1  498.37  44.86  7683.30   1269.81  7297.61  1555.31  8454.34   2199.02  474.23  58.36  486.01  81.71  -11.78  100.41 
1 1 1 -3  -7  4  o 14 326.76  34.42  3226.44   636.04   3103.66  899.44   3349.24   899.54   310.79  52.27  324.56  49.87  -13.77  72.24  
1 1 1 -3  -7  5  o 14 439.10  32.99  5788.02   825.55   5783.31  1167.52  5792.74   1167.50  428.53  48.30  428.92  48.25  -0.39   68.27  
1 1 1 -3  -7  6  o 10 160.86  13.89  753.58    127.01   724.79   179.44   782.48    179.79   156.40  20.48  162.80  19.63  -6.40   28.37  
1 1 1 -3  -7  7  o 14 541.67  44.42  9089.11   1369.05  9085.94  1936.44  9092.28   1935.83  519.20  66.49  519.45  66.44  -0.25   94.00  
1 1 1 -3  -7  8  o 1  165.93  11.91  798.29    112.68   773.86   162.79   820.76    156.12   162.36  17.76  167.52  16.45  -5.16   24.20  
1 1 1 -3  -7  9  o 6  291.29  39.99  2599.51   651.03   3666.83  919.35   1525.93   922.04   342.39  48.10  213.58  67.33  128.81  82.74  
1 1 1 -3  -7  10 o 15 231.40  24.26  1578.05   317.54   1601.10  445.01   1554.14   453.25   230.07  34.78  226.16  36.13  3.91    50.15  
1 1 1 -3  -7  11 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  -7  12 o 2  78.23   12.79  180.74    55.44    180.74   55.44    0.00      0.00     78.23   12.79  ?       ?      0.00    12.79  
1 1 1 -3  -7  13 o 7  704.68  58.17  15175.06  2332.37  16300.17 2856.51  12924.60  4039.94  721.04  69.89  592.43  122.82 128.61  141.32 
1 1 1 -3  -7  14 o 3  609.51  53.02  11283.84  1836.70  12140.58 2249.15  9568.83   3182.20  625.08  63.56  516.36  110.68 108.72  127.63 
1 1 1 -3  -7  15 o 17 192.00  22.81  1085.07   246.54   1085.07  246.54   0.00      0.00     192.00  22.81  ?       ?      0.00    22.81  
1 1 1 -3  -7  16 o 1  326.61  52.56  3351.80   951.98   3351.80  951.98   0.00      0.00     326.61  52.56  ?       ?      0.00    52.56  
1 1 1 -3  -7  17 o 12 462.49  80.17  7316.33   2051.44  7316.33  2051.44  0.00      0.00     462.49  80.17  ?       ?      0.00    80.17  
1 1 1 -3  -7  18 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  -7  19 o 14 369.15  47.30  4208.00   979.31   5658.64  1342.86  2560.09   1431.26  422.74  56.77  269.24  83.74  153.50  101.17 
1 1 1 -3  -7  20 o 4  335.48  56.02  3668.29   1040.90  3668.29  1040.90  0.00      0.00     335.48  56.02  ?       ?      0.00    56.02  
1 1 1 -3  -7  21 o 11 289.50  48.76  2725.40   781.57   2725.40  781.57   0.00      0.00     289.50  48.76  ?       ?      0.00    48.76  
1 1 1 -3  -7  22 o 14 330.86  58.35  3788.68   1067.83  3788.68  1067.83  0.00      0.00     330.86  58.35  ?       ?      0.00    58.35  
1 1 1 -3  -7  23 o 5  153.81  26.91  730.07    228.98   753.25   250.27   611.01    567.21   155.42  29.12  140.23  52.40  15.19   59.95  
1 1 1 -3  -7  24 o 18 154.46  27.26  744.12    232.86   741.92   254.96   755.15    571.83   152.98  30.10  147.43  53.01  5.54    60.96  
1 1 1 -3  -7  25 o 5  184.80  58.81  1365.68   702.07   0.00     0.00     1365.68   702.07   ?       ?      184.80  58.81  0.00    58.81  
1 1 1 -3  -7  26 o 13 223.24  30.92  1599.44   385.66   1393.06  451.98   2151.95   739.54   200.73  40.62  233.70  55.88  -32.97  69.08  
1 1 1 -3  -7  27 o 19 106.45  48.41  63.84     647.13   0.00     0.00     63.84     647.13   ?       ?      106.45  48.41  0.00    48.41  
1 1 1 -3  -7  28 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  -6  1  o 1  236.00  24.19  1637.54   323.12   1673.06  456.97   1602.01   456.96   235.69  34.82  230.25  35.73  5.43    49.89  
1 1 1 -3  -6  2  o 4  268.04  27.57  2123.04   418.14   2009.57  591.30   2236.55   591.38   256.12  41.65  271.44  39.08  -15.33  57.11  
1 1 1 -3  -6  3  o 18 545.65  48.16  9149.53   1492.95  8716.83  1828.56  10014.68  2585.63  521.28  62.34  534.16  87.34  -12.88  107.30 
1 1 1 -3  -6  4  o 8  237.73  24.49  1667.85   329.45   1763.43  465.89   1572.25   465.95   241.38  34.61  226.83  37.06  14.55   50.71  
1 1 1 -3  -6  5  o 18 225.05  19.57  1482.27   250.35   1345.41  306.87   1754.65   432.90   212.83  25.63  241.41  32.03  -28.58  41.02  
1 1 1 -3  -6  6  o 7  290.65  21.66  2477.75   358.88   2779.34  439.93   1877.79   620.50   306.80  25.20  243.59  46.06  63.21   52.50  
1 1 1 -3  -6  7  o 7  241.72  19.93  1712.42   274.07   1829.36  336.02   1479.99   473.72   248.82  23.81  218.20  39.26  30.63   45.92  
1 1 1 -3  -6  8  o 18 271.27  23.27  2170.54   358.90   1990.34  439.92   2529.19   620.63   257.25  30.37  286.63  38.71  -29.38  49.20  
1 1 1 -3  -6  9  o 5  282.08  20.18  2330.05   324.58   2238.97  397.02   2513.62   563.64   274.88  25.45  287.64  34.84  -12.76  43.15  
1 1 1 -3  -6  10 o 3  324.62  36.29  3197.46   664.70   3197.46  664.70   0.00      0.00     324.62  36.29  ?       ?      0.00    36.29  
1 1 1 -3  -6  11 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  -6  12 o 9  118.09  12.66  406.49    84.51    473.44   103.94   275.97    145.14   127.28  14.48  95.63   25.83  31.65   29.62  
1 1 1 -3  -6  13 o 4  260.59  39.50  2051.95   572.47   2051.95  572.47   0.00      0.00     260.59  39.50  ?       ?      0.00    39.50  
1 1 1 -3  -6  14 o 8  270.97  28.74  2161.80   440.25   2234.02  617.46   2087.11   627.88   272.21  40.77  262.17  43.22  10.04   59.42  
1 1 1 -3  -6  15 f 0  468.14  56.95  6743.33   1499.09  7911.00  2117.78  5570.67   2122.30  494.72  77.08  402.99  93.54  91.73   121.21 
1 1 1 -3  -6  16 o 19 245.99  24.20  1775.64   337.39   1635.41  466.86   1928.92   488.11   232.87  36.09  253.82  34.38  -20.95  49.85  
1 1 1 -3  -6  17 o 14 298.06  34.17  2661.61   574.14   3308.98  812.02   2014.44   811.89   328.46  44.18  249.45  57.83  79.02   72.77  
1 1 1 -3  -6  18 o 6  377.71  40.47  4327.48   863.76   4029.22  1193.93  4655.03   1251.16  352.73  61.18  381.01  59.12  -28.27  85.07  
1 1 1 -3  -6  19 o 16 342.72  46.55  3615.49   892.18   5543.34  1217.01  1375.64   1311.79  422.73  51.19  213.73  79.72  209.00  94.74  
1 1 1 -3  -6  20 o 10 300.58  48.64  2825.00   810.63   2825.00  810.63   0.00      0.00     300.58  48.64  ?       ?      0.00    48.64  
1 1 1 -3  -6  21 o 14 216.78  35.93  1448.10   431.54   1448.10  431.54   0.00      0.00     216.78  35.93  ?       ?      0.00    35.93  
1 1 1 -3  -6  22 o 7  173.98  30.82  933.39    296.58   933.39   296.58   0.00      0.00     173.98  30.82  ?       ?      0.00    30.82  
1 1 1 -3  -6  23 o 5  119.96  26.04  444.85    174.17   415.07   188.72   615.96    452.33   115.29  28.64  139.13  47.35  -23.84  55.34  
1 1 1 -3  -6  24 o 7  186.82  26.85  1072.27   279.65   988.24   323.95   1318.00   553.96   176.26  33.23  194.01  49.56  -17.75  59.68  
1 1 1 -3  -6  25 o 3  68.37   25.14  118.39    129.64   128.89   135.41   2.97      449.00   70.53   25.73  94.74   41.90  -24.21  49.17  
1 1 1 -3  -6  26 o 1  149.28  25.99  699.41    214.66   659.25   236.00   891.84    516.61   143.07  29.71  154.30  50.56  -11.22  58.65  
1 1 1 -3  -6  27 o 7  219.97  29.86  1554.71   367.37   1468.92  442.22   1745.78   659.97   206.63  38.70  208.44  54.54  -1.81   66.87  
1 1 1 -3  -6  28 o 11 53.06   20.03  66.33     83.36    63.07    84.37    200.81    541.70   52.67   20.09  104.96  46.24  -52.29  50.41  
1 1 1 -3  -5  1  o 8  372.19  58.09  4309.56   1200.56  0.00     0.00     4309.56   1200.56  ?       ?      372.19  58.09  0.00    58.09  
1 1 1 -3  -5  2  o 4  614.96  112.15 13693.62  3813.48  0.00     0.00     13693.62  3813.48  ?       ?      614.96  112.15 0.00    112.15 
1 1 1 -3  -5  3  o 19 293.34  30.15  2541.66   500.45   2458.66  707.70   2624.69   707.77   283.71  44.95  293.95  43.23  -10.24  62.37  
1 1 1 -3  -5  4  o 17 763.34  92.42  20090.59  3967.57  21839.05 5611.03  18342.17  5610.95  724.91  139.90 636.65  155.00 88.26   208.80 
1 1 1 -3  -5  5  o 18 431.92  46.01  5694.32   1123.20  6060.01  1588.45  5328.64   1588.44  432.88  66.01  401.67  71.51  31.21   97.32  
1 1 1 -3  -5  6  o 19 511.83  36.81  7851.57   1074.41  7809.12  1519.46  7894.01   1519.43  498.71  53.93  501.71  53.58  -2.99   76.02  
1 1 1 -3  -5  7  o 14 123.58  7.89   441.01    55.66    465.01   78.56    416.81    78.88    126.58  10.92  119.69  11.63  6.89    15.95  
1 1 1 -3  -5  8  o 17 200.65  16.66  1174.77   190.16   1162.97  269.00   1186.55   268.86   197.86  24.18  199.97  23.89  -2.10   34.00  
1 1 1 -3  -5  9  o 7  302.44  27.85  2722.90   478.04   3017.80  585.31   2132.13   828.44   316.45  32.69  252.66  58.30  63.79   66.84  
1 1 1 -3  -5  10 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  -5  11 o 9  74.82   17.74  169.04    75.04    0.00     0.00     169.04    75.04    ?       ?      74.82   17.74  0.00    17.74  
1 1 1 -3  -5  12 o 13 296.22  21.44  2569.81   362.13   2625.01  443.20   2458.96   628.11   297.97  26.18  283.05  39.75  14.92   47.59  
1 1 1 -3  -5  13 o 6  328.83  52.08  3398.60   950.43   3398.60  950.43   0.00      0.00     328.83  52.08  ?       ?      0.00    52.08  
1 1 1 -3  -5  14 o 5  211.15  20.90  1304.20   249.97   1304.20  249.97   0.00      0.00     211.15  20.90  ?       ?      0.00    20.90  
1 1 1 -3  -5  15 o 18 544.36  47.70  8928.84   1475.46  8719.24  1806.40  9348.98   2557.47  530.50  60.39  529.96  87.09  0.55    105.98 
1 1 1 -3  -5  16 o 19 314.12  23.67  2877.88   423.63   3071.62  517.89   2486.06   736.47   323.54  28.16  285.28  46.58  38.27   54.43  
1 1 1 -3  -5  17 o 16 458.83  77.15  6970.75   1959.98  0.00     0.00     6970.75   1959.98  ?       ?      458.83  77.15  0.00    77.15  
1 1 1 -3  -5  18 o 19 489.56  88.20  8501.20   2387.73  0.00     0.00     8501.20   2387.73  ?       ?      489.56  88.20  0.00    88.20  
1 1 1 -3  -5  19 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  -5  20 f 0  189.65  17.14  1048.99   184.62   1514.66  196.27   -2528.20  543.98   228.52  15.04  ?       ?      0.00    15.04  
1 1 1 -3  -5  21 o 14 427.44  51.49  5734.68   1238.02  6744.63  1725.46  4663.05   1777.36  449.71  69.04  357.20  87.40  92.51   111.38 
1 1 1 -3  -5  22 o 9  261.81  42.56  2160.23   617.66   2160.23  617.66   0.00      0.00     261.81  42.56  ?       ?      0.00    42.56  
1 1 1 -3  -5  23 o 17 130.79  26.82  527.14    194.63   527.14   194.63   0.00      0.00     130.79  26.82  ?       ?      0.00    26.82  
1 1 1 -3  -5  24 o 1  221.71  36.96  1565.85   453.85   1565.85  453.85   0.00      0.00     221.71  36.96  ?       ?      0.00    36.96  
1 1 1 -3  -5  25 f 0  190.02  32.52  1148.29   341.99   1148.29  341.99   0.00      0.00     190.02  32.52  ?       ?      0.00    32.52  
1 1 1 -3  -5  26 f 0  174.38  24.78  939.63    241.08   888.67   276.60   1100.72   491.78   166.87  29.98  173.96  47.79  -7.09   56.41  
1 1 1 -3  -5  27 o 1  161.44  24.06  810.63    216.16   777.08   241.70   944.73    483.20   155.94  28.03  157.94  48.58  -2.00   56.08  
1 1 1 -3  -5  28 o 16 184.76  26.47  1086.36   272.76   1102.28  315.37   1039.10   543.35   182.85  31.16  158.90  51.84  23.95   60.49  
1 1 1 -3  -5  29 o 5  131.52  23.36  551.34    169.89   542.18   179.61   629.14    523.44   129.46  25.07  125.55  49.44  3.91    55.44  
1 1 1 -3  -4  1  o 15 562.38  60.08  9698.18   1909.59  9646.49  2700.56  9749.86   2700.58  540.54  90.21  543.94  89.60  -3.40   127.14 
1 1 1 -3  -4  2  o 15 312.38  32.09  2877.18   567.26   2925.10  802.21   2829.25   802.23   310.68  46.40  305.13  47.33  5.55    66.28  
1 1 1 -3  -4  3  o 13 709.52  79.54  16167.85  3184.11  16231.56 4503.00  16104.14  4503.01  666.62  122.17 663.23  122.79 3.40    173.21 
1 1 1 -3  -4  4  o 4  663.28  124.67 16421.09  4572.85  0.00     0.00     16421.09  4572.85  ?       ?      663.28  124.67 0.00    124.67 
1 1 1 -3  -4  5  o 14 531.74  90.93  9608.55   2675.97  0.00     0.00     9608.55   2675.97  ?       ?      531.74  90.93  0.00    90.93  
1 1 1 -3  -4  6  o 8  176.15  17.92  906.14    178.70   917.56   253.80   894.91    251.65   175.66  25.95  173.40  26.09  2.26    36.80  
1 1 1 -3  -4  7  o 12 618.50  71.52  12550.49  2492.66  12344.71 3525.50  12756.18  3524.81  565.24  112.61 577.95  110.26 -12.71  157.60 
1 1 1 -3  -4  8  o 9  396.45  46.54  4862.08   1039.10  4063.13  1469.91  5660.18   1469.12  341.73  76.80  416.07  63.52  -74.34  99.67  
1 1 1 -3  -4  9  o 8  164.14  25.26  807.36    230.37   807.36   230.37   0.00      0.00     164.14  25.26  ?       ?      0.00    25.26  
1 1 1 -3  -4  10 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  -4  11 o 15 226.98  25.42  1533.84   325.55   1533.84  325.55   0.00      0.00     226.98  25.42  ?       ?      0.00    25.42  
1 1 1 -3  -4  12 o 10 230.06  22.48  1562.78   293.07   1562.78  293.07   0.00      0.00     230.06  22.48  ?       ?      0.00    22.48  
1 1 1 -3  -4  13 o 14 507.70  58.52  8341.83   1674.53  8341.83  1674.53  0.00      0.00     507.70  58.52  ?       ?      0.00    58.52  
1 1 1 -3  -4  14 o 4  266.31  22.13  2077.98   335.31   2124.67  409.70   1983.27   583.55   268.00  27.00  253.85  41.47  14.15   49.49  
1 1 1 -3  -4  15 o 10 368.57  37.31  4058.40   778.64   3889.92  1098.81  4228.33   1103.53  352.34  56.21  368.92  53.68  -16.58  77.73  
1 1 1 -3  -4  16 o 7  164.67  17.69  791.89    164.63   773.75   226.31   812.29    239.94   161.33  25.26  165.19  26.17  -3.86   36.38  
1 1 1 -3  -4  17 o 11 499.14  53.73  7631.16   1515.42  7764.85  2138.58  7496.32   2147.70  486.65  79.28  476.41  81.45  10.23   113.66 
1 1 1 -3  -4  18 o 2  487.02  54.00  7366.52   1484.43  7773.20  2092.83  6954.77   2105.83  481.59  78.39  449.84  84.65  31.76   115.38 
1 1 1 -3  -4  19 o 17 306.07  33.60  2810.66   580.67   2938.60  803.09   2670.51   840.57   306.97  47.07  289.66  52.48  17.31   70.50  
1 1 1 -3  -4  20 o 18 201.86  44.72  1283.49   504.50   0.00     0.00     1283.49   504.50   ?       ?      201.86  44.72  0.00    44.72  
1 1 1 -3  -4  21 o 12 617.53  140.49 17393.09  4867.73  0.00     0.00     17393.09  4867.73  ?       ?      617.53  140.49 0.00    140.49 
1 1 1 -3  -4  22 o 4  197.96  45.82  1250.56   510.45   0.00     0.00     1250.56   510.45   ?       ?      197.96  45.82  0.00    45.82  
1 1 1 -3  -4  23 o 19 232.28  29.76  1638.10   387.68   1973.31  505.70   1160.26   603.77   252.32  35.93  185.29  53.68  67.03   64.59  
1 1 1 -3  -4  24 o 6  125.06  21.48  473.28    148.65   530.15   163.57   203.59    356.20   132.27  22.34  101.05  40.46  31.23   46.22  
1 1 1 -3  -4  25 o 14 118.23  41.76  427.95    353.31   0.00     0.00     427.95    353.31   ?       ?      118.23  41.76  0.00    41.76  
1 1 1 -3  -4  26 o 18 61.22   19.19  110.77    74.99    110.77   74.99    0.00      0.00     61.22   19.19  ?       ?      0.00    19.19  
1 1 1 -3  -4  27 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  -4  28 o 2  51.83   20.02  56.85     84.55    52.38    86.52    151.68    398.70   51.47   20.15  95.41   40.85  -43.93  45.55  
1 1 1 -3  -4  29 o 19 61.01   21.32  105.65    91.91    106.72   94.64    87.87     385.66   61.49   21.62  88.91   39.09  -27.42  44.67  
1 1 1 -3  -4  30 o 5  178.61  32.69  1105.17   322.83   1105.17  322.83   0.00      0.00     178.61  32.69  ?       ?      0.00    32.69  
1 1 1 -3  -3  1  o 18 300.09  45.35  2716.87   756.91   2716.87  756.91   0.00      0.00     300.09  45.35  ?       ?      0.00    45.35  
1 1 1 -3  -3  2  o 6  667.74  118.32 15691.23  4369.51  15691.23 4369.51  0.00      0.00     667.74  118.32 ?       ?      0.00    118.32 
1 1 1 -3  -3  3  o 18 542.90  89.53  9670.17   2692.98  9670.17  2692.98  0.00      0.00     542.90  89.53  ?       ?      0.00    89.53  
1 1 1 -3  -3  4  o 3  653.53  117.02 15186.14  4228.88  15186.14 4228.88  0.00      0.00     653.53  117.02 ?       ?      0.00    117.02 
1 1 1 -3  -3  5  o 6  243.78  24.91  1741.56   343.70   1802.97  486.06   1680.15   486.07   245.58  35.51  236.50  37.01  9.08    51.29  
1 1 1 -3  -3  6  o 18 392.15  40.87  4599.61   906.61   4680.05  1282.13  4519.17   1282.15  387.25  59.58  379.78  60.86  7.48    85.17  
1 1 1 -3  -3  7  o 18 264.23  20.02  2032.67   301.35   2234.64  369.27   1630.03   521.40   276.40  23.49  231.09  40.79  45.32   47.08  
1 1 1 -3  -3  8  o 18 158.32  13.27  727.67    119.47   812.09   206.16   684.98    146.59   165.74  22.23  153.00  16.98  12.74   27.97  
1 1 1 -3  -3  9  o 16 404.03  67.56  5423.59   1511.64  5423.59  1511.64  0.00      0.00     404.03  67.56  ?       ?      0.00    67.56  
1 1 1 -3  -3  10 o 11 424.71  74.19  6254.31   1742.99  0.00     0.00     6254.31   1742.99  ?       ?      424.71  74.19  0.00    74.19  
1 1 1 -3  -3  11 o 10 287.48  45.72  2608.62   729.23   2608.62  729.23   0.00      0.00     287.48  45.72  ?       ?      0.00    45.72  
1 1 1 -3  -3  12 o 5  386.85  67.09  5149.68   1435.94  5149.68  1435.94  0.00      0.00     386.85  67.09  ?       ?      0.00    67.09  
1 1 1 -3  -3  13 o 3  465.78  89.60  8285.49   2308.70  8285.49  2308.70  0.00      0.00     465.78  89.60  ?       ?      0.00    89.60  
1 1 1 -3  -3  14 o 11 408.90  38.25  5081.74   887.55   5172.44  1086.63  4899.94   1538.39  406.69  47.43  374.95  74.10  31.74   87.98  
1 1 1 -3  -3  15 o 15 577.65  54.09  10446.83  1772.75  10429.40 2170.83  10481.73  3071.45  563.60  68.50  522.61  106.01 40.99   126.21 
1 1 1 -3  -3  16 o 15 636.61  70.80  13036.56  2543.86  12523.84 3595.57  13550.41  3599.56  580.63  111.93 610.99  106.49 -30.36  154.50 
1 1 1 -3  -3  17 o 8  698.86  79.52  15908.71  3133.59  15888.87 4429.70  15928.60  4433.44  648.48  123.50 649.39  123.44 -0.91   174.61 
1 1 1 -3  -3  18 o 5  387.62  41.66  4518.72   912.41   4766.39  1283.97  4266.06   1296.81  389.63  59.27  365.64  64.12  23.98   87.32  
1 1 1 -3  -3  19 o 7  122.74  21.85  450.82    148.34   450.82   148.34   0.00      0.00     122.74  21.85  ?       ?      0.00    21.85  
1 1 1 -3  -3  20 o 14 456.01  53.61  6594.59   1376.64  7552.06  1940.03  5623.53   1953.76  469.09  74.53  389.45  89.30  79.64   116.32 
1 1 1 -3  -3  21 o 7  177.81  23.46  937.94    233.60   1035.28  283.39   731.59    412.63   185.94  27.37  153.10  44.38  32.84   52.14  
1 1 1 -3  -3  22 o 18 45.09   20.88  -106.77   128.27   7.60     135.89   -1041.39  388.46   56.83   24.07  56.87   28.45  -0.04   37.27  
1 1 1 -3  -3  23 o 1  399.44  73.24  5690.24   1617.60  0.00     0.00     5690.24   1617.60  ?       ?      399.44  73.24  0.00    73.24  
1 1 1 -3  -3  24 o 16 129.38  40.91  529.94    340.17   0.00     0.00     529.94    340.17   ?       ?      129.38  40.91  0.00    40.91  
1 1 1 -3  -3  25 o 1  109.93  38.49  359.18    299.70   0.00     0.00     359.18    299.70   ?       ?      109.93  38.49  0.00    38.49  
1 1 1 -3  -3  26 o 10 287.03  31.73  2593.01   514.03   2389.92  703.18   2826.09   753.30   260.85  48.75  285.18  47.70  -24.33  68.20  
1 1 1 -3  -3  27 o 6  110.59  19.29  374.24    118.01   402.99   132.78   266.13    257.48   114.25  21.02  95.86   35.40  18.39   41.17  
1 1 1 -3  -3  28 o 12 153.92  26.71  756.02    227.49   756.02   227.49   0.00      0.00     153.92  26.71  ?       ?      0.00    26.71  
1 1 1 -3  -3  29 o 11 244.24  48.35  2322.98   653.86   2322.98  653.86   0.00      0.00     244.24  48.35  ?       ?      0.00    48.35  
1 1 1 -3  -3  30 o 14 134.39  24.30  585.24    180.56   585.24   180.56   0.00      0.00     134.39  24.30  ?       ?      0.00    24.30  
1 1 1 -3  -2  1  x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  -2  2  o 4  550.81  90.50  9918.80   2762.16  9918.80  2762.16  0.00      0.00     550.81  90.50  ?       ?      0.00    90.50  
1 1 1 -3  -2  3  o 13 148.68  15.08  643.13    126.93   624.63   179.52   661.63    179.51   145.36  22.22  149.83  21.48  -4.46   30.91  
1 1 1 -3  -2  4  o 11 375.28  38.68  4174.91   821.41   4058.52  1161.64  4291.30   1161.67  363.17  57.64  374.41  55.74  -11.25  80.19  
1 1 1 -3  -2  5  o 12 786.47  89.93  20221.52  3987.17  20723.68 5638.71  19719.36  5638.72  740.60  137.69 716.28  142.15 24.33   197.90 
1 1 1 -3  -2  6  o 14 441.98  70.39  6198.18   1726.19  6198.18  1726.19  0.00      0.00     441.98  70.39  ?       ?      0.00    70.39  
1 1 1 -3  -2  7  o 7  209.51  31.33  1310.23   365.26   1310.23  365.26   0.00      0.00     209.51  31.33  ?       ?      0.00    31.33  
1 1 1 -3  -2  8  o 13 321.81  49.80  3195.97   890.29   3195.97  890.29   0.00      0.00     321.81  49.80  ?       ?      0.00    49.80  
1 1 1 -3  -2  9  x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  -2  10 o 12 319.42  35.85  3081.73   646.13   3440.74  913.36   2722.08   914.18   330.67  49.65  289.46  57.04  41.21   75.62  
1 1 1 -3  -2  11 o 8  57.13   7.93   95.69     25.32    111.73   30.57    60.66     45.18    61.67   8.89   46.41   14.93  15.26   17.38  
1 1 1 -3  -2  12 f 0  212.34  17.93  1320.02   216.47   1401.32  264.90   1156.60   375.56   217.94  21.45  193.37  35.13  24.57   41.16  
1 1 1 -3  -2  13 o 2  105.95  12.44  328.62    74.25    328.62   74.25    0.00      0.00     105.95  12.44  ?       ?      0.00    12.44  
1 1 1 -3  -2  14 o 14 165.44  17.23  803.09    161.28   940.03   196.54   520.75    282.21   178.62  19.48  129.40  36.45  49.23   41.33  
1 1 1 -3  -2  15 o 10 512.97  100.53 10247.66  2854.63  10247.66 2854.63  0.00      0.00     512.97  100.53 ?       ?      0.00    100.53 
1 1 1 -3  -2  16 o 4  410.66  67.80  5533.44   1542.56  5533.44  1542.56  0.00      0.00     410.66  67.80  ?       ?      0.00    67.80  
1 1 1 -3  -2  17 o 18 293.98  45.25  2643.45   739.19   2643.45  739.19   0.00      0.00     293.98  45.25  ?       ?      0.00    45.25  
1 1 1 -3  -2  18 o 5  708.17  84.96  16711.10  3385.03  18205.19 4785.93  15215.48  4788.38  687.34  125.93 606.79  140.27 80.55   188.51 
1 1 1 -3  -2  19 o 19 296.51  29.96  2604.01   502.94   2315.49  702.64   2907.15   720.22   273.62  46.39  309.27  41.62  -35.65  62.32  
1 1 1 -3  -2  20 o 15 598.81  70.31  12006.50  2370.87  12056.22 3350.27  11956.63  3355.56  547.54  110.40 544.02  111.20 3.53    156.70 
1 1 1 -3  -2  21 o 1  517.77  55.78  8583.51   1631.93  7752.66  2300.78  9424.72   2315.08  455.32  91.21  515.63  80.87  -60.31  121.89 
1 1 1 -3  -2  22 o 3  137.82  10.86  550.58    85.22    679.76   88.52    -1085.76  315.04   153.31  10.11  46.68   23.63  106.63  25.71  
1 1 1 -3  -2  23 o 11 135.06  35.98  568.14    284.01   0.00     0.00     568.14    284.01   ?       ?      135.06  35.98  0.00    35.98  
1 1 1 -3  -2  24 o 13 253.60  28.98  1949.03   414.33   2172.96  570.64   1699.34   602.57   262.64  39.03  226.80  47.79  35.84   61.71  
1 1 1 -3  -2  25 o 16 334.01  37.82  3539.09   712.42   3612.35  997.77   3462.89   1017.55  320.32  56.31  310.46  59.25  9.86    81.75  
1 1 1 -3  -2  26 o 13 348.18  74.16  5089.44   1436.86  0.00     0.00     5089.44   1436.86  ?       ?      348.18  74.16  0.00    74.16  
1 1 1 -3  -2  27 o 18 173.78  36.68  1013.43   354.43   0.00     0.00     1013.43   354.43   ?       ?      173.78  36.68  0.00    36.68  
1 1 1 -3  -2  28 o 11 174.65  37.91  1056.55   369.12   0.00     0.00     1056.55   369.12   ?       ?      174.65  37.91  0.00    37.91  
1 1 1 -3  -2  29 o 10 122.12  19.54  461.09    132.38   351.83   152.01   804.07    269.34   103.94  25.64  154.68  31.41  -50.75  40.54  
1 1 1 -3  -2  30 o 10 52.88   18.65  77.30     70.49    82.73    73.74    19.81     240.02   54.38   19.09  70.15   30.84  -15.77  36.27  
1 1 1 -3  -2  31 o 17 83.69   21.38  227.73    103.08   227.73   103.08   0.00      0.00     83.69   21.38  ?       ?      0.00    21.38  
1 1 1 -3  -1  1  f 0  565.40  60.08  9757.83   1920.19  9909.29  2715.57  9606.37   2715.54  551.53  88.78  541.66  90.52  9.87    126.79 
1 1 1 -3  -1  2  o 17 479.73  50.23  6918.86   1362.74  6848.79  1927.21  6988.92   1927.20  465.15  74.70  470.49  73.78  -5.34   104.99 
1 1 1 -3  -1  3  o 5  423.75  43.98  5353.67   1054.32  5342.75  1491.03  5364.59   1491.03  414.69  64.75  415.63  64.59  -0.94   91.45  
1 1 1 -3  -1  4  o 3  572.60  60.93  10022.64  1972.19  10319.34 2789.11  9725.94   2789.09  562.58  89.35  543.46  92.72  19.11   128.76 
1 1 1 -3  -1  5  o 4  852.96  99.47  24243.59  4779.26  25573.76 6758.91  22913.43  6758.89  809.50  151.00 749.73  161.79 59.78   221.31 
1 1 1 -3  -1  6  o 10 785.44  164.96 25860.32  7200.91  25860.32 7200.91  0.00      0.00     785.44  164.96 ?       ?      0.00    164.96 
1 1 1 -3  -1  7  o 6  103.02  8.21   306.94    48.14    344.06   59.23    234.69    82.64    108.98  9.56   88.75   16.84  20.23   19.36  
1 1 1 -3  -1  8  o 1  243.87  26.33  1750.40   362.71   1750.40  362.71   0.00      0.00     243.87  26.33  ?       ?      0.00    26.33  
1 1 1 -3  -1  9  o 18 143.70  21.37  611.80    170.90   0.00     0.00     611.80    170.90   ?       ?      143.70  21.37  0.00    21.37  
1 1 1 -3  -1  10 f 0  152.99  15.03  682.63    130.34   850.03   159.54   346.72    225.99   170.64  16.49  107.97  33.22  62.67   37.09  
1 1 1 -3  -1  11 o 4  385.07  32.90  4444.37   720.24   4697.16  882.06   3938.61   1247.65  392.25  39.72  341.77  65.98  50.48   77.01  
1 1 1 -3  -1  12 o 8  147.13  17.45  637.29    144.52   796.03   203.41   475.50    205.36   163.52  22.24  124.23  29.28  39.30   36.77  
1 1 1 -3  -1  13 o 1  271.96  43.12  2335.52   650.75   2335.52  650.75   0.00      0.00     271.96  43.12  ?       ?      0.00    43.12  
1 1 1 -3  -1  14 o 9  184.77  28.53  1035.24   292.93   0.00     0.00     1035.24   292.93   ?       ?      184.77  28.53  0.00    28.53  
1 1 1 -3  -1  15 o 2  286.44  29.12  2454.53   472.16   2159.12  664.20   2756.30   671.33   260.81  46.05  298.54  40.19  -37.74  61.12  
1 1 1 -3  -1  16 o 12 398.83  44.41  4900.07   999.60   5504.91  1411.72  4291.91   1415.59  410.74  61.78  354.31  72.05  56.43   94.92  
1 1 1 -3  -1  17 o 19 278.76  30.11  2304.95   474.19   2586.17  666.94   2017.46   674.35   291.70  40.95  254.43  47.93  37.27   63.04  
1 1 1 -3  -1  18 o 4  535.22  93.22  9908.27   2760.21  9908.27  2760.21  0.00      0.00     535.22  93.22  ?       ?      0.00    93.22  
1 1 1 -3  -1  19 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  -1  20 o 1  177.30  27.06  941.98    266.74   941.98   266.74   0.00      0.00     177.30  27.06  ?       ?      0.00    27.06  
1 1 1 -3  -1  21 o 7  329.35  36.91  3302.00   685.88   3777.31  965.17   2817.08   974.87   344.65  50.26  290.64  60.40  54.02   78.58  
1 1 1 -3  -1  22 o 17 198.59  22.01  1164.00   246.73   1182.02  331.39   1141.59   369.59   197.86  30.13  192.92  34.65  4.94    45.91  
1 1 1 -3  -1  23 o 6  136.43  14.35  544.01    110.68   844.17   124.55   -583.87   241.43   170.52  12.82  46.70   23.21  123.82  26.51  
1 1 1 -3  -1  24 o 1  295.96  31.71  2662.94   530.42   2621.24  741.24   2706.70   759.35   284.64  47.00  289.05  47.40  -4.42   66.76  
1 1 1 -3  -1  25 o 16 120.81  17.18  435.09    115.78   349.73   139.10   627.68    208.93   106.54  23.39  142.60  26.50  -36.07  35.34  
1 1 1 -3  -1  26 o 5  264.05  29.29  2158.45   436.47   2176.18  607.38   2139.51   627.65   255.11  43.00  251.10  45.20  4.01    62.39  
1 1 1 -3  -1  27 o 5  340.67  39.19  3875.41   752.55   3602.30  1056.69  4156.50   1072.01  296.21  64.01  325.75  59.52  -29.54  87.41  
1 1 1 -3  -1  28 f 0  142.85  18.62  619.79    149.07   618.44   185.31   622.25    250.95   140.34  23.85  136.19  32.54  4.16    40.35  
1 1 1 -3  -1  29 o 9  86.97   31.40  231.01    200.83   0.00     0.00     231.01    200.83   ?       ?      86.97   31.40  0.00    31.40  
1 1 1 -3  -1  30 o 4  120.21  33.72  515.76    242.09   0.00     0.00     515.76    242.09   ?       ?      120.21  33.72  0.00    33.72  
1 1 1 -3  -1  31 o 7  71.87   21.82  166.44    97.90    166.44   97.90    0.00      0.00     71.87   21.82  ?       ?      0.00    21.82  
1 1 1 -3  0   1  o 8  353.16  36.31  3686.55   725.62   3831.73  1026.20  3541.39   1026.16  355.02  51.88  340.14  54.38  14.88   75.16  
1 1 1 -3  0   2  o 4  328.98  50.05  3287.07   915.53   0.00     0.00     3287.07   915.53   ?       ?      328.98  50.05  0.00    50.05  
1 1 1 -3  0   3  o 2  454.18  47.21  6177.46   1213.07  6620.15  1715.57  5734.80   1715.52  461.30  66.72  425.74  72.81  35.56   98.75  
1 1 1 -3  0   4  o 12 557.68  59.04  9481.99   1861.54  10075.80 2632.63  8888.20   2632.59  558.78  84.73  519.55  91.61  39.23   124.79 
1 1 1 -3  0   5  f 0  683.73  74.82  14690.30  2888.78  15305.64 4085.36  14074.96  4085.34  666.26  110.70 632.57  116.80 33.69   160.92 
1 1 1 -3  0   6  o 3  594.89  64.01  10932.92  2151.77  11084.90 3043.07  10780.94  3043.05  575.79  95.40  566.31  97.10  9.48    136.12 
1 1 1 -3  0   7  o 4  516.18  54.97  8131.16   1603.79  8455.50  2268.10  7806.82   2268.09  510.53  80.02  487.37  84.11  23.16   116.09 
1 1 1 -3  0   8  x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  0   9  o 16 218.72  17.24  1390.92   214.71   1459.51  263.07   1254.09   371.59   223.46  20.74  204.13  32.82  19.32   38.83  
1 1 1 -3  0   10 f 0  352.56  27.72  3664.85   556.45   3840.46  681.47   3313.52   963.90   358.83  33.47  323.71  53.75  35.12   63.32  
1 1 1 -3  0   11 o 5  266.93  20.72  2086.95   315.01   2148.71  385.72   1963.25   545.87   269.60  25.21  252.65  38.88  16.96   46.34  
1 1 1 -3  0   12 o 10 103.02  8.61   307.65    50.45    321.00   61.12    279.11    89.36    105.04  10.27  96.74   16.69  8.29    19.60  
1 1 1 -3  0   13 o 17 260.51  25.77  2022.07   380.36   2022.07  380.36   0.00      0.00     260.51  25.77  ?       ?      0.00    25.77  
1 1 1 -3  0   14 o 3  70.50   9.19   145.58    36.31    143.27   47.69    148.76    55.98    69.38   12.43  70.42   14.34  -1.04   18.98  
1 1 1 -3  0   15 o 13 358.59  39.09  3963.39   791.74   4151.53  1118.18  3774.24   1121.20  354.36  56.89  334.72  60.58  19.64   83.11  
1 1 1 -3  0   16 o 17 507.03  100.26 10100.67  2814.79  0.00     0.00     10100.67  2814.79  ?       ?      507.03  100.26 0.00    100.26 
1 1 1 -3  0   17 o 1  361.15  58.21  4168.87   1165.82  0.00     0.00     4168.87   1165.82  ?       ?      361.15  58.21  0.00    58.21  
1 1 1 -3  0   18 o 7  584.27  108.97 12640.45  3520.54  12640.45 3520.54  0.00      0.00     584.27  108.97 ?       ?      0.00    108.97 
1 1 1 -3  0   19 o 18 307.41  32.23  2806.68   560.35   2898.46  790.27   2713.88   794.66   307.25  46.24  296.23  48.40  11.02   66.93  
1 1 1 -3  0   20 o 3  759.45  97.66  21278.05  4159.08  20718.77 5881.18  21837.58  5882.48  629.87  161.80 658.16  157.75 -28.29  225.97 
1 1 1 -3  0   21 o 8  233.95  36.24  1680.08   471.03   1680.08  471.03   0.00      0.00     233.95  36.24  ?       ?      0.00    36.24  
1 1 1 -3  0   22 o 12 246.67  38.45  1878.08   526.68   1878.08  526.68   0.00      0.00     246.67  38.45  ?       ?      0.00    38.45  
1 1 1 -3  0   23 o 7  442.36  44.81  6073.36   1122.24  4614.39  1582.29  7550.17   1591.93  357.86  79.13  481.25  58.84  -123.40 98.61  
1 1 1 -3  0   24 o 5  314.59  33.85  3021.35   601.77   3030.77  844.92   3011.65   857.28   304.97  49.99  303.24  51.06  1.73    71.46  
1 1 1 -3  0   25 o 17 170.74  19.69  868.08    189.42   952.14   252.79   760.46    286.04   176.81  25.65  154.80  33.19  22.02   41.94  
1 1 1 -3  0   26 o 6  104.67  15.37  326.80    89.62    356.97   105.88   250.58    168.26   108.92  17.53  90.62   28.78  18.30   33.70  
1 1 1 -3  0   27 o 1  218.65  23.99  1465.44   296.14   1362.95  407.39   1580.29   431.23   202.91  36.31  219.46  35.44  -16.54  50.73  
1 1 1 -3  0   28 o 6  231.21  41.68  1894.87   532.82   1894.87  532.82   0.00      0.00     231.21  41.68  ?       ?      0.00    41.68  
1 1 1 -3  0   29 o 14 64.30   17.79  128.22    67.90    111.46   74.19    214.68    168.47   60.71   19.09  83.23   28.88  -22.52  34.62  
1 1 1 -3  0   30 o 4  218.18  46.16  1905.86   560.08   0.00     0.00     1905.86   560.08   ?       ?      218.18  46.16  0.00    46.16  
1 1 1 -3  0   31 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  1   1  o 10 778.09  86.97  19509.54  3818.30  21975.79 5399.94  17043.38  5399.85  785.58  123.84 665.59  145.40 119.99  190.99 
1 1 1 -3  1   2  o 17 295.22  30.23  2561.38   505.05   2491.92  714.25   2630.84   714.25   287.23  44.78  295.72  43.36  -8.49   62.33  
1 1 1 -3  1   3  o 18 931.76  111.89 29829.55  5865.10  31380.73 8294.52  28278.38  8294.48  865.68  172.96 801.40  184.16 64.29   252.65 
1 1 1 -3  1   4  o 13 576.47  61.16  10174.08  1992.99  11495.05 2818.55  8853.18   2818.48  597.13  84.59  512.46  99.39  84.67   130.51 
1 1 1 -3  1   5  o 6  286.87  29.24  2417.14   474.87   2552.16  671.58   2282.12   671.55   291.72  41.25  274.74  44.07  16.98   60.36  
1 1 1 -3  1   6  o 15 377.20  38.58  4224.27   823.58   4762.44  1164.75  3686.16   1164.69  395.42  52.62  343.58  61.30  51.84   80.78  
1 1 1 -3  1   7  o 18 537.64  90.28  9652.35   2687.78  9652.35  2687.78  0.00      0.00     537.64  90.28  ?       ?      0.00    90.28  
1 1 1 -3  1   8  o 2  181.88  27.07  983.43    274.00   0.00     0.00     983.43    274.00   ?       ?      181.88  27.07  0.00    27.07  
1 1 1 -3  1   9  o 7  227.02  20.34  1505.05   262.22   1273.34  321.17   1968.34   454.14   207.05  27.72  257.18  31.41  -50.12  41.89  
1 1 1 -3  1   10 o 11 265.85  25.15  2081.64   379.33   2081.64  379.33   0.00      0.00     265.85  25.15  ?       ?      0.00    25.15  
1 1 1 -3  1   11 o 19 173.09  13.18  870.02    129.95   905.63   159.03   798.46    225.42   176.17  15.90  163.34  24.82  12.83   29.47  
1 1 1 -3  1   12 f 0  188.68  15.77  1038.91   169.21   1106.67  207.08   902.79    293.51   194.12  18.82  171.76  30.90  22.36   36.18  
1 1 1 -3  1   13 o 14 248.44  24.21  1833.55   340.94   1833.55  340.94   0.00      0.00     248.44  24.21  ?       ?      0.00    24.21  
1 1 1 -3  1   14 o 3  111.54  11.54  363.04    72.84    337.56   101.25   390.38    104.87   106.44  17.15  114.81  16.38  -8.37   23.72  
1 1 1 -3  1   15 o 4  206.05  32.25  1300.38   368.98   0.00     0.00     1300.38   368.98   ?       ?      206.05  32.25  0.00    32.25  
1 1 1 -3  1   16 f 0  264.19  25.89  2072.71   387.58   1595.32  545.62   2558.97   550.67   224.43  43.92  290.69  33.62  -66.26  55.31  
1 1 1 -3  1   17 o 11 209.54  20.46  1287.96   242.95   1002.12  341.35   1581.42   345.86   180.99  34.10  230.84  26.58  -49.84  43.24  
1 1 1 -3  1   18 o 7  208.67  20.74  1275.16   245.19   1075.26  344.16   1481.17   349.39   188.48  33.01  223.40  27.85  -34.92  43.19  
1 1 1 -3  1   19 o 4  659.99  142.15 18765.21  5226.45  0.00     0.00     18765.21  5226.45  ?       ?      659.99  142.15 0.00    142.15 
1 1 1 -3  1   20 o 2  425.76  71.92  6078.33   1695.20  0.00     0.00     6078.33   1695.20  ?       ?      425.76  71.92  0.00    71.92  
1 1 1 -3  1   21 o 11 271.62  27.39  2197.79   421.20   1817.85  592.75   2585.31   598.63   239.64  44.73  290.87  36.66  -51.24  57.84  
1 1 1 -3  1   22 o 12 146.13  16.32  626.85    134.56   523.81   178.60   762.12    204.64   131.53  24.56  159.75  22.97  -28.22  33.63  
1 1 1 -3  1   23 o 14 240.68  37.44  1784.85   500.45   1784.85  500.45   0.00      0.00     240.68  37.44  ?       ?      0.00    37.44  
1 1 1 -3  1   24 f 0  178.19  27.59  962.79    273.12   962.79   273.12   0.00      0.00     178.19  27.59  ?       ?      0.00    27.59  
1 1 1 -3  1   25 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  1   26 o 15 106.35  14.87  336.52    88.33    362.47   110.73   291.11    146.48   109.55  18.25  96.41   25.91  13.14   31.69  
1 1 1 -3  1   27 o 8  131.67  16.09  517.65    119.07   549.01   157.35   475.62    182.14   133.87  21.18  122.31  26.69  11.56   34.07  
1 1 1 -3  1   28 o 17 113.03  15.46  384.34    97.70    437.56   125.63   302.91    155.39   119.46  18.95  96.64   26.98  22.81   32.97  
1 1 1 -3  1   29 o 16 55.93   17.42  94.17     61.90    135.18   72.62    -14.84    118.39   65.90   18.46  49.29   21.67  16.61   28.47  
1 1 1 -3  1   30 o 16 113.24  27.32  432.23    175.51   0.00     0.00     432.23    175.51   ?       ?      113.24  27.32  0.00    27.32  
1 1 1 -3  1   31 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  1   32 o 18 74.99   20.68  185.22    91.92    196.97   117.00   166.26    148.59   76.56   23.96  72.67   26.88  3.90    36.01  
1 1 1 -3  2   1  o 4  440.05  45.82  5790.42   1140.45  5769.34  1612.84  5811.49   1612.83  429.56  67.64  431.31  67.34  -1.74   95.44  
1 1 1 -3  2   2  o 8  436.17  45.35  5685.96   1118.92  5820.81  1582.42  5551.11   1582.38  432.34  65.83  421.08  67.76  11.26   94.47  
1 1 1 -3  2   3  o 19 775.23  87.03  19404.10  3806.29  21460.18 5382.94  17348.08  5382.87  772.84  125.64 672.34  143.81 100.50  190.97 
1 1 1 -3  2   4  f 0  484.19  50.70  7062.64   1388.34  7475.26  1963.42  6650.04   1963.38  486.97  72.44  455.78  77.83  31.19   106.32 
1 1 1 -3  2   5  o 5  550.33  91.55  10022.28  2790.84  10022.28 2790.84  0.00      0.00     550.33  91.55  ?       ?      0.00    91.55  
1 1 1 -3  2   6  o 16 420.34  66.30  5554.95   1546.89  0.00     0.00     5554.95   1546.89  ?       ?      420.34  66.30  0.00    66.30  
1 1 1 -3  2   7  x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  2   8  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  2   9  x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  2   10 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  2   11 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  2   12 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  2   13 o 15 230.87  35.87  1651.28   459.92   1651.28  459.92   0.00      0.00     230.87  35.87  ?       ?      0.00    35.87  
1 1 1 -3  2   14 o 15 478.45  105.49 10122.54  2819.27  0.00     0.00     10122.54  2819.27  ?       ?      478.45  105.49 0.00    105.49 
1 1 1 -3  2   15 o 7  316.33  32.41  3036.24   580.24   2601.08  819.86   3472.94   821.32   280.57  52.84  331.20  44.31  -50.64  68.96  
1 1 1 -3  2   16 o 6  372.40  63.27  4679.92   1304.22  0.00     0.00     4679.92   1304.22  ?       ?      372.40  63.27  0.00    63.27  
1 1 1 -3  2   17 o 2  307.51  31.47  2825.65   547.67   2534.91  773.92   3117.28   775.12   283.20  49.40  317.67  43.66  -34.47  65.93  
1 1 1 -3  2   18 o 16 403.60  41.71  4930.87   952.46   4243.17  1346.55  5619.45   1347.42  359.53  67.72  422.15  57.06  -62.61  88.56  
1 1 1 -3  2   19 o 2  235.90  23.98  1636.46   320.30   1476.50  451.95   1797.86   454.00   220.32  37.05  244.87  33.15  -24.54  49.71  
1 1 1 -3  2   20 o 6  420.72  45.04  5439.72   1070.94  5386.75  1514.21  5492.74   1514.87  402.81  67.89  407.44  67.10  -4.63   95.46  
1 1 1 -3  2   21 o 8  259.14  40.71  2091.49   585.64   0.00     0.00     2091.49   585.64   ?       ?      259.14  40.71  0.00    40.71  
1 1 1 -3  2   22 o 1  322.07  53.01  3385.03   945.96   0.00     0.00     3385.03   945.96   ?       ?      322.07  53.01  0.00    53.01  
1 1 1 -3  2   23 o 15 277.29  29.22  2304.14   458.11   2463.25  646.03   2143.21   649.72   281.25  41.24  260.04  45.16  21.21   61.16  
1 1 1 -3  2   24 o 18 150.30  16.45  664.18    139.63   665.83   193.12   662.37    202.12   148.75  23.39  147.99  24.66  0.76    33.98  
1 1 1 -3  2   25 o 9  172.84  18.53  886.44    180.97   919.53   253.17   851.86    258.80   173.36  26.26  165.99  28.17  7.37    38.51  
1 1 1 -3  2   26 o 16 145.66  23.60  651.64    190.61   651.64   190.61   0.00      0.00     145.66  23.60  ?       ?      0.00    23.60  
1 1 1 -3  2   27 o 11 81.31   18.19  203.63    82.80    203.63   82.80    0.00      0.00     81.31   18.19  ?       ?      0.00    18.19  
1 1 1 -3  2   28 o 8  128.41  15.53  495.02    112.18   454.00   154.40   540.89    163.27   119.78  23.29  131.40  22.45  -11.63  32.35  
1 1 1 -3  2   29 o 6  177.80  20.02  975.81    200.82   1048.53  281.08   899.98    287.03   178.49  28.38  162.43  31.92  16.06   42.71  
1 1 1 -3  2   30 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  2   31 o 6  107.20  22.17  377.78    131.91   377.78   131.91   0.00      0.00     107.20  22.17  ?       ?      0.00    22.17  
1 1 1 -3  2   32 o 1  42.96   17.38  32.01     66.49    48.10    83.82    4.70      109.20   48.88   19.61  48.09   20.98  0.79    28.72  
1 1 1 -3  3   1  o 11 506.10  53.23  7742.47   1523.51  8010.92  2154.59  7474.04   2154.54  501.66  77.29  482.22  80.68  19.44   111.73 
1 1 1 -3  3   2  o 19 706.23  77.98  15787.54  3108.75  15770.29 4396.45  15804.79  4396.43  667.50  119.10 668.42  118.94 -0.92   168.32 
1 1 1 -3  3   3  o 10 347.02  35.70  3560.69   701.06   3628.82  991.46   3492.57   991.44   345.08  51.63  337.97  52.83  7.11    73.87  
1 1 1 -3  3   4  o 17 324.38  33.31  3105.55   611.39   3158.45  864.66   3052.65   864.62   322.51  48.18  316.61  49.16  5.90    68.83  
1 1 1 -3  3   5  o 16 541.82  57.71  8993.96   1767.38  9575.01  2499.47  8412.94   2499.42  542.14  82.94  502.52  89.94  39.61   122.35 
1 1 1 -3  3   6  o 3  116.67  17.31  401.25    112.44   401.25   112.44   0.00      0.00     116.67  17.31  ?       ?      0.00    17.31  
1 1 1 -3  3   7  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  3   8  o 4  255.17  38.71  1972.13   549.25   0.00     0.00     1972.13   549.25   ?       ?      255.17  38.71  0.00    38.71  
1 1 1 -3  3   9  x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  3   10 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  3   11 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  3   12 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  3   13 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  3   14 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  3   15 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  3   16 o 11 226.66  34.92  1576.21   439.76   0.00     0.00     1576.21   439.76   ?       ?      226.66  34.92  0.00    34.92  
1 1 1 -3  3   17 o 6  371.44  39.19  4191.14   823.15   3688.97  1164.02  4693.45   1164.19  334.39  62.95  384.13  54.31  -49.74  83.14  
1 1 1 -3  3   18 o 8  240.96  24.74  1710.52   337.38   1805.05  477.12   1615.99   477.12   244.60  34.97  230.42  37.35  14.18   51.17  
1 1 1 -3  3   19 o 12 384.34  40.51  4465.96   880.37   4351.93  1245.02  4580.00   1245.05  368.13  61.05  379.01  59.15  -10.88  85.01  
1 1 1 -3  3   20 o 4  339.56  35.86  3479.60   688.51   3181.31  973.68   3777.90   973.72   313.94  56.08  346.13  50.49  -32.19  75.46  
1 1 1 -3  3   21 o 16 394.56  43.55  4864.30   970.12   3824.24  1371.84  5904.75   1372.09  324.36  75.15  422.57  58.10  -98.22  94.99  
1 1 1 -3  3   22 o 9  238.25  25.13  1691.44   338.57   1440.22  478.83   1942.61   478.78   213.52  40.55  251.92  33.97  -38.40  52.90  
1 1 1 -3  3   23 o 17 183.00  28.47  1014.70   289.41   0.00     0.00     1014.70   289.41   ?       ?      183.00  28.47  0.00    28.47  
1 1 1 -3  3   24 o 19 196.28  30.71  1181.28   334.73   0.00     0.00     1181.28   334.73   ?       ?      196.28  30.71  0.00    30.71  
1 1 1 -3  3   25 o 4  145.86  15.92  628.57    131.18   627.84   186.26   629.28    184.77   143.50  23.42  143.75  23.18  -0.25   32.95  
1 1 1 -3  3   26 o 2  107.39  13.51  341.45    81.44    292.40   117.27   387.14    113.18   97.14   21.59  113.22  18.02  -16.08  28.12  
1 1 1 -3  3   27 o 10 179.92  30.10  1042.24   299.96   1042.24  299.96   0.00      0.00     179.92  30.10  ?       ?      0.00    30.10  
1 1 1 -3  3   28 o 4  100.84  20.96  319.96    117.38   319.96   117.38   0.00      0.00     100.84  20.96  ?       ?      0.00    20.96  
1 1 1 -3  3   29 o 3  60.79   20.61  108.90    85.68    108.90   85.68    0.00      0.00     60.79   20.61  ?       ?      0.00    20.61  
1 1 1 -3  3   30 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  3   31 o 18 79.33   16.26  198.45    71.57    162.25   108.26   226.55    95.38    70.60   23.15  83.21   20.18  -12.61  30.71  
1 1 1 -3  3   32 o 10 65.60   17.68  139.52    68.10    147.90   105.53   133.54    89.16    67.27   22.87  64.18   21.00  3.09    31.05  
1 1 1 -3  4   1  o 1  347.01  53.30  3689.19   1027.90  3689.19  1027.90  0.00      0.00     347.01  53.30  ?       ?      0.00    53.30  
1 1 1 -3  4   2  o 17 423.99  44.22  5381.43   1060.56  5574.21  1499.89  5188.67   1499.83  422.67  63.80  406.09  66.65  16.58   92.26  
1 1 1 -3  4   3  o 10 462.75  74.40  6856.03   1909.49  0.00     0.00     6856.03   1909.49  ?       ?      462.75  74.40  0.00    74.40  
1 1 1 -3  4   4  o 4  652.30  120.43 15598.06  4343.58  15598.06 4343.58  0.00      0.00     652.30  120.43 ?       ?      0.00    120.43 
1 1 1 -3  4   5  o 19 811.89  96.97  22499.48  4430.18  22442.42 6265.22  22556.55  6265.21  728.69  154.57 731.40  154.09 -2.71   218.25 
1 1 1 -3  4   6  x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  4   7  o 10 780.83  97.31  21481.63  4267.59  19116.54 6035.27  23846.76  6035.30  627.17  165.32 743.56  146.60 -116.39 220.96 
1 1 1 -3  4   8  o 8  189.87  28.52  1078.96   301.23   1078.96  301.23   0.00      0.00     189.87  28.52  ?       ?      0.00    28.52  
1 1 1 -3  4   9  o 13 436.78  75.43  6546.42   1823.01  0.00     0.00     6546.42   1823.01  ?       ?      436.78  75.43  0.00    75.43  
1 1 1 -3  4   10 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  4   11 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  4   12 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  4   13 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  4   14 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  4   15 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  4   16 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  4   17 o 16 307.14  48.26  2953.82   822.92   0.00     0.00     2953.82   822.92   ?       ?      307.14  48.26  0.00    48.26  
1 1 1 -3  4   18 o 12 427.58  45.62  5592.80   1102.50  5684.79  1559.21  5500.81   1559.12  416.79  67.47  408.85  68.87  7.94    96.41  
1 1 1 -3  4   19 o 13 108.95  11.43  345.70    70.44    322.34   100.22   368.51    99.01    104.17  17.37  111.82  15.87  -7.65   23.53  
1 1 1 -3  4   20 o 9  226.76  23.37  1519.81   299.83   1584.38  424.30   1455.40   423.74   228.31  33.36  218.04  35.04  10.28   48.38  
1 1 1 -3  4   21 o 7  114.06  12.23  380.14    78.83    336.33   112.52   422.35    110.46   105.81  19.23  119.48  16.55  -13.67  25.37  
1 1 1 -3  4   22 o 3  156.19  16.26  715.94    143.65   735.60   203.97   696.59    202.33   156.57  23.41  152.12  23.96  4.44    33.50  
1 1 1 -3  4   23 o 11 156.06  24.49  733.41    212.23   733.41   212.23   0.00      0.00     156.06  24.49  ?       ?      0.00    24.49  
1 1 1 -3  4   24 o 9  137.83  21.70  571.90    166.01   0.00     0.00     571.90    166.01   ?       ?      137.83  21.70  0.00    21.70  
1 1 1 -3  4   25 o 10 143.76  22.90  630.58    182.64   0.00     0.00     630.58    182.64   ?       ?      143.76  22.90  0.00    22.90  
1 1 1 -3  4   26 o 4  206.66  34.18  1388.30   391.38   0.00     0.00     1388.30   391.38   ?       ?      206.66  34.18  0.00    34.18  
1 1 1 -3  4   27 o 11 208.21  23.05  1337.14   270.95   1251.39  383.44   1422.67   382.93   192.29  36.06  207.56  33.26  -15.28  49.06  
1 1 1 -3  4   28 o 4  165.18  19.51  838.36    181.44   600.72   257.21   1073.74   255.98   131.07  33.92  183.62  24.93  -52.54  42.10  
1 1 1 -3  4   29 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  4   30 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  4   31 o 18 47.73   19.26  43.26     81.31    0.00     0.00     43.26     81.31    ?       ?      47.73   19.26  0.00    19.26  
1 1 1 -3  4   32 o 5  80.73   21.79  222.57    103.32   0.00     0.00     222.57    103.32   ?       ?      80.73   21.79  0.00    21.79  
1 1 1 -3  5   1  o 3  203.63  20.78  1212.15   239.54   1268.68  338.82   1155.67   338.69   206.57  29.40  196.59  31.04  9.98    42.75  
1 1 1 -3  5   2  o 14 495.72  82.31  8115.25   2260.32  8115.25  2260.32  0.00      0.00     495.72  82.31  ?       ?      0.00    82.31  
1 1 1 -3  5   3  o 13 191.24  28.63  1089.51   304.68   1089.51  304.68   0.00      0.00     191.24  28.63  ?       ?      0.00    28.63  
1 1 1 -3  5   4  o 9  357.72  56.00  3992.36   1112.31  3992.36  1112.31  0.00      0.00     357.72  56.00  ?       ?      0.00    56.00  
1 1 1 -3  5   5  o 9  221.81  33.44  1478.09   412.52   1478.09  412.52   0.00      0.00     221.81  33.44  ?       ?      0.00    33.44  
1 1 1 -3  5   6  o 1  460.79  77.91  7136.37   1987.55  0.00     0.00     7136.37   1987.55  ?       ?      460.79  77.91  0.00    77.91  
1 1 1 -3  5   7  o 1  71.43   8.23   148.68    33.14    140.40   48.13    156.15    45.70    68.71   12.67  72.77   11.31  -4.07   16.98  
1 1 1 -3  5   8  o 6  70.16   8.13   143.47    32.13    164.84   47.54    125.50    43.59    74.78   11.44  64.93   12.14  9.85    16.68  
1 1 1 -3  5   9  o 8  140.79  13.75  578.37    109.75   0.00     0.00     578.37    109.75   ?       ?      140.79  13.75  0.00    13.75  
1 1 1 -3  5   10 f 0  96.87   8.39   272.15    46.19    210.12   81.58    301.42    56.04    83.48   17.58  101.81  9.71   -18.33  20.08  
1 1 1 -3  5   11 o 17 74.98   7.53   163.41    31.96    0.00     0.00     163.41    31.96    ?       ?      74.98   7.53   0.00    7.53   
1 1 1 -3  5   12 o 16 478.06  50.15  7450.05   1355.84  0.00     0.00     7450.05   1355.84  ?       ?      478.06  50.15  0.00    50.15  
1 1 1 -3  5   13 o 6  307.28  51.10  3122.69   869.78   0.00     0.00     3122.69   869.78   ?       ?      307.28  51.10  0.00    51.10  
1 1 1 -3  5   14 f 0  298.54  31.33  2704.38   528.89   2648.44  747.94   2760.34   748.00   286.15  47.17  293.03  45.98  -6.88   65.87  
1 1 1 -3  5   15 o 18 451.36  52.16  6580.13   1326.56  7057.05  1876.03  6103.20   1876.05  441.12  76.88  401.18  84.15  39.94   113.98 
1 1 1 -3  5   16 o 3  737.33  100.48 21155.47  4142.67  20785.38 5858.58  21525.57  5858.66  590.12  166.01 608.93  163.97 -18.81  233.33 
1 1 1 -3  5   17 o 2  267.98  41.27  2205.65   614.58   2205.65  614.58   0.00      0.00     267.98  41.27  ?       ?      0.00    41.27  
1 1 1 -3  5   18 o 7  270.15  27.68  2160.33   423.26   2100.57  598.53   2220.11   598.64   261.69  41.20  269.70  39.86  -8.01   57.33  
1 1 1 -3  5   19 o 1  275.63  28.18  2256.02   439.55   2092.94  621.54   2419.19   621.70   259.68  43.21  281.16  39.61  -21.48  58.62  
1 1 1 -3  5   20 o 16 373.88  39.95  4311.61   844.10   4083.14  1193.75  4540.06   1193.73  347.74  62.08  370.40  58.05  -22.66  84.99  
1 1 1 -3  5   21 o 5  87.41   10.28  223.39    50.59    242.35   74.83    207.44    68.66    90.24   14.97  83.35   14.90  6.89    21.12  
1 1 1 -3  5   22 o 7  279.37  44.83  2489.34   694.71   0.00     0.00     2489.34   694.71   ?       ?      279.37  44.83  0.00    44.83  
1 1 1 -3  5   23 o 9  162.59  25.82  800.13    232.92   800.13   232.92   0.00      0.00     162.59  25.82  ?       ?      0.00    25.82  
1 1 1 -3  5   24 o 4  141.88  22.79  610.14    179.37   610.14   179.37   0.00      0.00     141.88  22.79  ?       ?      0.00    22.79  
1 1 1 -3  5   25 o 13 159.47  17.32  757.03    156.04   654.61   221.69   857.60    219.68   144.22  27.79  167.49  23.49  -23.27  36.39  
1 1 1 -3  5   26 o 13 45.07   16.23  51.16     53.61    0.00     0.00     51.16     53.61    ?       ?      45.07   16.23  0.00    16.23  
1 1 1 -3  5   27 o 19 186.66  31.60  1152.43   326.52   0.00     0.00     1152.43   326.52   ?       ?      186.66  31.60  0.00    31.60  
1 1 1 -3  5   28 o 6  62.06   13.78  118.31    47.81    136.61   80.47    108.33    59.43    66.17   19.71  59.19   16.74  6.98    25.86  
1 1 1 -3  5   29 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  5   30 o 12 107.55  22.71  383.38    135.82   383.38   135.82   0.00      0.00     107.55  22.71  ?       ?      0.00    22.71  
1 1 1 -3  5   31 o 18 70.16   21.70  164.44    96.30    164.44   96.30    0.00      0.00     70.16   21.70  ?       ?      0.00    21.70  
1 1 1 -3  6   1  o 2  457.20  76.57  6959.52   1938.71  0.00     0.00     6959.52   1938.71  ?       ?      457.20  76.57  0.00    76.57  
1 1 1 -3  6   2  o 1  368.87  38.67  4089.07   806.66   3969.27  1140.82  4208.86   1140.76  353.81  58.19  365.68  56.13  -11.87  80.85  
1 1 1 -3  6   3  o 5  70.90   8.47   146.60    33.79    187.97   48.48    107.54    47.11    80.08   10.82  59.87   13.96  20.21   17.67  
1 1 1 -3  6   4  o 6  488.27  85.92  8330.90   2320.42  0.00     0.00     8330.90   2320.42  ?       ?      488.27  85.92  0.00    85.92  
1 1 1 -3  6   5  x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  6   6  o 13 199.35  30.30  1199.08   335.83   1199.08  335.83   0.00      0.00     199.35  30.30  ?       ?      0.00    30.30  
1 1 1 -3  6   7  o 13 213.55  22.19  1346.08   268.05   1289.43  379.69   1402.37   378.49   205.50  33.33  215.11  31.59  -9.61   45.92  
1 1 1 -3  6   8  o 12 199.96  30.55  1214.63   339.57   0.00     0.00     1214.63   339.57   ?       ?      199.96  30.55  0.00    30.55  
1 1 1 -3  6   9  o 5  241.63  19.43  1714.82   267.23   1615.44  463.52   1764.30   327.06   228.06  36.64  243.80  23.67  -15.73  43.62  
1 1 1 -3  6   10 o 10 344.43  36.86  3660.94   717.56   3693.68  1015.20  3628.24   1014.38  332.58  55.10  329.10  55.67  3.48    78.33  
1 1 1 -3  6   11 o 16 142.31  11.45  588.90    92.74    509.00   161.29   628.35    113.34   129.78  22.46  146.65  13.62  -16.87  26.27  
1 1 1 -3  6   12 o 18 580.15  68.68  12076.25  2242.96  0.00     0.00     12076.25  2242.96  ?       ?      580.15  68.68  0.00    68.68  
1 1 1 -3  6   13 f 0  207.81  21.09  1278.87   248.13   0.00     0.00     1278.87   248.13   ?       ?      207.81  21.09  0.00    21.09  
1 1 1 -3  6   14 o 14 528.11  55.50  9161.72   1657.36  0.00     0.00     9161.72   1657.36  ?       ?      528.11  55.50  0.00    55.50  
1 1 1 -3  6   15 o 14 463.32  36.50  6506.16   963.03   5540.84  1667.02  6989.69   1179.83  394.61  76.35  474.95  43.76  -80.34  88.00  
1 1 1 -3  6   16 o 19 389.46  30.20  4501.35   669.83   4066.30  1158.89  4719.61   820.83   354.42  59.03  395.90  36.53  -41.48  69.42  
1 1 1 -3  6   17 o 16 612.15  73.76  12505.48  2539.98  13716.30 3592.06  11294.63  3592.09  596.36  108.94 521.04  122.22 75.32   163.72 
1 1 1 -3  6   18 o 1  108.70  16.75  349.78    101.16   349.78   101.16   0.00      0.00     108.70  16.75  ?       ?      0.00    16.75  
1 1 1 -3  6   19 o 9  226.80  23.08  1520.26   296.26   1454.92  418.77   1585.73   419.18   218.00  34.62  228.43  32.92  -10.42  47.77  
1 1 1 -3  6   20 o 12 367.09  39.51  4187.40   819.61   4080.36  1159.02  4294.46   1159.20  345.69  60.61  356.54  58.67  -10.85  84.36  
1 1 1 -3  6   21 o 16 140.22  14.58  576.24    115.67   546.15   163.94   606.08    163.24   134.72  21.95  142.45  20.56  -7.73   30.07  
1 1 1 -3  6   22 o 12 312.04  32.80  2963.42   578.74   2770.69  818.61   3156.02   818.32   290.58  50.93  313.33  46.94  -22.74  69.26  
1 1 1 -3  6   23 o 2  241.35  38.48  1838.52   515.31   1838.52  515.31   0.00      0.00     241.35  38.48  ?       ?      0.00    38.48  
1 1 1 -3  6   24 o 4  163.32  17.61  791.82    162.49   899.34   230.27   685.19    229.32   171.90  23.99  148.14  27.99  23.76   36.86  
1 1 1 -3  6   25 o 14 200.45  21.23  1216.21   240.59   1047.41  341.18   1383.17   339.31   178.61  34.52  209.50  28.99  -30.89  45.08  
1 1 1 -3  6   26 o 8  190.63  31.60  1187.27   333.72   0.00     0.00     1187.27   333.72   ?       ?      190.63  31.60  0.00    31.60  
1 1 1 -3  6   27 o 11 149.70  24.77  716.34    205.39   0.00     0.00     716.34    205.39   ?       ?      149.70  24.77  0.00    24.77  
1 1 1 -3  6   28 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  6   29 f 0  107.69  19.69  370.08    117.23   0.00     0.00     370.08    117.23   ?       ?      107.69  19.69  0.00    19.69  
1 1 1 -3  6   30 o 14 130.18  23.78  569.94    171.17   0.00     0.00     569.94    171.17   ?       ?      130.18  23.78  0.00    23.78  
1 1 1 -3  6   31 o 12 128.73  27.35  603.46    195.87   603.46   195.87   0.00      0.00     128.73  27.35  ?       ?      0.00    27.35  
1 1 1 -3  7   1  o 4  512.16  57.54  8431.21   1662.44  8314.42  2351.09  8548.00   2351.01  475.38  89.43  484.01  87.85  -8.63   125.36 
1 1 1 -3  7   2  o 8  72.27   13.19  155.45    52.70    0.00     0.00     155.45    52.70    ?       ?      72.27   13.19  0.00    13.19  
1 1 1 -3  7   3  o 19 189.56  28.81  1083.22   303.66   0.00     0.00     1083.22   303.66   ?       ?      189.56  28.81  0.00    28.81  
1 1 1 -3  7   4  x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  7   5  o 11 315.29  50.93  3193.66   890.40   0.00     0.00     3193.66   890.40   ?       ?      315.29  50.93  0.00    50.93  
1 1 1 -3  7   6  o 8  444.18  50.27  6311.76   1259.27  5761.55  1781.03  6861.79   1780.74  393.45  81.54  440.15  73.03  -46.70  109.46 
1 1 1 -3  7   7  o 2  189.93  29.08  1096.02   307.03   0.00     0.00     1096.02   307.03   ?       ?      189.93  29.08  0.00    29.08  
1 1 1 -3  7   8  o 9  190.97  29.50  1111.75   312.98   1111.75  312.98   0.00      0.00     190.97  29.50  ?       ?      0.00    29.50  
1 1 1 -3  7   9  o 14 183.22  27.98  1021.42   284.99   0.00     0.00     1021.42   284.99   ?       ?      183.22  27.98  0.00    27.98  
1 1 1 -3  7   10 o 19 309.12  32.69  2918.87   571.40   2953.37  808.81   2884.48   807.34   300.74  48.50  296.70  49.12  4.03    69.03  
1 1 1 -3  7   11 o 1  109.78  8.87   349.56    55.40    365.58   99.25    342.30    66.78    111.03  16.04  108.34  10.88  2.69    19.38  
1 1 1 -3  7   12 o 13 342.71  32.48  3570.36   631.41   0.00     0.00     3570.36   631.41   ?       ?      342.71  32.48  0.00    32.48  
1 1 1 -3  7   13 o 6  144.15  14.94  608.53    121.81   0.00     0.00     608.53    121.81   ?       ?      144.15  14.94  0.00    14.94  
1 1 1 -3  7   14 o 4  424.87  43.89  5605.88   1055.11  0.00     0.00     5605.88   1055.11  ?       ?      424.87  43.89  0.00    43.89  
1 1 1 -3  7   15 f 0  352.14  28.72  3674.81   575.56   3722.95  995.13   3650.61   705.54   342.70  52.23  347.98  35.83  -5.28   63.34  
1 1 1 -3  7   16 o 6  143.15  12.56  595.35    102.14   614.05   163.93   583.49    130.60   144.02  20.40  141.10  16.43  2.93    26.19  
1 1 1 -3  7   17 o 4  207.24  18.69  1255.39   219.98   1556.49  373.85   1095.93   272.06   228.27  29.20  192.02  25.30  36.25   38.63  
1 1 1 -3  7   18 o 19 463.30  41.06  6569.62   1080.71  7057.58  1869.79  6324.84   1324.32  450.41  74.95  445.79  52.77  4.62    91.66  
1 1 1 -3  7   19 o 11 103.94  12.54  316.72    73.30    404.84   104.80   232.30    102.57   117.04  16.02  87.41   20.75  29.63   26.21  
1 1 1 -3  7   20 o 14 178.80  27.60  973.00    274.20   973.00   274.20   0.00      0.00     178.80  27.60  ?       ?      0.00    27.60  
1 1 1 -3  7   21 o 13 100.41  11.29  294.81    63.94    252.48   91.24    335.64    89.62    91.54   18.01  106.53  15.08  -14.99  23.48  
1 1 1 -3  7   22 o 11 207.83  22.03  1283.54   258.80   1330.69  365.66   1236.23   366.33   208.08  31.60  199.80  33.10  8.28    45.76  
1 1 1 -3  7   23 o 11 203.20  21.78  1235.03   250.05   1313.28  353.67   1156.81   353.59   205.62  30.92  191.59  33.36  14.03   45.48  
1 1 1 -3  7   24 o 8  205.38  33.54  1357.27   381.84   1357.27  381.84   0.00      0.00     205.38  33.54  ?       ?      0.00    33.54  
1 1 1 -3  7   25 o 16 83.96   11.90  209.38    55.75    222.75   79.98    196.76    77.74    85.36   16.92  80.00   17.42  5.36    24.29  
1 1 1 -3  7   26 o 13 117.56  19.91  428.02    129.58   0.00     0.00     428.02    129.58   ?       ?      117.56  19.91  0.00    19.91  
1 1 1 -3  7   27 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  7   28 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  7   29 o 16 91.40   13.07  254.32    66.62    239.47   101.44   265.58    88.35    85.27   20.89  91.54   17.45  -6.27   27.22  
1 1 1 -3  7   30 o 18 92.69   21.63  290.16    112.99   290.16   112.99   0.00      0.00     92.69   21.63  ?       ?      0.00    21.63  
1 1 1 -3  7   31 o 5  104.68  14.28  342.48    83.56    331.79   129.62   350.08    109.30   96.60   23.58  102.63  19.26  -6.03   30.45  
1 1 1 -3  8   1  o 2  130.52  13.85  498.25    102.19   480.65   144.83   515.70    144.23   126.76  20.61  131.61  19.69  -4.86   28.51  
1 1 1 -3  8   2  o 9  126.79  13.56  470.14    97.13    472.66   139.09   467.74    135.70   125.82  19.92  125.24  19.51  0.58    27.88  
1 1 1 -3  8   3  o 5  293.11  47.20  2749.76   767.24   0.00     0.00     2749.76   767.24   ?       ?      293.11  47.20  0.00    47.20  
1 1 1 -3  8   4  x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  8   5  o 14 332.40  55.84  3685.68   1027.74  0.00     0.00     3685.68   1027.74  ?       ?      332.40  55.84  0.00    55.84  
1 1 1 -3  8   6  o 6  68.21   13.15  139.12    49.61    0.00     0.00     139.12    49.61    ?       ?      68.21   13.15  0.00    13.15  
1 1 1 -3  8   7  x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  8   8  o 8  346.30  26.93  3586.40   531.19   3886.47  921.13   3436.89   650.20   346.73  47.53  334.84  34.31  11.89   58.62  
1 1 1 -3  8   9  o 4  110.44  9.77   354.49    61.31    500.70   92.28    238.97    82.03    130.99  12.42  89.24   16.62  41.75   20.75  
1 1 1 -3  8   10 o 8  478.14  46.07  7284.04   1249.05  6036.01  2163.84  7907.69   1529.62  369.62  99.70  487.72  55.63  -118.10 114.17 
1 1 1 -3  8   11 o 15 486.59  43.27  7418.31   1196.06  6648.04  2072.82  7802.78   1464.44  406.85  91.03  489.22  52.99  -82.37  105.33 
1 1 1 -3  8   12 o 9  174.20  26.46  914.41    256.28   0.00     0.00     914.41    256.28   ?       ?      174.20  26.46  0.00    26.46  
1 1 1 -3  8   13 o 8  184.20  27.91  1021.36   285.92   0.00     0.00     1021.36   285.92   ?       ?      184.20  27.91  0.00    27.91  
1 1 1 -3  8   14 o 18 249.15  38.26  1898.81   529.75   0.00     0.00     1898.81   529.75   ?       ?      249.15  38.26  0.00    38.26  
1 1 1 -3  8   15 o 19 146.72  22.23  640.25    181.37   0.00     0.00     640.25    181.37   ?       ?      146.72  22.23  0.00    22.23  
1 1 1 -3  8   16 o 16 267.57  26.62  2118.25   403.45   0.00     0.00     2118.25   403.45   ?       ?      267.57  26.62  0.00    26.62  
1 1 1 -3  8   17 o 11 399.93  44.35  4958.38   1001.10  5305.38  1415.68  4611.29   1415.87  398.95  63.98  366.72  69.80  32.23   94.69  
1 1 1 -3  8   18 o 16 109.24  11.17  348.00    69.08    302.97   102.77   385.12    93.31    100.45  18.50  114.40  14.54  -13.95  23.53  
1 1 1 -3  8   19 o 4  151.35  17.22  675.79    146.97   972.34   233.59   481.47    189.09   180.22  23.11  124.90  27.15  55.32   35.65  
1 1 1 -3  8   20 o 11 203.84  21.73  1233.92   250.36   1287.03  355.00   1181.36   353.13   204.78  31.18  195.45  32.62  9.33    45.13  
1 1 1 -3  8   21 o 17 180.08  23.53  971.65    237.42   1497.70  337.66   457.21    333.91   222.92  26.93  122.59  40.67  100.33  48.78  
1 1 1 -3  8   22 o 12 168.70  18.01  841.92    171.72   862.18   242.98   821.70    242.71   168.14  26.01  163.81  26.73  4.33    37.30  
1 1 1 -3  8   23 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  8   24 o 6  210.33  35.46  1465.61   412.91   0.00     0.00     1465.61   412.91   ?       ?      210.33  35.46  0.00    35.46  
1 1 1 -3  8   25 o 3  70.39   17.72  153.58    71.54    0.00     0.00     153.58    71.54    ?       ?      70.39   17.72  0.00    17.72  
1 1 1 -3  8   26 o 12 142.87  24.29  654.95    192.07   0.00     0.00     654.95    192.07   ?       ?      142.87  24.29  0.00    24.29  
1 1 1 -3  8   27 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  8   28 o 13 102.70  19.91  339.82    113.12   0.00     0.00     339.82    113.12   ?       ?      102.70  19.91  0.00    19.91  
1 1 1 -3  8   29 o 19 114.84  14.23  405.27    91.83    368.57   130.85   440.88    128.90   104.59  22.46  116.36  20.02  -11.77  30.09  
1 1 1 -3  8   30 o 13 95.58   14.04  284.75    74.75    278.23   109.81   290.38    102.04   89.96   21.55  93.20   19.69  -3.24   29.19  
1 1 1 -3  8   31 o 1  81.61   15.02  213.24    67.76    204.14   100.72   220.76    91.58    75.91   21.90  80.12   19.98  -4.21   29.65  
1 1 1 -3  9   1  o 3  291.78  47.21  2730.64   763.84   2730.64  763.84   0.00      0.00     291.78  47.21  ?       ?      0.00    47.21  
1 1 1 -3  9   2  o 14 171.80  18.08  868.66    175.64   854.99   250.04   881.98    246.78   168.01  26.83  170.97  25.96  -2.96   37.33  
1 1 1 -3  9   3  o 9  159.73  25.26  770.38    223.95   770.38   223.95   0.00      0.00     159.73  25.26  ?       ?      0.00    25.26  
1 1 1 -3  9   4  o 11 179.68  27.72  979.66    276.75   0.00     0.00     979.66    276.75   ?       ?      179.68  27.72  0.00    27.72  
1 1 1 -3  9   5  o 2  374.88  66.36  4935.67   1375.92  0.00     0.00     4935.67   1375.92  ?       ?      374.88  66.36  0.00    66.36  
1 1 1 -3  9   6  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  9   7  o 10 135.99  14.61  542.02    112.29   594.85   162.85   494.12    155.05   141.16  20.71  128.12  21.86  13.04   30.12  
1 1 1 -3  9   8  o 10 452.36  41.87  6377.20   1074.99  5385.72  1862.67  6872.37   1316.34  367.16  89.25  461.74  50.48  -94.58  102.54 
1 1 1 -3  9   9  o 8  354.81  60.13  4233.39   1181.00  0.00     0.00     4233.39   1181.00  ?       ?      354.81  60.13  0.00    60.13  
1 1 1 -3  9   10 o 16 514.15  109.73 11271.48  3140.11  0.00     0.00     11271.48  3140.11  ?       ?      514.15  109.73 0.00    109.73 
1 1 1 -3  9   11 o 1  143.53  25.69  622.21    203.88   0.00     0.00     622.21    203.88   ?       ?      143.53  25.69  0.00    25.69  
1 1 1 -3  9   12 o 9  222.94  35.31  1513.98   436.90   0.00     0.00     1513.98   436.90   ?       ?      222.94  35.31  0.00    35.31  
1 1 1 -3  9   13 o 5  301.09  31.15  2701.98   530.71   0.00     0.00     2701.98   530.71   ?       ?      301.09  31.15  0.00    31.15  
1 1 1 -3  9   14 o 5  429.37  72.59  6194.24   1725.62  0.00     0.00     6194.24   1725.62  ?       ?      429.37  72.59  0.00    72.59  
1 1 1 -3  9   15 o 14 300.50  28.66  2680.94   488.41   0.00     0.00     2680.94   488.41   ?       ?      300.50  28.66  0.00    28.66  
1 1 1 -3  9   16 f 0  329.89  30.10  3254.98   563.84   3886.60  972.13   2934.79   692.16   349.33  49.89  308.41  40.04  40.91   63.97  
1 1 1 -3  9   17 o 9  292.14  31.45  2587.79   519.12   2711.74  733.98   2463.72   734.31   291.23  45.38  275.62  48.16  15.60   66.17  
1 1 1 -3  9   18 o 15 168.39  26.10  860.61    244.13   0.00     0.00     860.61    244.13   ?       ?      168.39  26.10  0.00    26.10  
1 1 1 -3  9   19 o 12 224.21  35.39  1565.34   440.44   0.00     0.00     1565.34   440.44   ?       ?      224.21  35.39  0.00    35.39  
1 1 1 -3  9   20 o 6  118.40  20.23  421.62    132.56   0.00     0.00     421.62    132.56   ?       ?      118.40  20.23  0.00    20.23  
1 1 1 -3  9   21 o 8  151.16  24.43  694.59    204.75   0.00     0.00     694.59    204.75   ?       ?      151.16  24.43  0.00    24.43  
1 1 1 -3  9   22 o 4  246.93  41.59  2028.81   568.67   0.00     0.00     2028.81   568.67   ?       ?      246.93  41.59  0.00    41.59  
1 1 1 -3  9   23 o 15 99.77   18.52  304.62    102.19   0.00     0.00     304.62    102.19   ?       ?      99.77   18.52  0.00    18.52  
1 1 1 -3  9   24 o 12 158.69  26.35  801.45    231.65   0.00     0.00     801.45    231.65   ?       ?      158.69  26.35  0.00    26.35  
1 1 1 -3  9   25 o 10 53.30   16.57  85.20     56.07    0.00     0.00     85.20     56.07    ?       ?      53.30   16.57  0.00    16.57  
1 1 1 -3  9   26 o 13 63.51   13.58  124.18    48.02    134.58   64.75    111.47    71.58    65.43   17.06  60.10   18.73  5.33    25.34  
1 1 1 -3  9   27 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  9   28 o 6  120.76  22.36  485.52    149.32   485.52   149.32   0.00      0.00     120.76  22.36  ?       ?      0.00    22.36  
1 1 1 -3  9   29 o 13 55.70   15.67  99.26     52.21    127.77   72.02    67.68     75.81    62.40   18.66  50.36   19.08  12.04   26.69  
1 1 1 -3  9   30 o 16 56.60   16.20  104.64    55.31    112.62   76.90    96.08     79.61    58.47   19.52  55.33   19.79  3.14    27.80  
1 1 1 -3  10  1  o 13 460.80  85.27  7791.89   2172.49  7791.89  2172.49  0.00      0.00     460.80  85.27  ?       ?      0.00    85.27  
1 1 1 -3  10  2  o 5  357.63  59.65  4227.03   1181.56  4227.03  1181.56  0.00      0.00     357.63  59.65  ?       ?      0.00    59.65  
1 1 1 -3  10  3  x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  10  4  f 0  305.81  32.18  2817.39   556.46   2848.34  788.43   2786.67   785.49   299.66  47.41  296.09  47.84  3.57    67.35  
1 1 1 -3  10  5  o 16 279.62  44.48  2457.60   690.07   2457.60  690.07   0.00      0.00     279.62  44.48  ?       ?      0.00    44.48  
1 1 1 -3  10  6  o 17 395.82  68.01  5342.42   1489.66  0.00     0.00     5342.42   1489.66  ?       ?      395.82  68.01  0.00    68.01  
1 1 1 -3  10  7  o 14 214.01  12.90  1327.09   157.80   1773.24  280.06   1119.55   191.01   246.03  20.00  195.74  17.17  50.29   26.36  
1 1 1 -3  10  8  o 2  354.16  33.98  3769.50   682.32   4244.33  967.40   3299.47   962.50   368.99  46.72  320.40  54.26  48.58   71.60  
1 1 1 -3  10  9  o 19 449.92  50.21  6323.25   1274.73  0.00     0.00     6323.25   1274.73  ?       ?      449.92  50.21  0.00    50.21  
1 1 1 -3  10  10 o 3  384.74  25.67  4348.53   563.77   5376.79  986.62   3850.02   686.97   420.70  41.39  358.91  33.74  61.79   53.40  
1 1 1 -3  10  11 o 6  579.62  49.15  10357.30  1620.04  10386.07 2809.29  10342.97  1982.97  534.48  95.04  568.21  61.79  -33.73  113.36 
1 1 1 -3  10  12 o 18 265.62  18.58  2054.68   281.58   2279.92  501.06   1950.72   340.41   276.10  32.22  257.72  23.26  18.37   39.74  
1 1 1 -3  10  13 o 14 576.16  119.78 13742.54  3832.23  0.00     0.00     13742.54  3832.23  ?       ?      576.16  119.78 0.00    119.78 
1 1 1 -3  10  14 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  10  15 o 8  393.69  70.42  5447.59   1533.12  0.00     0.00     5447.59   1533.12  ?       ?      393.69  70.42  0.00    70.42  
1 1 1 -3  10  16 f 0  452.54  95.87  8626.05   2413.01  0.00     0.00     8626.05   2413.01  ?       ?      452.54  95.87  0.00    95.87  
1 1 1 -3  10  17 o 13 202.62  31.89  1266.68   358.70   1266.68  358.70   0.00      0.00     202.62  31.89  ?       ?      0.00    31.89  
1 1 1 -3  10  18 o 14 276.15  44.84  2453.87   686.43   2453.87  686.43   0.00      0.00     276.15  44.84  ?       ?      0.00    44.84  
1 1 1 -3  10  19 o 5  327.07  39.93  3362.78   734.18   4204.79  1038.46  2521.36   1038.10  355.79  52.41  261.12  68.44  94.67   86.20  
1 1 1 -3  10  20 o 10 204.71  20.45  1245.42   237.06   1382.48  370.20   1150.15   308.65   211.16  31.50  193.53  28.65  17.63   42.58  
1 1 1 -3  10  21 o 1  204.68  24.44  1277.13   281.47   1587.30  397.39   964.84    398.74   224.28  31.75  168.69  41.47  55.60   52.23  
1 1 1 -3  10  22 o 15 370.95  49.04  4987.69   1018.72  5386.86  1440.42  4588.23   1440.94  339.97  75.75  299.08  81.65  40.89   111.38 
1 1 1 -3  10  23 o 17 82.40   13.15  203.72    60.09    169.30   82.12    243.42    88.18    73.74   19.21  88.86   17.91  -15.12  26.26  
1 1 1 -3  10  24 o 14 173.11  20.48  926.15    199.63   1046.37  281.53   804.57    283.12   178.68  28.40  152.77  33.23  25.91   43.71  
1 1 1 -3  10  25 o 10 139.01  16.73  591.47    130.80   645.41   184.32   536.75    185.64   141.25  23.56  126.79  26.37  14.46   35.36  
1 1 1 -3  10  26 o 14 114.60  21.59  427.00    136.81   427.00   136.81   0.00      0.00     114.60  21.59  ?       ?      0.00    21.59  
1 1 1 -3  10  27 o 1  83.12   19.26  225.53    90.13    0.00     0.00     225.53    90.13    ?       ?      83.12   19.26  0.00    19.26  
1 1 1 -3  10  28 o 3  96.94   14.76  293.67    79.55    358.64   107.59   215.34    118.14   105.05  18.52  78.37   24.00  26.68   30.32  
1 1 1 -3  10  29 o 18 45.57   17.49  53.38     64.20    53.38    64.20    0.00      0.00     45.57   17.49  ?       ?      0.00    17.49  
1 1 1 -3  11  1  o 13 245.71  25.80  1779.47   358.56   1800.68  506.91   1758.23   507.24   243.80  37.41  240.67  37.97  3.13    53.31  
1 1 1 -3  11  2  x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  11  3  x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  11  4  o 18 340.00  54.02  3636.78   1019.07  3636.78  1019.07  0.00      0.00     340.00  54.02  ?       ?      0.00    54.02  
1 1 1 -3  11  5  o 14 547.93  101.89 11073.73  3087.15  11073.73 3087.15  0.00      0.00     547.93  101.89 ?       ?      0.00    101.89 
1 1 1 -3  11  6  o 2  703.50  59.31  15595.26  2373.02  14673.95 4111.13  16055.61  2906.02  602.64  123.00 697.58  73.68  -94.94  143.38 
1 1 1 -3  11  7  o 14 361.41  31.17  3870.33   640.28   3337.20  1111.92  4134.80   783.16   320.77  62.63  371.22  37.25  -50.45  72.87  
1 1 1 -3  11  8  o 1  321.54  24.80  3032.09   454.32   2999.22  790.19   3048.33   555.27   312.26  45.41  320.67  30.53  -8.41   54.72  
1 1 1 -3  11  9  o 16 446.05  42.56  6033.25   1076.68  0.00     0.00     6033.25   1076.68  ?       ?      446.05  42.56  0.00    42.56  
1 1 1 -3  11  10 o 1  414.30  36.12  5140.55   850.42   4648.62  1483.59  5381.29   1037.85  372.16  72.05  420.02  43.68  -47.86  84.25  
1 1 1 -3  11  11 o 6  270.04  22.20  2138.16   341.17   2266.17  619.77   2082.51   408.66   271.54  41.04  265.08  27.24  6.46    49.26  
1 1 1 -3  11  12 o 19 335.33  31.87  3368.80   606.12   0.00     0.00     3368.80   606.12   ?       ?      335.33  31.87  0.00    31.87  
1 1 1 -3  11  13 o 7  633.81  73.88  14196.50  2637.85  0.00     0.00     14196.50  2637.85  ?       ?      633.81  73.88  0.00    73.88  
1 1 1 -3  11  14 o 13 155.85  19.23  719.57    168.39   0.00     0.00     719.57    168.39   ?       ?      155.85  19.23  0.00    19.23  
1 1 1 -3  11  15 o 7  392.42  73.37  5711.06   1592.03  0.00     0.00     5711.06   1592.03  ?       ?      392.42  73.37  0.00    73.37  
1 1 1 -3  11  16 o 13 188.74  23.44  1065.76   248.52   0.00     0.00     1065.76   248.52   ?       ?      188.74  23.44  0.00    23.44  
1 1 1 -3  11  17 o 14 425.71  42.16  5706.77   1016.85  6517.85  1745.29  5289.96   1251.13  418.46  75.43  396.46  56.57  22.00   94.29  
1 1 1 -3  11  18 o 6  280.56  28.25  2378.24   448.76   2083.73  634.54   2672.92   634.74   252.89  45.38  291.41  38.91  -38.52  59.78  
1 1 1 -3  11  19 o 13 236.18  23.48  1676.09   314.15   1984.15  500.51   1475.84   403.54   250.23  35.87  216.58  33.54  33.65   49.11  
1 1 1 -3  11  20 o 8  347.41  37.50  3925.38   736.08   3488.86  990.72   4463.26   1099.75  303.03  59.08  345.80  57.41  -42.78  82.38  
1 1 1 -3  11  21 o 8  202.56  27.99  1297.29   316.78   1339.10  375.05   1193.20   591.76   202.02  33.51  173.17  53.84  28.85   63.42  
1 1 1 -3  11  22 o 11 139.67  21.28  603.77    165.24   605.80   177.31   590.36    455.63   139.09  23.01  126.97  47.06  12.12   52.38  
1 1 1 -3  11  23 o 7  169.82  28.85  952.50    271.16   952.50   271.16   0.00      0.00     169.82  28.85  ?       ?      0.00    28.85  
1 1 1 -3  11  24 o 5  100.25  18.81  316.47    104.27   316.85   106.73   308.50    487.64   100.11  19.27  102.09  44.44  -1.98   48.44  
1 1 1 -3  11  25 o 17 124.26  22.50  505.36    154.61   505.36   154.61   0.00      0.00     124.26  22.50  ?       ?      0.00    22.50  
1 1 1 -3  11  26 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  11  27 o 11 73.16   19.80  179.00    85.17    179.00   85.17    0.00      0.00     73.16   19.80  ?       ?      0.00    19.80  
1 1 1 -3  11  28 o 12 56.50   19.51  102.48    76.85    102.48   76.85    0.00      0.00     56.50   19.51  ?       ?      0.00    19.51  
1 1 1 -3  11  29 o 11 128.06  26.66  628.35    189.61   628.35   189.61   0.00      0.00     128.06  26.66  ?       ?      0.00    26.66  
1 1 1 -3  12  1  o 11 374.72  59.79  4432.80   1243.01  0.00     0.00     4432.80   1243.01  ?       ?      374.72  59.79  0.00    59.79  
1 1 1 -3  12  2  x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  12  3  o 2  676.73  78.20  15140.64  2981.99  15200.99 4218.82  15080.38  4215.51  623.80  122.18 620.57  122.68 3.24    173.15 
1 1 1 -3  12  4  o 16 600.49  68.34  11614.45  2314.04  11143.07 3274.50  12084.70  3270.59  546.65  108.18 576.49  102.59 -29.84  149.09 
1 1 1 -3  12  5  o 2  432.67  48.60  5749.50   1186.25  4760.48  1677.49  6738.79   1677.73  372.77  80.73  457.14  65.83  -84.37  104.17 
1 1 1 -3  12  6  o 14 643.74  63.88  13261.51  2329.41  15237.20 3297.08  11292.51  3291.50  660.06  89.30  543.92  109.21 116.13  141.07 
1 1 1 -3  12  7  o 3  272.61  42.06  2282.62   637.03   0.00     0.00     2282.62   637.03   ?       ?      272.61  42.06  0.00    42.06  
1 1 1 -3  12  8  o 2  291.21  45.50  2637.93   735.76   0.00     0.00     2637.93   735.76   ?       ?      291.21  45.50  0.00    45.50  
1 1 1 -3  12  9  o 6  683.43  70.10  15769.39  2711.23  18432.52 3840.48  13123.44  3828.07  690.65  99.75  539.58  125.90 151.07  160.62 
1 1 1 -3  12  10 o 10 151.10  19.09  674.65    161.93   0.00     0.00     674.65    161.93   ?       ?      151.10  19.09  0.00    19.09  
1 1 1 -3  12  11 o 4  233.15  28.76  1638.02   376.83   1525.51  565.07   1728.13   505.69   217.02  46.74  235.28  38.79  -18.26  60.74  
1 1 1 -3  12  12 o 5  163.75  22.00  800.45    201.54   262.95   414.58   966.78    230.62   111.24  43.94  179.96  22.84  -68.72  49.52  
1 1 1 -3  12  13 o 19 173.28  19.61  888.89    191.69   0.00     0.00     888.89    191.69   ?       ?      173.28  19.61  0.00    19.61  
1 1 1 -3  12  14 o 16 319.67  32.43  3110.49   586.84   0.00     0.00     3110.49   586.84   ?       ?      319.67  32.43  0.00    32.43  
1 1 1 -3  12  15 o 9  138.71  23.21  580.75    178.26   0.00     0.00     580.75    178.26   ?       ?      138.71  23.21  0.00    23.21  
1 1 1 -3  12  16 o 11 279.47  45.78  2529.16   709.04   0.00     0.00     2529.16   709.04   ?       ?      279.47  45.78  0.00    45.78  
1 1 1 -3  12  17 o 7  214.60  24.54  1386.46   296.94   0.00     0.00     1386.46   296.94   ?       ?      214.60  24.54  0.00    24.54  
1 1 1 -3  12  18 o 4  207.70  23.82  1307.87   278.92   1510.04  393.63   1104.03   395.27   218.79  32.31  182.89  38.85  35.90   50.53  
1 1 1 -3  12  19 o 9  334.25  40.60  3755.30   763.14   3994.96  1078.63  3515.10   1079.84  317.57  61.39  290.03  66.31  27.53   90.36  
1 1 1 -3  12  20 o 16 237.59  22.66  1730.41   305.37   1753.74  481.03   1714.66   395.21   226.79  38.31  230.74  30.59  -3.95   49.02  
1 1 1 -3  12  21 o 10 109.82  12.93  358.64    79.94    359.46   111.04   357.75    115.17   108.05  18.57  107.48  19.38  0.57    26.84  
1 1 1 -3  12  22 o 3  115.58  14.19  401.63    92.19    413.37   125.55   387.89    135.80   115.00  19.73  110.17  22.24  4.83    29.73  
1 1 1 -3  12  23 o 1  112.30  14.79  383.59    93.04    429.44   127.37   331.16    136.22   116.54  19.74  99.93   24.04  16.60   31.11  
1 1 1 -3  12  24 o 16 71.08   14.50  157.13    57.17    169.15   72.53    137.41    92.90    72.79   17.56  65.80   21.43  6.99    27.71  
1 1 1 -3  12  25 o 1  149.46  27.47  786.33    227.01   786.33   227.01   0.00      0.00     149.46  27.47  ?       ?      0.00    27.47  
1 1 1 -3  12  26 o 10 115.83  24.96  473.79    161.05   0.00     0.00     473.79    161.05   ?       ?      115.83  24.96  0.00    24.96  
1 1 1 -3  12  27 f 0  92.96   14.96  274.67    77.11    288.46   103.02   257.10    116.28   91.95   20.08  84.44   23.25  7.51    30.72  
1 1 1 -3  12  28 o 5  90.44   14.93  263.14    74.83    247.40   97.94    285.21    115.99   83.78   20.53  88.27   22.75  -4.49   30.64  
1 1 1 -3  13  1  o 3  219.04  39.86  1486.35   482.75   1486.35  482.75   0.00      0.00     219.04  39.86  ?       ?      0.00    39.86  
1 1 1 -3  13  2  o 5  412.15  70.73  5760.75   1613.17  0.00     0.00     5760.75   1613.17  ?       ?      412.15  70.73  0.00    70.73  
1 1 1 -3  13  3  x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  13  4  o 2  160.42  30.93  786.84    274.48   0.00     0.00     786.84    274.48   ?       ?      160.42  30.93  0.00    30.93  
1 1 1 -3  13  5  o 10 189.19  33.32  1096.72   348.65   0.00     0.00     1096.72   348.65   ?       ?      189.19  33.32  0.00    33.32  
1 1 1 -3  13  6  o 4  358.44  60.83  4283.62   1207.04  0.00     0.00     4283.62   1207.04  ?       ?      358.44  60.83  0.00    60.83  
1 1 1 -3  13  7  o 11 253.55  39.89  2003.24   561.46   0.00     0.00     2003.24   561.46   ?       ?      253.55  39.89  0.00    39.89  
1 1 1 -3  13  8  o 3  390.37  47.42  4848.52   1040.81  4373.71  1494.15  5296.09   1450.66  343.83  77.55  390.41  67.15  -46.59  102.58 
1 1 1 -3  13  9  o 4  359.55  28.53  3868.63   584.08   3999.56  1059.00  3811.39   700.21   347.82  54.85  353.31  34.98  -5.49   65.06  
1 1 1 -3  13  10 o 18 450.59  89.95  8052.99   2245.27  0.00     0.00     8052.99   2245.27  ?       ?      450.59  89.95  0.00    89.95  
1 1 1 -3  13  11 o 11 476.72  56.30  7517.94   1510.97  7444.94  2162.54  7587.58   2112.01  433.43  89.86  442.78  86.19  -9.35   124.52 
1 1 1 -3  13  12 o 9  198.01  35.85  1221.48   392.51   -90.67   663.80   1926.95   486.72   113.62  50.56  250.30  34.81  -136.68 61.38  
1 1 1 -3  13  13 o 5  341.70  22.99  3449.58   448.35   7123.78  748.41   1392.86   559.94   489.29  26.75  205.67  48.26  283.62  55.18  
1 1 1 -3  13  14 o 8  226.97  36.15  1609.35   455.28   0.00     0.00     1609.35   455.28   ?       ?      226.97  36.15  0.00    36.15  
1 1 1 -3  13  15 o 17 200.64  24.96  1216.09   281.28   0.00     0.00     1216.09   281.28   ?       ?      200.64  24.96  0.00    24.96  
1 1 1 -3  13  16 o 8  344.14  67.83  4630.08   1292.31  0.00     0.00     4630.08   1292.31  ?       ?      344.14  67.83  0.00    67.83  
1 1 1 -3  13  17 o 19 292.09  54.87  3169.46   886.25   0.00     0.00     3169.46   886.25   ?       ?      292.09  54.87  0.00    54.87  
1 1 1 -3  13  18 o 10 214.63  52.25  1767.97   637.65   0.00     0.00     1767.97   637.65   ?       ?      214.63  52.25  0.00    52.25  
1 1 1 -3  13  19 o 12 184.18  19.04  1027.78   198.45   1151.93  303.19   934.72    262.50   189.11  28.84  170.74  27.73  18.37   40.01  
1 1 1 -3  13  20 f 0  216.50  25.49  1491.03   310.74   1617.03  437.43   1362.66   441.51   215.09  36.74  192.65  41.17  22.44   55.18  
1 1 1 -3  13  21 o 14 46.05   15.01  61.78     45.55    66.49    55.35    51.88     80.18    48.48   16.56  49.70   19.42  -1.22   25.52  
1 1 1 -3  13  22 o 1  91.94   22.02  277.18    114.67   0.00     0.00     277.18    114.67   ?       ?      91.94   22.02  0.00    22.02  
1 1 1 -3  13  23 o 9  61.11   14.76  117.21    51.21    126.02   60.95    96.06     94.46    62.99   16.62  58.35   21.46  4.64    27.14  
1 1 1 -3  13  24 o 2  123.09  15.37  470.07    106.26   471.73   143.90   468.07    157.58   119.03  21.86  116.69  24.31  2.34    32.70  
1 1 1 -3  13  25 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  13  26 o 10 86.86   15.15  241.58    72.81    295.70   94.95    164.36    113.43   94.29   18.20  68.19   23.69  26.10   29.88  
1 1 1 -3  13  27 o 16 136.98  18.73  631.45    143.45   674.40   193.17   578.64    214.18   132.82  26.27  115.33  31.48  17.48   41.00  
1 1 1 -3  14  1  x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  14  2  o 11 548.47  116.83 12771.42  3565.77  0.00     0.00     12771.42  3565.77  ?       ?      548.47  116.83 0.00    116.83 
1 1 1 -3  14  3  o 1  223.14  30.16  1499.06   376.51   1284.11  603.14   1636.31   481.94   198.48  52.24  230.47  37.73  -31.99  64.44  
1 1 1 -3  14  4  o 15 556.94  70.02  10568.28  2189.35  9148.96  3107.96  11966.33  3084.58  451.93  118.40 549.36  101.55 -97.43  155.98 
1 1 1 -3  14  5  o 17 330.56  29.89  3264.80   561.07   2874.45  1025.76  3431.46   670.23   291.34  63.16  336.46  35.22  -45.11  72.31  
1 1 1 -3  14  6  o 7  623.45  61.08  12820.83  2157.96  11419.57 3755.18  13511.74  2636.84  476.49  132.50 619.70  75.69  -143.20 152.59 
1 1 1 -3  14  7  o 18 139.38  24.05  585.40    185.49   -2584.84 575.69   952.64    195.94   ?       ?      179.89  19.27  0.00    19.27  
1 1 1 -3  14  8  x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  14  9  o 3  462.17  92.91  8447.21   2379.38  0.00     0.00     8447.21   2379.38  ?       ?      462.17  92.91  0.00    92.91  
1 1 1 -3  14  10 o 8  107.56  43.36  209.37    411.83   0.00     0.00     209.37    411.83   ?       ?      107.56  43.36  0.00    43.36  
1 1 1 -3  14  11 o 7  217.53  47.88  1558.74   581.69   0.00     0.00     1558.74   581.69   ?       ?      217.53  47.88  0.00    47.88  
1 1 1 -3  14  12 f 0  174.10  23.19  911.16    226.02   384.13   573.02   1008.27   245.96   128.06  51.31  183.00  23.99  -54.94  56.64  
1 1 1 -3  14  13 o 16 175.77  28.62  956.05    278.89   0.00     0.00     956.05    278.89   ?       ?      175.77  28.62  0.00    28.62  
1 1 1 -3  14  14 o 19 113.03  19.04  386.86    119.16   0.00     0.00     386.86    119.16   ?       ?      113.03  19.04  0.00    19.04  
1 1 1 -3  14  15 o 9  209.13  34.81  1424.74   403.24   0.00     0.00     1424.74   403.24   ?       ?      209.13  34.81  0.00    34.81  
1 1 1 -3  14  16 o 4  288.51  57.08  3260.80   911.89   0.00     0.00     3260.80   911.89   ?       ?      288.51  57.08  0.00    57.08  
1 1 1 -3  14  17 o 9  188.57  31.94  1168.56   333.39   0.00     0.00     1168.56   333.39   ?       ?      188.57  31.94  0.00    31.94  
1 1 1 -3  14  18 o 13 114.58  20.98  410.92    132.93   0.00     0.00     410.92    132.93   ?       ?      114.58  20.98  0.00    20.98  
1 1 1 -3  14  19 o 1  85.72   19.62  232.65    94.46    0.00     0.00     232.65    94.46    ?       ?      85.72   19.62  0.00    19.62  
1 1 1 -3  14  20 o 13 124.63  24.10  509.59    166.16   0.00     0.00     509.59    166.16   ?       ?      124.63  24.10  0.00    24.10  
1 1 1 -3  14  21 o 15 33.05   13.92  6.67      45.07    8.60     53.02    1.62      85.58    35.83   15.10  43.24   18.72  -7.41   24.05  
1 1 1 -3  14  22 o 12 139.95  16.98  611.74    133.61   628.39   182.14   592.34    196.61   136.63  24.10  129.95  27.23  6.67    36.36  
1 1 1 -3  14  23 o 4  40.98   15.23  42.65     47.80    82.71    59.69    -28.97    79.81    51.91   17.20  37.87   17.13  14.04   24.27  
1 1 1 -3  14  24 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  14  25 f 0  68.98   23.36  170.95    110.05   0.00     0.00     170.95    110.05   ?       ?      68.98   23.36  0.00    23.36  
1 1 1 -3  15  1  x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  15  2  o 14 520.61  120.27 12499.04  3522.22  12499.04 3522.22  0.00      0.00     520.61  120.27 ?       ?      0.00    120.27 
1 1 1 -3  15  3  o 2  360.85  32.53  3928.94   666.61   3832.16  1219.50  3970.18   796.07   332.89  66.15  358.86  39.28  -25.97  76.93  
1 1 1 -3  15  4  o 17 173.57  21.35  894.06    208.25   877.77   566.58   896.60    223.92   164.70  52.88  173.35  23.07  -8.64   57.69  
1 1 1 -3  15  5  o 14 162.87  21.71  790.40    197.92   0.00     0.00     790.40    197.92   ?       ?      162.87  21.71  0.00    21.71  
1 1 1 -3  15  6  o 18 434.70  37.20  5822.19   919.29   5617.43  1643.89  5915.36   1108.89  387.91  76.54  431.09  45.49  -43.19  89.04  
1 1 1 -3  15  7  o 13 262.37  42.73  2204.50   621.41   0.00     0.00     2204.50   621.41   ?       ?      262.37  42.73  0.00    42.73  
1 1 1 -3  15  8  o 12 181.83  26.49  1005.23   268.39   1188.28  724.26   976.09    288.96   183.25  59.86  178.06  29.29  5.18    66.64  
1 1 1 -3  15  9  o 10 350.59  34.59  3826.31   687.05   3462.96  1290.04  3970.18   811.76   291.71  76.21  351.86  40.95  -60.15  86.52  
1 1 1 -3  15  10 o 11 139.73  20.92  589.48    162.68   0.00     0.00     589.48    162.68   ?       ?      139.73  20.92  0.00    20.92  
1 1 1 -3  15  11 o 19 267.59  28.75  2212.18   434.75   0.00     0.00     2212.18   434.75   ?       ?      267.59  28.75  0.00    28.75  
1 1 1 -3  15  12 o 2  335.69  77.75  5077.40   1468.86  0.00     0.00     5077.40   1468.86  ?       ?      335.69  77.75  0.00    77.75  
1 1 1 -3  15  13 o 19 264.75  58.40  2744.03   863.70   0.00     0.00     2744.03   863.70   ?       ?      264.75  58.40  0.00    58.40  
1 1 1 -3  15  14 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  15  15 o 17 236.48  58.62  2360.48   791.85   0.00     0.00     2360.48   791.85   ?       ?      236.48  58.62  0.00    58.62  
1 1 1 -3  15  16 o 15 210.87  56.44  1935.00   696.71   0.00     0.00     1935.00   696.71   ?       ?      210.87  56.44  0.00    56.44  
1 1 1 -3  15  17 o 12 55.64   21.61  68.89     98.86    0.00     0.00     68.89     98.86    ?       ?      55.64   21.61  0.00    21.61  
1 1 1 -3  15  18 o 6  106.73  45.98  389.00    510.79   0.00     0.00     389.00    510.79   ?       ?      106.73  45.98  0.00    45.98  
1 1 1 -3  15  19 o 14 73.98   20.59  177.49    90.66    0.00     0.00     177.49    90.66    ?       ?      73.98   20.59  0.00    20.59  
1 1 1 -3  15  20 o 1  131.84  23.70  579.68    172.77   0.00     0.00     579.68    172.77   ?       ?      131.84  23.70  0.00    23.70  
1 1 1 -3  15  21 o 19 83.11   15.13  216.52    69.51    274.86   86.86    112.61    115.93   93.00   16.89  62.40   23.61  30.60   29.03  
1 1 1 -3  15  22 o 12 76.57   22.84  203.67    108.01   0.00     0.00     203.67    108.01   ?       ?      76.57   22.84  0.00    22.84  
1 1 1 -3  15  23 o 11 98.63   25.04  358.40    142.01   0.00     0.00     358.40    142.01   ?       ?      98.63   25.04  0.00    25.04  
1 1 1 -3  15  24 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  16  1  o 8  293.32  37.72  2727.94   620.49   2331.47  931.64   3044.00   831.82   248.67  64.67  299.98  50.07  -51.31  81.78  
1 1 1 -3  16  2  o 16 281.44  33.84  2472.15   535.83   2473.13  845.22   2471.48   692.84   262.82  57.61  272.78  45.87  -9.95   73.64  
1 1 1 -3  16  3  o 1  265.16  30.48  2167.82   455.53   2455.17  754.72   2003.15   571.33   267.14  51.07  247.71  41.65  19.43   65.91  
1 1 1 -3  16  4  o 4  68.16   19.49  140.36    80.11    0.00     0.00     140.36    80.11    ?       ?      68.16   19.49  0.00    19.49  
1 1 1 -3  16  5  o 12 232.61  22.69  1625.20   299.12   1351.83  682.41   1690.21   332.79   190.94  57.53  236.20  24.92  -45.26  62.69  
1 1 1 -3  16  6  o 16 125.25  18.50  471.24    129.02   299.62   555.92   481.01    132.64   119.28  49.48  126.47  18.84  -7.19   52.95  
1 1 1 -3  16  7  o 15 214.01  28.55  1420.91   341.97   2061.78  799.24   1277.29   378.35   232.35  59.63  199.58  34.26  32.77   68.77  
1 1 1 -3  16  8  o 11 308.77  40.70  3157.60   703.85   3052.06  1130.36  3224.44   899.52   265.50  72.25  297.09  54.76  -31.60  90.66  
1 1 1 -3  16  9  o 19 96.29   18.29  282.68    97.42    674.07   615.47   272.62    98.67    140.55  54.10  94.37   18.87  46.18   57.30  
1 1 1 -3  16  10 o 18 190.54  21.10  1100.12   226.95   1140.88  679.80   1095.00   240.76   168.41  58.02  189.38  22.59  -20.97  62.27  
1 1 1 -3  16  11 o 5  111.02  20.45  380.27    125.55   0.00     0.00     380.27    125.55   ?       ?      111.02  20.45  0.00    20.45  
1 1 1 -3  16  12 o 18 148.66  21.12  680.01    175.21   851.99   611.29   664.61    182.89   145.49  54.39  146.31  22.49  -0.82   58.86  
1 1 1 -3  16  13 o 9  73.21   20.57  167.73    90.00    0.00     0.00     167.73    90.00    ?       ?      73.21   20.57  0.00    20.57  
1 1 1 -3  16  14 o 3  135.12  24.37  585.19    182.04   0.00     0.00     585.19    182.04   ?       ?      135.12  24.37  0.00    24.37  
1 1 1 -3  16  15 o 18 98.78   22.46  315.15    124.50   0.00     0.00     315.15    124.50   ?       ?      98.78   22.46  0.00    22.46  
1 1 1 -3  16  16 o 15 91.86   22.55  275.83    118.00   0.00     0.00     275.83    118.00   ?       ?      91.86   22.55  0.00    22.55  
1 1 1 -3  16  17 o 10 87.23   23.51  253.50    120.41   0.00     0.00     253.50    120.41   ?       ?      87.23   23.51  0.00    23.51  
1 1 1 -3  16  18 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  16  19 o 12 145.48  58.80  1650.27   759.90   0.00     0.00     1650.27   759.90   ?       ?      145.48  58.80  0.00    58.80  
1 1 1 -3  16  20 o 17 86.07   41.28  100.17    587.35   0.00     0.00     100.17    587.35   ?       ?      86.07   41.28  0.00    41.28  
1 1 1 -3  16  21 o 5  107.68  48.46  946.93    628.90   0.00     0.00     946.93    628.90   ?       ?      107.68  48.46  0.00    48.46  
1 1 1 -3  16  22 o 17 110.13  50.46  1379.07   720.60   0.00     0.00     1379.07   720.60   ?       ?      110.13  50.46  0.00    50.46  
1 1 1 -3  17  1  o 17 224.49  44.04  1732.70   547.24   0.00     0.00     1732.70   547.24   ?       ?      224.49  44.04  0.00    44.04  
1 1 1 -3  17  2  x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  17  3  o 19 68.66   18.74  144.33    75.91    0.00     0.00     144.33    75.91    ?       ?      68.66   18.74  0.00    18.74  
1 1 1 -3  17  4  o 7  174.75  21.20  926.24    208.29   584.96   624.09   969.02    220.96   134.59  53.67  178.42  22.04  -43.82  58.02  
1 1 1 -3  17  5  o 14 170.69  22.07  889.76    211.16   0.00     0.00     889.76    211.16   ?       ?      170.69  22.07  0.00    22.07  
1 1 1 -3  17  6  o 14 80.74   20.12  202.60    92.93    124.78   652.75   204.21    93.89    112.16  50.01  81.04   20.24  31.12   53.95  
1 1 1 -3  17  7  o 19 265.97  35.98  2352.74   535.29   2667.62  1004.24  2227.78   632.66   238.50  69.27  248.49  46.05  -9.99   83.17  
1 1 1 -3  17  8  o 17 224.89  39.96  1758.31   497.04   0.00     0.00     1758.31   497.04   ?       ?      224.89  39.96  0.00    39.96  
1 1 1 -3  17  9  f 0  135.78  19.51  565.14    147.72   395.40   746.34   572.06    150.70   122.45  54.09  136.49  19.81  -14.04  57.61  
1 1 1 -3  17  10 o 1  189.30  24.36  1129.36   258.56   0.00     0.00     1129.36   258.56   ?       ?      189.30  24.36  0.00    24.36  
1 1 1 -3  17  11 o 18 259.49  27.80  2182.21   407.72   2242.89  920.45   2167.39   454.77   201.20  67.55  254.26  31.85  -53.06  74.68  
1 1 1 -3  17  12 o 4  45.99   18.69  31.67     77.32    135.58   693.72   30.36     77.80    105.52  48.77  45.89   18.72  59.63   52.24  
1 1 1 -3  17  13 o 7  148.07  23.85  707.53    195.85   0.00     0.00     707.53    195.85   ?       ?      148.07  23.85  0.00    23.85  
1 1 1 -3  17  14 o 12 67.04   21.51  141.13    93.78    0.00     0.00     141.13    93.78    ?       ?      67.04   21.51  0.00    21.51  
1 1 1 -3  17  15 o 4  152.49  25.80  779.20    217.82   0.00     0.00     779.20    217.82   ?       ?      152.49  25.80  0.00    25.80  
1 1 1 -3  17  16 o 16 145.14  25.92  717.32    208.01   0.00     0.00     717.32    208.01   ?       ?      145.14  25.92  0.00    25.92  
1 1 1 -3  17  17 o 13 65.65   23.60  134.60    113.38   0.00     0.00     134.60    113.38   ?       ?      65.65   23.60  0.00    23.60  
1 1 1 -3  17  18 f 0  52.43   22.00  44.25     111.81   0.00     0.00     44.25     111.81   ?       ?      52.43   22.00  0.00    22.00  
1 1 1 -3  17  19 o 4  70.53   26.00  172.43    138.71   0.00     0.00     172.43    138.71   ?       ?      70.53   26.00  0.00    26.00  
1 1 1 -3  17  20 o 8  53.74   23.40  37.33     135.32   0.00     0.00     37.33     135.32   ?       ?      53.74   23.40  0.00    23.40  
1 1 1 -3  18  1  o 15 102.76  18.12  323.35    103.01   629.13   666.90   315.88    104.27   133.08  54.60  101.38  18.60  31.70   57.68  
1 1 1 -3  18  2  f 0  35.52   15.77  -19.86    64.23    -251.15  665.26   -17.68    64.53    97.99   46.09  35.89   15.88  62.10   48.75  
1 1 1 -3  18  3  o 6  157.88  22.13  772.07    195.09   0.00     0.00     772.07    195.09   ?       ?      157.88  22.13  0.00    22.13  
1 1 1 -3  18  4  x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  18  5  o 1  71.92   33.10  -126.37   314.86   0.00     0.00     -126.37   314.86   ?       ?      71.92   33.10  0.00    33.10  
1 1 1 -3  18  6  o 15 177.86  45.05  1212.23   460.46   0.00     0.00     1212.23   460.46   ?       ?      177.86  45.05  0.00    45.05  
1 1 1 -3  18  7  o 12 261.76  27.43  2208.92   406.02   2311.75  1105.82  2192.90   436.51   189.06  72.58  258.09  30.02  -69.04  78.54  
1 1 1 -3  18  8  o 15 171.61  23.24  931.48    223.03   1577.91  874.75   886.54    230.66   165.89  64.32  166.24  24.94  -0.35   68.99  
1 1 1 -3  18  9  o 11 86.65   19.20  237.14    92.97    0.00     0.00     237.14    92.97    ?       ?      86.65   19.20  0.00    19.20  
1 1 1 -3  18  10 o 9  151.81  26.92  764.57    226.03   0.00     0.00     764.57    226.03   ?       ?      151.81  26.92  0.00    26.92  
1 1 1 -3  18  11 o 7  75.28   19.83  181.78    86.86    178.35   873.69   181.82    87.29    107.39  51.19  75.27   19.90  32.12   54.92  
1 1 1 -3  18  12 f 0  126.11  23.50  522.50    163.86   818.45   890.57   512.13    166.71   121.03  55.69  124.34  24.23  -3.31   60.73  
1 1 1 -3  18  13 o 18 53.03   20.30  69.51     86.37    0.00     0.00     69.51     86.37    ?       ?      53.03   20.30  0.00    20.30  
1 1 1 -3  18  14 o 19 117.21  23.43  461.86    152.14   0.00     0.00     461.86    152.14   ?       ?      117.21  23.43  0.00    23.43  
1 1 1 -3  18  15 o 3  53.61   21.32  66.36     98.27    0.00     0.00     66.36     98.27    ?       ?      53.61   21.32  0.00    21.32  
1 1 1 -3  18  16 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  18  17 o 17 56.24   22.70  78.69     113.10   0.00     0.00     78.69     113.10   ?       ?      56.24   22.70  0.00    22.70  
1 1 1 -3  19  1  o 9  115.80  18.79  414.88    120.62   0.00     0.00     414.88    120.62   ?       ?      115.80  18.79  0.00    18.79  
1 1 1 -3  19  2  o 2  92.78   18.90  269.52    97.27    1456.53  764.20   249.97    98.06    166.52  61.08  89.00   19.71  77.52   64.18  
1 1 1 -3  19  3  o 2  49.17   17.27  66.04     60.38    0.00     0.00     66.04     60.38    ?       ?      49.17   17.27  0.00    17.27  
1 1 1 -3  19  4  o 6  48.62   17.47  62.50     62.13    -25.94   843.65   62.98     62.30    106.06  50.48  48.75   17.50  57.31   53.43  
1 1 1 -3  19  5  o 10 187.27  23.88  1122.29   250.88   375.65   1147.10  1159.80   257.11   119.72  57.49  190.25  24.08  -70.53  62.33  
1 1 1 -3  19  6  o 2  71.25   19.38  161.42    81.37    -1190.31 1199.44  167.67    81.56    97.43   48.91  72.60   19.26  24.83   52.57  
1 1 1 -3  19  7  o 7  44.36   18.53  20.27     78.68    0.00     0.00     20.27     78.68    ?       ?      44.36   18.53  0.00    18.53  
1 1 1 -3  19  8  o 12 216.91  63.73  2707.43   845.82   0.00     0.00     2707.43   845.82   ?       ?      216.91  63.73  0.00    63.73  
1 1 1 -3  19  9  x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -3  19  10 o 4  110.12  44.75  555.73    442.74   0.00     0.00     555.73    442.74   ?       ?      110.12  44.75  0.00    44.75  
1 1 1 -3  19  11 o 11 87.97   39.40  203.38    410.32   -447.66  1055.35  319.32    445.36   92.35   46.29  94.63   41.79  -2.28   62.37  
1 1 1 -3  19  12 o 10 79.87   22.94  218.20    110.72   0.00     0.00     218.20    110.72   ?       ?      79.87   22.94  0.00    22.94  
1 1 1 -3  19  13 o 6  142.81  26.37  722.38    208.21   0.00     0.00     722.38    208.21   ?       ?      142.81  26.37  0.00    26.37  
1 1 1 -3  19  14 o 7  100.14  23.07  348.59    129.86   0.00     0.00     348.59    129.86   ?       ?      100.14  23.07  0.00    23.07  
1 1 1 -2  -19 1  o 6  111.06  23.67  391.64    146.33   391.58   147.60   395.31    1115.11  110.97  23.88  132.20  61.35  -21.22  65.84  
1 1 1 -2  -19 2  o 7  98.05   23.56  306.35    130.97   302.21   131.82   624.82    1156.35  97.31   23.80  138.50  63.63  -41.19  67.94  
1 1 1 -2  -19 3  o 14 63.54   22.28  113.10    100.48   114.65   100.83   -111.87   1213.15  63.84   22.33  123.48  59.25  -59.64  63.32  
1 1 1 -2  -19 4  o 4  62.32   21.90  108.20    97.08    101.71   97.36    1221.86   1275.93  61.23   21.89  154.07  69.21  -92.84  72.59  
1 1 1 -2  -19 5  o 1  140.37  25.07  625.79    194.61   610.21   196.29   1521.10   1487.94  138.26  25.68  160.20  73.07  -21.93  77.45  
1 1 1 -2  -19 6  o 7  56.32   19.85  86.27     79.84    86.27    79.84    0.00      0.00     56.32   19.85  ?       ?      0.00    19.85  
1 1 1 -2  -18 1  o 15 93.94   22.79  276.29    121.63   270.33   122.73   604.50    910.70   92.86   23.11  142.07  61.30  -49.21  65.51  
1 1 1 -2  -18 2  f 0  163.59  25.35  832.10    230.39   867.73   236.39   156.66    1029.18  167.07  25.45  131.31  60.22  35.76   65.38  
1 1 1 -2  -18 3  o 7  258.33  29.65  2101.71   431.67   1972.87  466.96   2858.76   1131.93  247.04  33.81  246.16  74.07  0.88    81.43  
1 1 1 -2  -18 4  o 14 219.73  30.97  1538.87   379.83   1553.30  398.11   1392.37   1268.23  219.67  32.55  172.52  73.33  47.15   80.23  
1 1 1 -2  -18 5  f 0  185.04  31.00  1098.65   317.70   1098.65  317.70   0.00      0.00     185.04  31.00  ?       ?      0.00    31.00  
1 1 1 -2  -18 6  f 0  86.42   20.18  231.74    98.28    231.74   98.28    0.00      0.00     86.42   20.18  ?       ?      0.00    20.18  
1 1 1 -2  -18 7  o 18 113.99  20.87  400.89    131.51   405.21   132.20   -9.93     1288.30  114.62  20.86  133.39  63.17  -18.77  66.52  
1 1 1 -2  -18 8  o 2  131.54  22.25  536.04    162.04   552.72   163.22   -603.20   1348.53  133.71  22.03  123.60  60.07  10.11   63.98  
1 1 1 -2  -18 9  o 9  68.44   19.69  143.99    81.50    141.30   81.65    902.75    1373.56  67.87   19.76  152.18  69.71  -84.31  72.45  
1 1 1 -2  -18 10 o 14 61.02   18.91  111.58    73.10    113.58   73.20    -583.78   1365.65  61.47   18.91  123.57  60.14  -62.10  63.05  
1 1 1 -2  -17 1  o 4  131.70  22.52  529.31    164.13   547.42   167.85   134.08    784.13   133.95  22.63  125.37  55.41  8.58    59.85  
1 1 1 -2  -17 2  o 2  277.04  30.70  2380.84   480.11   2278.00  540.50   2765.54   1045.33  267.22  36.16  262.53  68.61  4.69    77.56  
1 1 1 -2  -17 3  o 12 187.40  24.83  1071.10   260.54   1016.93  273.05   1621.66   870.54   181.57  27.02  201.13  65.62  -19.55  70.97  
1 1 1 -2  -17 4  o 17 188.79  25.96  1093.92   273.92   1052.51  284.54   1617.85   1012.08  184.30  27.75  195.76  70.51  -11.45  75.77  
1 1 1 -2  -17 5  o 13 64.35   19.75  123.14    79.93    126.09   80.18    -342.15   1008.53  64.98   19.75  121.90  57.16  -56.91  60.47  
1 1 1 -2  -17 6  o 14 128.73  22.55  508.06    160.56   491.27   162.52   1192.15   1037.36  126.29  23.27  173.47  69.19  -47.18  73.00  
1 1 1 -2  -17 7  o 3  121.09  20.61  446.65    138.14   446.65   138.14   0.00      0.00     121.09  20.61  ?       ?      0.00    20.61  
1 1 1 -2  -17 8  o 17 115.88  20.28  409.54    130.00   409.54   130.00   0.00      0.00     115.88  20.28  ?       ?      0.00    20.28  
1 1 1 -2  -17 9  o 3  88.10   19.20  238.49    94.36    238.49   94.36    0.00      0.00     88.10   19.20  ?       ?      0.00    19.20  
1 1 1 -2  -17 10 o 17 58.88   19.15  100.29    74.18    98.84    74.38    368.60    1009.82  58.59   19.19  137.98  61.81  -79.39  64.72  
1 1 1 -2  -17 11 o 12 166.83  26.81  873.26    248.06   882.15   254.93   714.79    1075.96  167.35  27.49  148.68  65.34  18.67   70.89  
1 1 1 -2  -17 12 o 13 130.06  22.04  522.45    158.66   535.80   160.32   -112.27   1105.32  131.77  21.97  125.51  59.16  6.26    63.10  
1 1 1 -2  -17 13 o 11 79.36   18.27  194.40    81.53    194.60   81.74    155.03    1146.43  79.40   18.31  132.40  61.71  -53.00  64.36  
1 1 1 -2  -16 1  o 6  226.30  28.16  1552.66   357.91   1745.80  671.52   1476.03   422.99   226.70  52.62  217.49  35.07  9.21    63.23  
1 1 1 -2  -16 2  x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  -16 3  o 1  275.26  30.91  2311.45   480.06   2360.75  543.43   2136.29   1024.33  275.93  35.10  237.37  70.24  38.56   78.52  
1 1 1 -2  -16 4  o 16 253.42  20.17  1896.25   291.01   1896.25  291.01   0.00      0.00     253.42  20.17  ?       ?      0.00    20.17  
1 1 1 -2  -16 5  o 5  172.79  27.81  914.64    266.52   914.64   266.52   0.00      0.00     172.79  27.81  ?       ?      0.00    27.81  
1 1 1 -2  -16 6  o 3  94.19   18.96  269.01    98.97    269.22   99.62    253.34    867.90   94.20   19.08  137.19  59.51  -42.99  62.50  
1 1 1 -2  -16 7  o 19 128.97  22.13  505.11    157.95   499.37   160.44   685.57    900.03   128.07  22.65  155.22  63.53  -27.16  67.44  
1 1 1 -2  -16 8  o 5  142.72  21.75  615.98    172.58   616.17   175.66   610.71    925.67   142.60  22.18  151.48  63.42  -8.88   67.19  
1 1 1 -2  -16 9  o 11 126.35  20.42  482.98    143.09   482.98   143.09   0.00      0.00     126.35  20.42  ?       ?      0.00    20.42  
1 1 1 -2  -16 10 o 19 182.93  22.54  1010.69   231.73   970.07   240.28   1551.27   876.50   178.57  24.05  196.89  65.91  -18.32  70.16  
1 1 1 -2  -16 11 o 3  86.72   19.84  231.05    96.64    223.32   97.20    898.12    903.22   85.19   20.19  160.07  64.32  -74.88  67.41  
1 1 1 -2  -16 12 o 14 83.11   18.85  211.90    87.84    204.65   88.33    858.07    833.90   81.61   19.18  155.86  62.08  -74.24  64.97  
1 1 1 -2  -16 13 o 3  199.76  24.75  1223.64   277.71   1188.79  290.69   1587.84   939.75   195.95  26.52  191.06  68.04  4.89    73.03  
1 1 1 -2  -16 14 f 0  56.31   18.54  90.81     69.43    90.81    69.43    0.00      0.00     56.31   18.54  ?       ?      0.00    18.54  
1 1 1 -2  -16 15 o 2  170.39  28.09  919.53    265.20   919.53   265.20   0.00      0.00     170.39  28.09  ?       ?      0.00    28.09  
1 1 1 -2  -15 1  o 12 317.42  26.93  2980.88   486.03   3080.30  680.14   2877.12   694.81   318.18  37.99  306.20  40.52  11.97   55.54  
1 1 1 -2  -15 2  o 9  144.59  23.62  626.63    189.28   568.68   195.92   1439.02   733.53   137.06  25.85  208.15  58.81  -71.09  64.24  
1 1 1 -2  -15 3  o 6  283.35  32.62  2422.21   521.00   2619.26  592.71   1752.51   1092.67  293.31  35.95  223.68  73.55  69.63   81.87  
1 1 1 -2  -15 4  x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  -15 5  o 15 351.92  63.44  4227.87   1234.54  4227.87  1234.54  0.00      0.00     351.92  63.44  ?       ?      0.00    63.44  
1 1 1 -2  -15 6  o 16 131.85  46.67  507.61    441.50   507.61   441.50   0.00      0.00     131.85  46.67  ?       ?      0.00    46.67  
1 1 1 -2  -15 7  x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  -15 8  o 15 366.47  32.62  4085.88   679.13   3994.90  788.69   4346.79   1335.61  358.10  38.99  346.56  69.55  11.54   79.74  
1 1 1 -2  -15 9  o 11 245.83  28.21  1828.79   390.89   1983.90  434.72   1173.77   893.34   255.20  30.26  183.62  66.23  71.59   72.81  
1 1 1 -2  -15 10 o 11 85.87   19.12  224.36    91.81    215.51   92.58    747.19    711.33   84.08   19.55  154.83  58.50  -70.74  61.68  
1 1 1 -2  -15 11 o 3  209.89  25.87  1335.73   305.15   1395.10  328.50   962.11    824.14   213.90  27.38  167.50  63.04  46.40   68.73  
1 1 1 -2  -15 12 o 15 137.27  20.70  568.10    158.02   569.66   162.07   537.90    711.21   137.29  21.25  140.62  56.87  -3.33   60.71  
1 1 1 -2  -15 13 o 7  99.20   18.48  298.24    101.39   285.82   102.42   909.73    718.74   96.92   19.09  160.60  59.18  -63.68  62.18  
1 1 1 -2  -15 14 o 12 68.38   18.00  142.59    71.59    140.43   71.89    402.91    787.88   67.88   18.11  135.17  57.64  -67.29  60.42  
1 1 1 -2  -15 15 o 11 114.57  19.05  397.73    120.89   394.86   122.37   514.44    781.30   114.05  19.38  138.35  58.12  -24.30  61.26  
1 1 1 -2  -15 16 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  -15 17 o 12 43.10   16.89  34.01     60.79    31.32    60.93    629.38    906.56   42.63   16.84  142.07  61.23  -99.44  63.50  
1 1 1 -2  -14 1  o 12 200.24  28.48  1199.48   318.11   1263.58  360.96   976.54    673.15   204.67  31.75  176.91  57.70  27.76   65.86  
1 1 1 -2  -14 2  o 1  501.78  59.16  7995.59   1671.46  8411.09  2321.60  7548.43   2408.40  491.03  85.46  454.80  95.30  36.23   128.01 
1 1 1 -2  -14 3  o 15 192.26  40.22  1143.50   429.62   2189.14  477.72   -3277.89  982.35   271.03  31.28  82.16   41.61  188.87  52.06  
1 1 1 -2  -14 4  o 17 497.45  87.43  8625.48   2405.76  8625.48  2405.76  0.00      0.00     497.45  87.43  ?       ?      0.00    87.43  
1 1 1 -2  -14 5  o 4  155.83  15.39  708.04    135.87   829.56   137.23   -5304.69  965.31   168.96  14.28  ?       ?      0.00    14.28  
1 1 1 -2  -14 6  o 11 354.94  40.06  3819.52   802.11   4353.92  935.26   2333.15   1559.76  377.23  44.01  257.42  87.92  119.81  98.32  
1 1 1 -2  -14 7  o 13 154.72  23.14  713.32    199.21   713.32   199.21   0.00      0.00     154.72  23.14  ?       ?      0.00    23.14  
1 1 1 -2  -14 8  o 11 109.62  20.36  360.83    123.39   369.40   125.56   119.75    665.72   110.93  20.47  124.33  53.00  -13.40  56.82  
1 1 1 -2  -14 9  o 6  301.47  54.98  2986.29   916.49   2986.29  916.49   0.00      0.00     301.47  54.98  ?       ?      0.00    54.98  
1 1 1 -2  -14 10 o 2  111.99  42.07  314.21    366.53   314.21   366.53   0.00      0.00     111.99  42.07  ?       ?      0.00    42.07  
1 1 1 -2  -14 11 o 9  99.67   39.65  190.97    339.73   190.97   339.73   0.00      0.00     99.67   39.65  ?       ?      0.00    39.65  
1 1 1 -2  -14 12 o 12 152.20  20.75  691.39    176.54   697.36   184.29   624.69    615.62   152.62  21.64  145.89  54.57  6.73    58.71  
1 1 1 -2  -14 13 o 2  269.34  25.80  2180.47   393.99   2144.31  442.34   2319.28   866.63   265.25  29.55  254.64  60.23  10.61   67.09  
1 1 1 -2  -14 14 o 9  137.30  20.76  567.63    158.52   569.58   162.97   533.26    683.12   137.36  21.36  140.19  56.07  -2.83   60.00  
1 1 1 -2  -14 15 o 17 161.85  21.59  788.81    195.56   788.81   195.56   0.00      0.00     161.85  21.59  ?       ?      0.00    21.59  
1 1 1 -2  -14 16 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  -14 17 o 16 145.67  18.90  636.64    154.36   628.75   157.46   831.09    781.62   144.56  19.47  154.09  60.50  -9.53   63.55  
1 1 1 -2  -14 18 o 15 114.44  18.49  396.64    117.30   379.69   118.74   1084.05   756.14   111.69  19.21  165.50  60.74  -53.81  63.71  
1 1 1 -2  -14 19 o 13 34.31   15.01  -10.70    56.20    -12.44   56.32    372.28    836.64   34.10   14.97  130.36  57.44  -96.26  59.36  
1 1 1 -2  -13 1  f 0  317.54  28.72  2980.92   517.84   2988.01  729.43   2973.72   735.29   313.06  41.62  312.09  42.12  0.97    59.21  
1 1 1 -2  -13 2  o 12 431.43  38.10  5594.83   933.91   5695.85  1316.91  5492.62   1324.61  425.20  55.26  416.37  56.90  8.83    79.32  
1 1 1 -2  -13 3  o 12 384.90  19.31  4307.93   425.35   4025.65  528.25   4828.41   717.30   370.43  24.99  403.49  31.21  -33.06  39.98  
1 1 1 -2  -13 4  o 17 248.90  23.60  1821.89   333.15   1961.52  372.47   1263.44   744.92   257.84  25.50  197.78  60.21  60.07   65.39  
1 1 1 -2  -13 5  f 0  417.20  34.54  5192.95   819.76   4815.22  980.70   6068.94   1493.47  397.16  43.74  434.57  61.59  -37.41  75.54  
1 1 1 -2  -13 6  o 14 116.65  22.32  408.46    144.05   408.46   144.05   0.00      0.00     116.65  22.32  ?       ?      0.00    22.32  
1 1 1 -2  -13 7  o 9  38.50   19.24  -481.41   176.72   -392.76  181.68   -2038.82  761.48   42.30   20.86  79.08   39.60  -36.78  44.76  
1 1 1 -2  -13 8  o 17 672.99  37.26  13472.66  1434.04  5615.92  1959.02  22543.15  2104.91  401.51  87.47  866.66  42.44  -465.15 97.22  
1 1 1 -2  -13 9  o 11 151.30  25.48  685.28    213.48   1039.70  223.51   -3001.24  720.85   188.13  21.06  ?       ?      0.00    21.06  
1 1 1 -2  -13 10 o 6  176.83  22.82  925.62    226.24   1043.18  240.69   34.17     662.80   187.89  22.78  121.32  52.32  66.57   57.06  
1 1 1 -2  -13 11 o 19 161.83  24.42  783.34    219.80   783.34   219.80   0.00      0.00     161.83  24.42  ?       ?      0.00    24.42  
1 1 1 -2  -13 12 o 17 264.84  25.89  2085.80   388.62   2024.04  442.83   2292.70   810.52   259.19  30.33  262.99  55.44  -3.79   63.19  
1 1 1 -2  -13 13 o 12 167.32  42.31  898.77    406.54   898.77   406.54   0.00      0.00     167.32  42.31  ?       ?      0.00    42.31  
1 1 1 -2  -13 14 o 19 239.19  44.77  1846.33   592.22   1846.33  592.22   0.00      0.00     239.19  44.77  ?       ?      0.00    44.77  
1 1 1 -2  -13 15 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  -13 16 o 13 207.58  29.44  1326.54   341.02   1377.79  387.79   1151.71   716.26   209.72  33.32  178.88  59.58  30.84   68.26  
1 1 1 -2  -13 17 f 0  74.66   17.93  170.00    75.88    170.15   76.44    159.90    628.34   74.68   18.03  117.75  50.86  -43.06  53.96  
1 1 1 -2  -13 18 o 14 217.63  22.81  1427.65   280.76   1413.68  301.38   1519.35   772.20   215.63  24.80  197.96  61.50  17.68   66.31  
1 1 1 -2  -13 19 o 8  141.56  19.11  602.77    151.36   600.50   154.81   651.90    720.76   141.12  19.64  143.07  57.46  -1.95   60.73  
1 1 1 -2  -13 20 o 2  188.09  36.33  1170.63   378.05   1113.39  427.80   1374.73   807.80   179.21  42.27  180.59  63.19  -1.39   76.03  
1 1 1 -2  -13 21 o 8  149.93  36.22  759.63    308.25   773.55   332.52   674.54    821.91   150.02  38.44  141.08  59.46  8.94    70.80  
1 1 1 -2  -12 1  o 5  315.33  26.18  2910.75   469.55   2816.80  661.83   3005.98   666.29   306.74  38.43  317.39  37.28  -10.64  53.54  
1 1 1 -2  -12 2  o 17 580.44  34.25  9920.01   1136.02  12035.36 1604.99  7796.23   1608.18  634.30  44.36  503.33  56.64  130.96  71.94  
1 1 1 -2  -12 3  o 18 370.52  17.54  3972.86   372.05   3560.35  466.79   4691.37   616.05   349.58  23.40  400.59  26.95  -51.01  35.68  
1 1 1 -2  -12 4  o 8  497.65  55.75  7635.23   1565.33  7635.23  1565.33  0.00      0.00     497.65  55.75  ?       ?      0.00    55.75  
1 1 1 -2  -12 5  o 18 312.31  37.09  2922.48   652.07   2922.48  652.07   0.00      0.00     312.31  37.09  ?       ?      0.00    37.09  
1 1 1 -2  -12 6  o 7  467.59  39.18  6550.18   1042.06  6352.11  1266.31  6965.67   1834.03  454.99  49.27  461.26  71.58  -6.27   86.90  
1 1 1 -2  -12 7  o 7  115.80  17.23  396.14    111.06   449.64   115.04   -337.05   425.87   123.63  16.63  81.80   37.95  41.83   41.43  
1 1 1 -2  -12 8  o 16 154.75  19.86  705.58    172.37   731.66   184.41   525.19    485.00   157.41  20.93  138.00  48.91  19.41   53.20  
1 1 1 -2  -12 9  o 1  57.94   19.75  89.70     78.69    94.82    79.64    -121.47   511.16   59.10   19.87  100.86  44.65  -41.76  48.87  
1 1 1 -2  -12 10 o 19 37.36   18.34  -271.64   134.90   -124.09  138.48   -3013.52  596.98   46.30   21.53  ?       ?      0.00    21.53  
1 1 1 -2  -12 11 o 19 336.47  52.92  3529.41   988.51   3529.41  988.51   0.00      0.00     336.47  52.92  ?       ?      0.00    52.92  
1 1 1 -2  -12 12 o 4  117.52  20.84  412.52    135.45   445.08   139.91   -74.31    541.00   122.21  20.68  105.95  46.45  16.27   50.85  
1 1 1 -2  -12 13 o 3  231.55  30.22  1608.19   392.14   1686.79  472.50   1434.26   702.90   235.15  36.16  209.13  57.00  26.01   67.50  
1 1 1 -2  -12 14 o 4  236.96  25.61  1670.22   342.87   1709.39  389.09   1534.10   725.36   238.61  29.00  213.86  57.74  24.75   64.62  
1 1 1 -2  -12 15 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  -12 16 o 14 246.86  33.08  1870.07   456.94   1798.19  585.00   1982.54   731.80   235.95  44.83  242.35  53.98  -6.39   70.17  
1 1 1 -2  -12 17 o 18 174.25  38.58  976.36    375.67   976.36   375.67   0.00      0.00     174.25  38.58  ?       ?      0.00    38.58  
1 1 1 -2  -12 18 o 13 80.36   33.36  77.72     252.86   77.72    252.86   0.00      0.00     80.36   33.36  ?       ?      0.00    33.36  
1 1 1 -2  -12 19 o 3  164.26  38.68  888.09    358.68   888.09   358.68   0.00      0.00     164.26  38.68  ?       ?      0.00    38.68  
1 1 1 -2  -12 20 o 7  115.70  35.08  431.36    253.17   438.48   277.20   395.55    621.64   116.70  36.93  127.07  52.48  -10.36  64.17  
1 1 1 -2  -12 21 o 3  69.85   30.66  -19.92    236.40   34.98    248.00   -566.05   782.15   75.36   32.24  101.33  48.34  -25.97  58.10  
1 1 1 -2  -12 22 o 12 95.25   34.19  269.79    237.74   269.79   237.74   0.00      0.00     95.25   34.19  ?       ?      0.00    34.19  
1 1 1 -2  -11 1  o 18 178.18  14.85  922.23    150.57   1959.17  260.14   399.89    184.63   259.75  17.55  114.74  28.23  145.01  33.24  
1 1 1 -2  -11 2  o 9  243.98  22.59  1741.57   312.81   3524.68  445.16   2.21      439.66   347.86  22.41  99.84   42.83  248.02  48.34  
1 1 1 -2  -11 3  o 3  330.24  24.58  3184.82   462.69   2712.68  649.37   3671.71   659.43   300.80  38.49  352.43  32.98  -51.63  50.68  
1 1 1 -2  -11 4  o 4  336.38  27.69  3315.38   530.06   3290.91  745.54   3340.39   753.76   331.54  39.98  334.01  40.11  -2.47   56.63  
1 1 1 -2  -11 5  o 4  431.10  40.71  5534.99   995.44   5668.64  1213.77  5260.42   1739.72  432.53  49.79  401.76  78.25  30.78   92.74  
1 1 1 -2  -11 6  o 1  152.57  19.73  683.65    168.77   683.65   168.77   0.00      0.00     152.57  19.73  ?       ?      0.00    19.73  
1 1 1 -2  -11 7  o 10 230.92  20.82  1554.95   273.07   1523.80  320.78   1636.93   520.41   227.80  24.94  232.27  40.50  -4.47   47.56  
1 1 1 -2  -11 8  o 11 239.11  29.54  1694.22   396.93   1946.20  526.73   1363.08   603.82   254.38  37.17  208.52  50.90  45.87   63.02  
1 1 1 -2  -11 9  o 10 272.89  23.93  2181.91   371.12   2119.57  442.46   2329.82   681.57   267.58  29.28  275.56  44.61  -7.98   53.36  
1 1 1 -2  -11 10 o 8  303.16  33.92  2746.46   580.18   2746.46  580.18   0.00      0.00     303.16  33.92  ?       ?      0.00    33.92  
1 1 1 -2  -11 11 o 15 423.61  33.75  5332.65   814.04   4948.02  985.69   6157.73   1443.65  403.60  43.22  441.32  58.42  -37.72  72.66  
1 1 1 -2  -11 12 o 2  268.54  25.30  2118.96   385.41   2113.24  449.06   2134.95   750.98   266.99  29.81  260.58  52.03  6.41    59.96  
1 1 1 -2  -11 13 o 18 627.49  25.37  11488.70  911.92   8233.68  1250.14  15190.32  1333.15  523.52  41.95  718.08  32.42  -194.56 53.02  
1 1 1 -2  -11 14 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  -11 15 o 19 368.45  66.50  4534.39   1354.78  0.00     0.00     4534.39   1354.78  ?       ?      368.45  66.50  0.00    66.50  
1 1 1 -2  -11 16 o 18 263.05  31.27  2088.54   463.03   2099.58  589.44   2070.75   748.25   259.43  40.93  250.92  53.58  8.51    67.42  
1 1 1 -2  -11 17 o 2  278.14  34.04  2365.54   532.24   2318.19  698.94   2430.90   821.12   268.19  47.12  269.75  54.89  -1.56   72.34  
1 1 1 -2  -11 18 f 0  111.67  33.50  385.33    231.75   416.92   263.70   278.18    485.71   116.16  35.91  117.00  47.11  -0.84   59.24  
1 1 1 -2  -11 19 o 1  186.77  31.43  1085.41   325.06   1132.26  391.22   980.95    584.16   187.95  37.57  168.59  53.64  19.37   65.49  
1 1 1 -2  -11 20 o 3  77.14   31.84  77.73     228.62   77.73    228.62   0.00      0.00     77.14   31.84  ?       ?      0.00    31.84  
1 1 1 -2  -11 21 o 10 93.72   32.58  256.40    214.49   256.40   214.49   0.00      0.00     93.72   32.58  ?       ?      0.00    32.58  
1 1 1 -2  -11 22 o 9  119.14  32.49  460.99    228.33   460.99   228.33   0.00      0.00     119.14  32.49  ?       ?      0.00    32.49  
1 1 1 -2  -11 23 o 3  111.32  32.31  405.31    218.55   352.55   227.42   1042.36   790.24   104.64  33.49  159.86  61.36  -55.22  69.90  
1 1 1 -2  -11 24 o 11 116.96  31.58  452.95    216.93   446.42   224.72   542.26    830.97   115.85  32.49  133.84  58.15  -17.98  66.60  
1 1 1 -2  -10 1  o 1  489.33  29.61  7105.98   827.91   8298.97  1170.69  5912.37   1170.99  522.59  39.31  434.99  47.67  87.60   61.79  
1 1 1 -2  -10 2  o 6  344.24  24.07  3481.48   472.69   3855.22  665.88   3101.82   671.13   358.96  32.67  319.71  37.26  39.25   49.56  
1 1 1 -2  -10 3  o 14 222.89  15.85  1443.80   201.51   1568.00  350.00   1382.22   246.46   229.74  27.06  217.26  19.98  12.48   33.64  
1 1 1 -2  -10 4  o 12 256.32  39.31  2003.40   559.94   0.00     0.00     2003.40   559.94   ?       ?      256.32  39.31  0.00    39.31  
1 1 1 -2  -10 5  o 19 535.74  95.64  10151.67  2833.36  10151.67 2833.36  0.00      0.00     535.74  95.64  ?       ?      0.00    95.64  
1 1 1 -2  -10 6  o 17 194.21  33.18  1135.89   356.60   1135.89  356.60   0.00      0.00     194.21  33.18  ?       ?      0.00    33.18  
1 1 1 -2  -10 7  o 18 256.69  40.81  1992.46   581.30   1992.46  581.30   0.00      0.00     256.69  40.81  ?       ?      0.00    40.81  
1 1 1 -2  -10 8  o 10 179.66  17.14  939.44    174.67   924.30   202.51   983.41    345.17   177.71  20.21  180.39  34.59  -2.68   40.06  
1 1 1 -2  -10 9  o 2  340.48  29.24  3399.94   566.02   3363.10  688.49   3476.77   994.24   336.73  36.18  336.43  53.25  0.30    64.38  
1 1 1 -2  -10 10 o 17 176.38  17.01  905.92    170.10   867.70   196.66   1019.49   338.97   172.05  20.30  183.90  33.34  -11.85  39.03  
1 1 1 -2  -10 11 o 17 411.55  47.85  5162.82   1109.48  5162.82  1109.48  0.00      0.00     411.55  47.85  ?       ?      0.00    47.85  
1 1 1 -2  -10 12 o 7  308.09  29.01  2804.90   507.03   2994.79  612.98   2393.47   902.25   316.70  34.26  272.53  59.35  44.16   68.53  
1 1 1 -2  -10 13 o 6  338.16  28.10  3371.04   540.64   3142.09  649.06   3889.86   977.06   323.86  35.49  354.35  49.37  -30.49  60.80  
1 1 1 -2  -10 14 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  -10 15 o 1  329.84  33.55  3235.75   626.43   3235.75  626.43   0.00      0.00     329.84  33.55  ?       ?      0.00    33.55  
1 1 1 -2  -10 16 o 1  333.90  38.07  3364.78   716.74   3411.14  980.79   3311.65   1050.00  328.62  53.85  320.77  59.20  7.85    80.03  
1 1 1 -2  -10 17 f 0  164.52  35.49  839.62    325.29   839.62   325.29   0.00      0.00     164.52  35.49  ?       ?      0.00    35.49  
1 1 1 -2  -10 18 o 5  209.67  50.66  1449.78   602.91   0.00     0.00     1449.78   602.91   ?       ?      209.67  50.66  0.00    50.66  
1 1 1 -2  -10 19 o 3  154.23  48.15  771.71    472.78   0.00     0.00     771.71    472.78   ?       ?      154.23  48.15  0.00    48.15  
1 1 1 -2  -10 20 o 2  121.66  47.27  373.91    473.11   0.00     0.00     373.91    473.11   ?       ?      121.66  47.27  0.00    47.27  
1 1 1 -2  -10 21 o 3  186.72  30.35  1086.49   314.12   1101.58  355.92   1033.35   668.06   185.95  34.62  169.67  57.55  16.28   67.15  
1 1 1 -2  -10 22 o 12 224.15  31.89  1580.41   398.75   1559.23  469.29   1635.42   756.20   218.20  38.89  206.26  60.17  11.95   71.64  
1 1 1 -2  -10 23 o 2  126.81  31.00  519.07    223.73   519.07   223.73   0.00      0.00     126.81  31.00  ?       ?      0.00    31.00  
1 1 1 -2  -10 24 o 15 103.22  31.46  343.33    203.31   343.33   203.31   0.00      0.00     103.22  31.46  ?       ?      0.00    31.46  
1 1 1 -2  -10 25 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  -9  1  o 1  220.33  25.92  1448.86   321.55   1755.37  452.84   1137.18   456.66   239.83  33.83  188.80  43.09  51.03   54.78  
1 1 1 -2  -9  2  o 2  350.17  39.05  3766.68   771.60   4013.89  1089.92  3518.29   1092.50  350.18  56.11  323.91  60.99  26.26   82.88  
1 1 1 -2  -9  3  o 13 107.86  12.04  339.91    73.26    320.00   95.15    368.90    114.79   103.80  16.52  111.18  18.65  -7.38   24.91  
1 1 1 -2  -9  4  o 9  146.61  15.26  628.74    126.53   588.26   178.17   669.92    179.72   140.10  22.95  150.08  21.47  -9.97   31.43  
1 1 1 -2  -9  5  o 4  436.33  29.49  5649.06   734.44   5850.82  1039.37  5447.85   1037.95  436.98  41.95  420.48  43.63  16.51   60.53  
1 1 1 -2  -9  6  o 19 206.08  19.38  1243.62   226.60   1243.62  226.60   0.00      0.00     206.08  19.38  ?       ?      0.00    19.38  
1 1 1 -2  -9  7  o 10 593.78  50.94  10892.10  1719.73  10713.12 2105.33  11250.99  2981.24  576.73  64.70  556.71  96.80  20.02   116.43 
1 1 1 -2  -9  8  x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  -9  9  o 6  293.33  45.97  2623.57   748.75   2623.57  748.75   0.00      0.00     293.33  45.97  ?       ?      0.00    45.97  
1 1 1 -2  -9  10 o 11 304.26  47.54  2818.81   803.22   2818.81  803.22   0.00      0.00     304.26  47.54  ?       ?      0.00    47.54  
1 1 1 -2  -9  11 o 4  678.60  126.05 16965.78  4729.77  16965.78 4729.77  0.00      0.00     678.60  126.05 ?       ?      0.00    126.05 
1 1 1 -2  -9  12 o 6  600.68  55.42  11018.04  1889.51  11512.84 2312.58  10024.33  3277.24  605.47  67.69  527.77  111.66 77.71   130.57 
1 1 1 -2  -9  13 o 8  672.38  76.44  14772.56  2898.09  14772.56 2898.09  0.00      0.00     672.38  76.44  ?       ?      0.00    76.44  
1 1 1 -2  -9  14 o 5  59.48   28.88  -515.95   309.49   0.00     0.00     -515.95   309.49   ?       ?      59.48   28.88  0.00    28.88  
1 1 1 -2  -9  15 o 11 225.30  28.49  1509.55   360.28   1322.74  476.67   1758.48   550.24   206.77  41.60  239.21  41.58  -32.44  58.82  
1 1 1 -2  -9  16 o 10 50.29   24.80  -551.21   256.75   -217.27  306.36   -1339.18  470.60   71.09   32.69  61.33   30.77  9.76    44.90  
1 1 1 -2  -9  17 o 8  309.34  50.86  2985.66   871.87   2985.66  871.87   0.00      0.00     309.34  50.86  ?       ?      0.00    50.86  
1 1 1 -2  -9  18 o 14 84.49   31.06  171.98    197.86   206.64   224.71   52.40     417.38   91.09   33.16  99.36   42.14  -8.27   53.63  
1 1 1 -2  -9  19 o 15 217.59  28.59  1426.04   348.46   1401.15  443.61   1466.13   563.06   212.10  37.82  212.85  47.31  -0.76   60.57  
1 1 1 -2  -9  20 o 13 115.97  46.85  257.98    482.15   0.00     0.00     257.98    482.15   ?       ?      115.97  46.85  0.00    46.85  
1 1 1 -2  -9  21 o 5  161.83  52.21  880.48    551.88   0.00     0.00     880.48    551.88   ?       ?      161.83  52.21  0.00    52.21  
1 1 1 -2  -9  22 o 5  112.91  46.83  232.49    497.85   0.00     0.00     232.49    497.85   ?       ?      112.91  46.83  0.00    46.83  
1 1 1 -2  -9  23 o 5  172.50  54.41  1093.52   602.18   0.00     0.00     1093.52   602.18   ?       ?      172.50  54.41  0.00    54.41  
1 1 1 -2  -9  24 o 18 134.41  51.63  589.36    559.92   0.00     0.00     589.36    559.92   ?       ?      134.41  51.63  0.00    51.63  
1 1 1 -2  -9  25 o 1  189.84  29.31  1146.36   309.19   1124.42  355.22   1214.95   627.99   184.44  34.83  174.46  55.63  9.99    65.63  
1 1 1 -2  -9  26 o 16 103.85  29.02  352.87    179.68   352.87   179.68   0.00      0.00     103.85  29.02  ?       ?      0.00    29.02  
1 1 1 -2  -8  1  o 8  124.99  54.62  1.73      742.34   5.13     1049.83  -1.68     1049.83  145.38  64.19  145.16  64.14  0.22    90.74  
1 1 1 -2  -8  2  o 1  301.85  22.29  2676.42   383.55   2550.08  542.21   2802.97   542.64   290.67  33.08  305.62  31.37  -14.95  45.59  
1 1 1 -2  -8  3  o 15 130.97  10.68  497.63    79.60    489.58   115.40   504.94    109.93   129.05  15.91  131.28  14.85  -2.23   21.76  
1 1 1 -2  -8  4  o 12 196.49  16.85  1128.07   188.23   1065.21  232.29   1248.28   321.23   189.78  21.71  203.72  28.22  -13.94  35.61  
1 1 1 -2  -8  5  o 10 327.57  37.47  3279.48   691.99   3653.41  977.32   2903.57   979.91   336.93  52.22  294.71  59.96  42.22   79.51  
1 1 1 -2  -8  6  o 18 73.25   9.05   156.83    37.25    78.90    42.86    397.36    75.31    51.43   14.10  116.83  11.37  -65.40  18.11  
1 1 1 -2  -8  7  o 5  50.63   9.63   76.28     26.98    76.61    29.14    74.32     71.48    50.65   10.37  53.67   18.80  -3.02   21.47  
1 1 1 -2  -8  8  o 17 90.67   12.30  241.42    62.38    301.02   79.02    142.86    101.62   101.15  13.98  70.52   22.37  30.63   26.38  
1 1 1 -2  -8  9  o 8  292.64  30.71  2549.17   508.15   2549.17  508.15   0.00      0.00     292.64  30.71  ?       ?      0.00    30.71  
1 1 1 -2  -8  10 o 7  79.85   10.81  186.85    48.26    194.11   54.12    158.67    106.64   81.24   11.96  73.96   22.83  7.28    25.78  
1 1 1 -2  -8  11 o 3  290.89  23.65  2470.79   391.57   2483.80  476.55   2443.77   687.01   290.44  28.97  283.70  43.58  6.74    52.33  
1 1 1 -2  -8  12 f 0  84.02   23.71  210.02    119.34   135.69   156.94   311.94    183.77   75.80   27.70  102.37  29.60  -26.57  40.54  
1 1 1 -2  -8  13 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  -8  14 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  -8  15 o 12 592.09  113.39 13315.16  3713.68  13315.16 3713.68  0.00      0.00     592.09  113.39 ?       ?      0.00    113.39 
1 1 1 -2  -8  16 o 4  247.44  40.44  1875.75   554.58   1875.75  554.58   0.00      0.00     247.44  40.44  ?       ?      0.00    40.44  
1 1 1 -2  -8  17 o 15 232.26  28.88  1603.23   376.72   1634.23  500.31   1562.64   572.49   231.42  39.05  223.82  46.09  7.60    60.41  
1 1 1 -2  -8  18 o 17 527.85  96.38  9966.65   2812.95  0.00     0.00     9966.65   2812.95  ?       ?      527.85  96.38  0.00    96.38  
1 1 1 -2  -8  19 o 4  125.15  29.14  478.96    205.43   490.11   235.22   443.12    421.76   126.30  32.31  127.59  45.57  -1.30   55.86  
1 1 1 -2  -8  20 o 16 75.97   26.70  152.18    144.25   177.91   154.96   -15.04    394.99   80.67   27.71  92.35   40.11  -11.68  48.75  
1 1 1 -2  -8  21 o 3  94.85   27.54  273.88    158.75   256.85   172.10   371.04    411.13   92.80   29.06  118.97  44.58  -26.17  53.22  
1 1 1 -2  -8  22 o 1  213.28  28.19  1385.56   336.71   1405.87  415.89   1346.93   573.64   211.47  35.52  199.01  50.22  12.46   61.51  
1 1 1 -2  -8  23 o 7  174.15  26.98  933.14    261.02   1042.48  307.60   651.91    493.32   182.73  30.39  141.00  49.38  41.73   57.98  
1 1 1 -2  -8  24 o 5  245.18  55.30  2212.25   759.78   0.00     0.00     2212.25   759.78   ?       ?      245.18  55.30  0.00    55.30  
1 1 1 -2  -8  25 o 10 172.25  51.44  1108.78   547.47   0.00     0.00     1108.78   547.47   ?       ?      172.25  51.44  0.00    51.44  
1 1 1 -2  -8  26 o 14 121.86  25.00  469.43    169.05   547.74   180.03   -114.39   491.54   132.02  24.66  91.35   41.79  40.67   48.52  
1 1 1 -2  -8  27 o 3  134.51  25.54  577.55    189.96   583.46   203.67   538.03    526.75   134.27  27.35  124.16  49.37  10.11   56.45  
1 1 1 -2  -7  1  o 13 86.32   37.53  -36.90    346.74   -3.27    490.32   -70.54    490.41   104.30  44.99  100.93  44.24  3.37    63.10  
1 1 1 -2  -7  2  o 4  104.53  8.11   316.08    48.31    355.01   60.16    245.39    81.06    110.66  9.56   90.80   16.14  19.86   18.76  
1 1 1 -2  -7  3  o 1  208.13  16.02  1260.31   189.92   1224.02  268.44   1296.69   268.75   203.55  23.40  209.75  22.68  -6.20   32.59  
1 1 1 -2  -7  4  o 15 369.44  26.69  4026.06   562.27   4146.65  795.21   3905.49   795.14   369.99  37.98  358.32  39.30  11.67   54.65  
1 1 1 -2  -7  5  o 2  379.80  27.09  4264.63   586.83   4240.98  829.88   4288.29   829.92   372.84  39.37  375.06  39.12  -2.23   55.50  
1 1 1 -2  -7  6  o 1  103.76  10.67  313.52    62.63    366.77   75.43    195.26    112.41   112.14  11.90  80.72   23.09  31.41   25.98  
1 1 1 -2  -7  7  o 14 104.87  9.84   319.54    58.52    324.98   70.42    307.39    105.20   105.48  11.83  101.26  18.79  4.22    22.21  
1 1 1 -2  -7  8  o 15 132.61  13.69  513.59    102.76   615.34   126.89   319.76    175.14   144.97  15.49  102.48  28.66  42.49   32.57  
1 1 1 -2  -7  9  o 2  110.92  14.04  361.24    87.41    361.24   87.41    0.00      0.00     110.92  14.04  ?       ?      0.00    14.04  
1 1 1 -2  -7  10 o 14 202.25  21.21  1203.81   242.59   1214.97  338.48   1192.02   347.85   200.71  30.32  198.37  31.61  2.34    43.80  
1 1 1 -2  -7  11 o 6  69.93   10.54  143.94    40.99    147.06   45.78    131.33    92.05    70.51   11.72  67.60   21.27  2.91    24.28  
1 1 1 -2  -7  12 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  -7  13 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  -7  14 o 2  648.74  74.10  13355.36  2710.17  15349.47 3832.92  11361.57  3832.60  668.11  103.26 552.98  123.82 115.13  161.23 
1 1 1 -2  -7  15 o 11 138.43  20.39  565.94    157.16   570.60   203.02   558.98    248.24   137.82  26.62  135.57  32.35  2.25    41.90  
1 1 1 -2  -7  16 o 10 409.87  66.82  5416.08   1518.10  5416.08  1518.10  0.00      0.00     409.87  66.82  ?       ?      0.00    66.82  
1 1 1 -2  -7  17 o 3  295.98  47.22  2721.80   775.43   2721.80  775.43   0.00      0.00     295.98  47.22  ?       ?      0.00    47.22  
1 1 1 -2  -7  18 o 14 151.57  31.85  701.07    268.28   701.07   268.28   0.00      0.00     151.57  31.85  ?       ?      0.00    31.85  
1 1 1 -2  -7  19 o 15 348.53  32.85  3611.36   649.42   1844.06  869.66   5839.19   976.42   237.44  62.83  441.05  38.96  -203.61 73.94  
1 1 1 -2  -7  20 o 3  265.94  32.18  2120.89   481.25   2477.17  642.56   1665.73   726.27   284.38  40.50  226.16  56.19  58.22   69.27  
1 1 1 -2  -7  21 o 4  239.32  29.53  1725.32   397.05   1935.97  522.03   1436.19   611.58   250.33  37.48  208.89  51.36  41.44   63.58  
1 1 1 -2  -7  22 o 3  91.70   38.59  75.65     345.30   0.00     0.00     75.65     345.30   ?       ?      91.70   38.59  0.00    38.59  
1 1 1 -2  -7  23 o 18 137.66  24.43  578.43    185.99   602.28   210.62   494.02    396.31   139.63  27.25  127.11  44.28  12.52   51.99  
1 1 1 -2  -7  24 o 15 183.01  26.60  1029.22   271.32   1213.38  328.77   636.03    480.39   197.35  29.96  138.97  48.72  58.38   57.20  
1 1 1 -2  -7  25 o 5  171.56  25.83  910.21    246.46   976.48   289.76   736.86    468.64   175.85  29.76  144.93  48.19  30.92   56.64  
1 1 1 -2  -7  26 o 16 54.16   20.94  60.76     92.48    72.62    95.03    -151.41   401.91   56.47   21.37  82.13   37.65  -25.66  43.30  
1 1 1 -2  -7  27 o 11 111.35  43.95  370.31    414.47   0.00     0.00     370.31    414.47   ?       ?      111.35  43.95  0.00    43.95  
1 1 1 -2  -7  28 o 12 137.50  46.84  736.64    442.64   0.00     0.00     736.64    442.64   ?       ?      137.50  46.84  0.00    46.84  
1 1 1 -2  -6  1  o 5  773.50  73.27  19101.66  3214.48  18222.18 3936.95  20860.52  5567.55  729.98  96.29  723.57  139.09 6.41    169.17 
1 1 1 -2  -6  2  o 16 414.63  29.38  5045.76   694.81   4947.37  982.60   5144.16   982.61   405.59  42.85  414.05  41.92  -8.46   59.94  
1 1 1 -2  -6  3  o 1  341.63  24.29  3409.62   473.26   3328.98  669.27   3490.26   669.31   334.28  35.41  342.68  34.49  -8.39   49.44  
1 1 1 -2  -6  4  o 1  136.88  11.34  543.11    88.29    542.78   108.62   543.74    151.56   136.48  14.06  135.56  20.08  0.92    24.52  
1 1 1 -2  -6  5  o 11 761.26  73.93  19155.44  3190.04  19752.57 5525.08  18856.84  3907.06  651.12  150.79 723.97  96.40  -72.85  178.97 
1 1 1 -2  -6  6  o 9  476.20  36.28  6799.95   984.30   6990.96  1392.03  6608.96   1391.98  472.44  52.20  457.93  53.99  14.51   75.09  
1 1 1 -2  -6  7  o 19 214.89  17.04  1346.32   208.47   1407.36  255.08   1223.52   361.77   219.00  20.53  200.71  32.51  18.29   38.45  
1 1 1 -2  -6  8  o 8  274.86  29.32  2257.51   455.42   2257.51  455.42   0.00      0.00     274.86  29.32  ?       ?      0.00    29.32  
1 1 1 -2  -6  9  o 8  96.28   9.60   269.61    52.36    270.35   61.93    267.77    98.02    96.14   11.45  94.35   18.76  1.79    21.97  
1 1 1 -2  -6  10 o 10 373.22  32.09  4179.42   680.87   4350.56  833.60   3836.43   1180.14  376.99  39.08  337.74  63.19  39.26   74.30  
1 1 1 -2  -6  11 o 15 194.32  14.95  1098.71   165.54   1039.38  201.26   1222.79   291.07   188.20  18.88  202.57  25.60  -14.37  31.81  
1 1 1 -2  -6  12 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  -6  13 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  -6  14 o 8  55.72   20.94  66.35     90.81    0.00     0.00     66.35     90.81    ?       ?      55.72   20.94  0.00    20.94  
1 1 1 -2  -6  15 o 11 331.02  51.28  3358.57   943.00   0.00     0.00     3358.57   943.00   ?       ?      331.02  51.28  0.00    51.28  
1 1 1 -2  -6  16 o 4  341.05  37.18  3462.24   716.14   3978.67  1012.19  2944.61   1013.36  360.92  50.21  305.75  59.88  55.18   78.14  
1 1 1 -2  -6  17 o 11 394.19  43.07  4701.29   958.84   5145.75  1354.76  4255.20   1357.26  403.22  60.38  361.71  67.86  41.51   90.83  
1 1 1 -2  -6  18 o 8  357.17  39.83  3866.07   802.76   4313.57  1123.05  3398.52   1147.92  369.45  54.59  321.52  64.44  47.93   84.46  
1 1 1 -2  -6  19 o 9  183.16  30.82  1013.23   312.61   1013.23  312.61   0.00      0.00     183.16  30.82  ?       ?      0.00    30.82  
1 1 1 -2  -6  20 o 3  240.71  38.74  1767.25   517.12   1767.25  517.12   0.00      0.00     240.71  38.74  ?       ?      0.00    38.74  
1 1 1 -2  -6  21 o 11 118.33  26.95  426.86    178.96   426.86   178.96   0.00      0.00     118.33  26.95  ?       ?      0.00    26.95  
1 1 1 -2  -6  22 o 9  156.21  23.12  730.88    201.03   825.29   242.18   521.63    360.52   165.21  26.42  130.48  42.20  34.73   49.79  
1 1 1 -2  -6  23 o 9  111.48  22.79  379.09    140.94   503.74   162.06   -7.86     285.54   128.95  22.72  78.84   34.17  50.12   41.03  
1 1 1 -2  -6  24 o 12 68.67   23.19  132.10    108.50   126.05   121.26   156.40    242.93   69.03   24.46  86.20   33.76  -17.17  41.69  
1 1 1 -2  -6  25 o 8  108.85  19.41  359.94    116.84   328.54   130.53   486.49    262.04   103.02  22.69  122.34  35.34  -19.33  41.99  
1 1 1 -2  -6  26 o 19 37.25   16.84  -38.90    76.99    -28.70   80.48    -149.02   264.50   39.35   17.55  65.92   30.34  -26.57  35.05  
1 1 1 -2  -6  27 o 18 115.35  19.50  407.39    124.52   453.47   136.19   172.63    307.42   121.57  20.22  91.03   37.18  30.55   42.32  
1 1 1 -2  -6  28 o 13 150.93  22.01  706.57    185.13   727.24   215.54   648.44    361.50   151.19  25.76  133.22  42.18  17.96   49.42  
1 1 1 -2  -6  29 o 16 96.08   38.74  256.77    328.91   0.00     0.00     256.77    328.91   ?       ?      96.08   38.74  0.00    38.74  
1 1 1 -2  -5  1  o 19 327.24  30.82  3147.20   572.19   3729.47  809.66   2566.24   808.74   353.63  40.62  289.38  50.52  64.26   64.82  
1 1 1 -2  -5  2  o 2  463.93  48.34  6478.11   1268.68  6563.03  1794.49  6393.26   1793.88  455.46  70.94  448.79  72.07  6.68    101.13 
1 1 1 -2  -5  3  o 16 232.71  23.11  1583.67   304.60   1672.22  431.45   1495.69   430.09   237.12  32.55  223.50  34.64  13.61   47.54  
1 1 1 -2  -5  4  o 4  707.55  77.24  16074.00  3086.46  16917.06 4365.24  15231.19  4364.58  685.35  115.02 640.23  123.22 45.11   168.57 
1 1 1 -2  -5  5  o 14 137.99  20.55  562.90    157.82   0.00     0.00     562.90    157.82   ?       ?      137.99  20.55  0.00    20.55  
1 1 1 -2  -5  6  o 1  648.36  47.73  12745.32  1764.22  12958.95 2494.99  12531.69  2494.98  635.52  69.52  623.53  70.96  11.98   99.34  
1 1 1 -2  -5  7  o 6  197.48  18.17  1138.29   203.67   1224.11  249.31   966.09    353.16   204.17  21.60  177.54  35.89  26.63   41.88  
1 1 1 -2  -5  8  o 12 210.34  21.40  1300.26   254.80   1300.26  254.80   0.00      0.00     210.34  21.40  ?       ?      0.00    21.40  
1 1 1 -2  -5  9  o 12 68.39   7.81   136.28    30.10    125.68   34.11    173.59    64.00    65.42   9.35   76.15   15.17  -10.73  17.82  
1 1 1 -2  -5  10 o 3  135.52  21.74  549.06    163.43   0.00     0.00     549.06    163.43   ?       ?      135.52  21.74  0.00    21.74  
1 1 1 -2  -5  11 o 15 110.35  12.96  356.54    80.56    321.28   110.97   395.80    117.12   103.43  19.40  115.33  18.30  -11.89  26.67  
1 1 1 -2  -5  12 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  -5  13 o 13 105.17  12.78  323.82    75.57    334.61   100.67   309.88    114.37   106.16  17.10  101.46  20.34  4.69    26.58  
1 1 1 -2  -5  14 o 17 230.93  35.32  1615.18   453.32   1615.18  453.32   0.00      0.00     230.93  35.32  ?       ?      0.00    35.32  
1 1 1 -2  -5  15 o 11 185.20  20.65  1005.45   215.77   1175.03  302.33   829.39    308.05   199.01  27.17  165.16  33.63  33.85   43.24  
1 1 1 -2  -5  16 o 15 319.40  34.54  3025.67   623.18   3448.59  881.24   2602.59   881.39   336.99  46.82  288.90  55.16  48.09   72.35  
1 1 1 -2  -5  17 o 10 398.82  63.37  5010.50   1402.39  0.00     0.00     5010.50   1402.39  ?       ?      398.82  63.37  0.00    63.37  
1 1 1 -2  -5  18 o 17 343.75  54.61  3706.65   1041.64  0.00     0.00     3706.65   1041.64  ?       ?      343.75  54.61  0.00    54.61  
1 1 1 -2  -5  19 o 14 280.53  32.92  2359.78   520.13   3055.95  723.27   1614.16   748.52   316.39  40.77  222.22  58.05  94.17   70.94  
1 1 1 -2  -5  20 o 6  395.53  44.29  4793.34   988.33   5307.45  1389.78  4267.32   1405.79  405.17  61.70  356.02  71.27  49.15   94.27  
1 1 1 -2  -5  21 o 7  358.12  32.10  3814.82   652.88   2093.79  909.08   5648.00   938.24   251.83  63.04  433.39  38.10  -181.57 73.65  
1 1 1 -2  -5  22 o 1  241.88  38.63  1803.08   518.31   1803.08  518.31   0.00      0.00     241.88  38.63  ?       ?      0.00    38.63  
1 1 1 -2  -5  23 o 2  265.91  42.94  2247.96   633.22   2247.96  633.22   0.00      0.00     265.91  42.94  ?       ?      0.00    42.94  
1 1 1 -2  -5  24 o 12 290.58  48.88  2804.65   786.54   2804.65  786.54   0.00      0.00     290.58  48.88  ?       ?      0.00    48.88  
1 1 1 -2  -5  25 o 16 198.32  24.64  1193.27   274.53   1417.10  362.62   892.71    420.20   213.53  30.44  162.48  43.98  51.06   53.49  
1 1 1 -2  -5  26 o 3  158.40  21.52  761.71    190.64   931.82   236.72   447.76    321.58   174.23  24.33  117.76  39.93  56.47   46.75  
1 1 1 -2  -5  27 o 7  100.68  20.14  312.88    112.35   312.70   125.03   313.60    256.05   100.00  22.34  100.87  35.56  -0.87   41.99  
1 1 1 -2  -5  28 o 12 141.29  21.04  614.75    165.49   608.44   196.98   629.89    305.10   138.34  25.75  134.26  37.92  4.08    45.84  
1 1 1 -2  -5  29 o 5  55.26   20.72  74.50     88.85    61.60    94.23    177.82    266.72   54.06   21.07  86.09   34.82  -32.03  40.70  
1 1 1 -2  -5  30 o 5  112.73  21.76  404.03    135.73   345.25   151.45   643.92    305.96   102.26  25.80  131.75  38.22  -29.48  46.12  
1 1 1 -2  -4  1  o 14 532.27  56.16  8587.62   1690.10  8297.77  2390.14  8877.48   2390.17  506.55  85.22  526.55  81.72  -20.00  118.07 
1 1 1 -2  -4  2  o 6  202.87  20.61  1200.66   236.72   1193.97  334.75   1207.35   334.80   200.52  30.00  201.70  29.81  -1.18   42.29  
1 1 1 -2  -4  3  o 3  1084.75 144.09 44439.85  8750.76  44582.68 12375.43 44297.02  12375.45 906.10  235.71 901.09  236.35 5.01    333.80 
1 1 1 -2  -4  4  o 4  897.74  77.51  25459.61  3955.60  24583.63 6851.13  25897.63  4844.65  780.49  158.33 883.31  97.14  -102.82 185.75 
1 1 1 -2  -4  5  o 11 150.98  15.34  663.59    131.14   723.89   185.54   603.39    185.40   156.84  21.15  142.51  23.48  14.33   31.60  
1 1 1 -2  -4  6  o 19 405.66  27.24  4808.41   630.72   4766.19  891.97   4850.64   891.98   400.09  39.34  403.78  38.96  -3.70   55.37  
1 1 1 -2  -4  7  o 17 585.52  105.27 12236.52  3408.25  12236.52 3408.25  0.00      0.00     585.52  105.27 ?       ?      0.00    105.27 
1 1 1 -2  -4  8  o 14 376.23  60.02  4494.01   1252.84  4494.01  1252.84  0.00      0.00     376.23  60.02  ?       ?      0.00    60.02  
1 1 1 -2  -4  9  o 14 296.19  46.29  2726.24   761.36   2726.24  761.36   0.00      0.00     296.19  46.29  ?       ?      0.00    46.29  
1 1 1 -2  -4  10 f 0  187.87  28.69  1062.60   299.58   1062.60  299.58   0.00      0.00     187.87  28.69  ?       ?      0.00    28.69  
1 1 1 -2  -4  11 o 2  237.78  36.86  1737.94   486.82   1737.94  486.82   0.00      0.00     237.78  36.86  ?       ?      0.00    36.86  
1 1 1 -2  -4  12 o 3  135.77  21.67  551.52    163.21   0.00     0.00     551.52    163.21   ?       ?      135.77  21.67  0.00    21.67  
1 1 1 -2  -4  13 o 12 71.30   13.90  152.01    54.86    152.01   54.86    0.00      0.00     71.30   13.90  ?       ?      0.00    13.90  
1 1 1 -2  -4  14 o 16 76.31   12.23  172.15    51.77    199.42   64.24    121.65    87.41    81.92   14.17  65.20   20.75  16.72   25.13  
1 1 1 -2  -4  15 o 11 145.65  15.86  620.35    130.51   629.11   179.21   610.47    190.43   145.45  22.16  142.81  24.08  2.64    32.73  
1 1 1 -2  -4  16 o 5  139.72  15.50  570.11    122.26   566.11   165.90   574.85    180.88   138.13  21.63  138.83  23.54  -0.70   31.97  
1 1 1 -2  -4  17 o 15 120.47  14.93  424.70    101.05   535.79   133.83   277.40    154.11   135.09  17.68  96.26   26.87  38.84   32.16  
1 1 1 -2  -4  18 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  -4  19 o 2  338.14  36.63  3432.85   699.66   3755.43  986.62   3106.49   992.36   347.08  51.04  311.84  57.55  35.25   76.93  
1 1 1 -2  -4  20 o 16 44.88   21.90  -337.51   184.67   0.00     0.00     -337.51   184.67   ?       ?      44.88   21.90  0.00    21.90  
1 1 1 -2  -4  21 o 8  66.23   28.62  -16.87    199.13   0.00     0.00     -16.87    199.13   ?       ?      66.23   28.62  0.00    28.62  
1 1 1 -2  -4  22 o 18 38.02   17.56  -72.11    89.70    15.48    95.68    -707.68   257.76   49.12   20.47  46.17   23.11  2.95    30.87  
1 1 1 -2  -4  23 o 18 84.96   17.60  217.31    82.99    212.48   91.04    241.07    201.89   83.78   19.32  92.84   31.63  -9.06   37.07  
1 1 1 -2  -4  24 o 4  136.11  32.34  582.69    248.98   0.00     0.00     582.69    248.98   ?       ?      136.11  32.34  0.00    32.34  
1 1 1 -2  -4  25 o 16 245.59  40.51  1950.20   551.20   1950.20  551.20   0.00      0.00     245.59  40.51  ?       ?      0.00    40.51  
1 1 1 -2  -4  26 f 0  150.53  25.70  701.50    214.16   701.50   214.16   0.00      0.00     150.53  25.70  ?       ?      0.00    25.70  
1 1 1 -2  -4  27 o 11 163.41  21.07  811.95    193.09   893.84   248.29   686.64    307.13   169.01  26.46  142.43  37.17  26.58   45.63  
1 1 1 -2  -4  28 o 2  302.83  38.07  3104.15   647.17   3411.42  903.21   2779.96   927.75   294.60  55.44  252.14  64.00  42.46   84.67  
1 1 1 -2  -4  29 o 3  151.21  26.50  735.16    221.66   735.16   221.66   0.00      0.00     151.21  26.50  ?       ?      0.00    26.50  
1 1 1 -2  -4  30 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  -3  1  o 19 291.12  43.90  2552.14   710.94   2552.14  710.94   0.00      0.00     291.12  43.90  ?       ?      0.00    43.90  
1 1 1 -2  -3  2  o 5  212.78  31.68  1345.98   375.14   1345.98  375.14   0.00      0.00     212.78  31.68  ?       ?      0.00    31.68  
1 1 1 -2  -3  3  x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  -3  4  o 14 478.44  76.06  7250.58   2019.23  7250.58  2019.23  0.00      0.00     478.44  76.06  ?       ?      0.00    76.06  
1 1 1 -2  -3  5  o 9  177.93  15.01  918.23    151.91   564.66   213.92   1277.84   215.74   137.00  28.14  209.71  18.10  -72.71  33.46  
1 1 1 -2  -3  6  o 3  192.05  18.38  1073.98   200.19   942.36   282.45   1206.84   283.78   177.87  28.63  202.55  24.93  -24.69  37.97  
1 1 1 -2  -3  7  o 13 736.87  149.31 21904.35  6099.52  21904.35 6099.52  0.00      0.00     736.87  149.31 ?       ?      0.00    149.31 
1 1 1 -2  -3  8  o 17 326.80  25.49  3123.63   474.42   3036.32  580.90   3298.51   822.11   320.46  32.00  329.86  44.55  -9.40   54.86  
1 1 1 -2  -3  9  o 18 97.12   9.98   274.23    54.84    325.79   66.52    164.79    96.90    105.81  11.12  74.54   21.48  31.26   24.18  
1 1 1 -2  -3  10 o 9  133.95  14.14  523.71    107.12   568.34   151.06   478.55    151.93   138.63  19.52  126.55  21.69  12.09   29.18  
1 1 1 -2  -3  11 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  -3  12 o 10 235.84  36.49  1710.31   478.06   1710.31  478.06   0.00      0.00     235.84  36.49  ?       ?      0.00    36.49  
1 1 1 -2  -3  13 o 16 158.25  24.23  751.59    213.11   751.59   213.11   0.00      0.00     158.25  24.23  ?       ?      0.00    24.23  
1 1 1 -2  -3  14 o 1  100.20  18.33  300.88    101.58   0.00     0.00     300.88    101.58   ?       ?      100.20  18.33  0.00    18.33  
1 1 1 -2  -3  15 o 19 85.10   11.46  212.52    54.57    169.73   71.40    272.60    84.62    75.06   16.97  95.78   15.95  -20.72  23.29  
1 1 1 -2  -3  16 o 4  310.64  32.48  2879.16   570.67   2920.48  806.21   2837.66   807.88   306.65  47.32  301.75  48.26  4.91    67.59  
1 1 1 -2  -3  17 o 19 351.03  36.61  3675.74   726.86   3697.75  1026.98  3653.65   1028.88  344.99  53.60  342.65  54.10  2.34    76.15  
1 1 1 -2  -3  18 o 2  69.14   16.48  143.48    64.46    160.34   78.72    109.16    112.32   73.10   18.69  66.10   23.53  7.00    30.05  
1 1 1 -2  -3  19 o 13 548.67  97.92  10655.84  2971.05  0.00     0.00     10655.84  2971.05  ?       ?      548.67  97.92  0.00    97.92  
1 1 1 -2  -3  20 o 5  513.62  57.26  8379.21   1659.66  8511.13  2345.42  8246.90   2348.82  489.65  86.61  479.80  88.54  9.84    123.85 
1 1 1 -2  -3  21 o 8  66.36   17.16  132.40    65.84    109.16   72.48    241.95    157.36   61.28   18.81  90.46   27.70  -29.18  33.48  
1 1 1 -2  -3  22 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  -3  23 o 4  63.04   27.27  -16.72    181.29   0.00     0.00     -16.72    181.29   ?       ?      63.04   27.27  0.00    27.27  
1 1 1 -2  -3  24 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  -3  25 o 17 130.68  17.79  508.38    129.97   552.19   160.50   424.92    221.50   135.28  21.38  116.09  32.14  19.19   38.60  
1 1 1 -2  -3  26 o 8  92.27   19.63  260.46    100.78   260.46   100.78   0.00      0.00     92.27   19.63  ?       ?      0.00    19.63  
1 1 1 -2  -3  27 o 14 214.31  36.08  1507.96   428.13   1507.96  428.13   0.00      0.00     214.31  36.08  ?       ?      0.00    36.08  
1 1 1 -2  -3  28 o 15 176.92  29.77  1008.41   291.65   1008.41  291.65   0.00      0.00     176.92  29.77  ?       ?      0.00    29.77  
1 1 1 -2  -3  29 o 13 44.16   17.71  31.15     68.37    40.81    73.39    -32.29    188.06   46.91   18.50  60.56   26.93  -13.65  32.67  
1 1 1 -2  -3  30 o 6  108.91  18.72  368.26    112.83   402.12   130.90   270.37    222.55   112.91  20.97  91.68   33.06  21.23   39.15  
1 1 1 -2  -3  31 o 19 49.88   19.14  56.85     76.93    65.42    82.63    1.07      210.81   52.30   19.90  64.85   28.69  -12.55  34.92  
1 1 1 -2  -2  1  o 4  217.69  22.13  1383.84   272.74   1454.25  385.72   1313.44   385.70   221.42  31.21  209.79  33.12  11.63   45.51  
1 1 1 -2  -2  2  o 4  570.56  60.53  9939.31   1952.35  9249.64  2761.01  10629.02  2761.06  528.78  94.42  573.35  86.58  -44.57  128.11 
1 1 1 -2  -2  3  o 7  621.56  66.86  11924.77  2348.18  11947.87 3320.82  11901.68  3320.83  597.67  100.34 596.29  100.59 1.38    142.08 
1 1 1 -2  -2  4  o 17 650.76  70.36  13154.89  2586.86  12763.36 3658.35  13546.43  3658.39  611.36  108.20 633.75  104.17 -22.39  150.19 
1 1 1 -2  -2  5  o 2  493.56  33.86  7141.38   953.53   7156.67  1348.50  7126.08   1348.49  488.72  48.71  487.62  48.83  1.10    68.97  
1 1 1 -2  -2  6  o 3  547.23  38.39  8826.15   1198.45  8664.01  1694.86  8988.30   1694.88  534.39  56.08  544.98  54.92  -10.59  78.50  
1 1 1 -2  -2  7  o 8  642.32  74.26  13024.92  2687.86  14382.36 3801.09  11667.32  3801.31  647.10  105.99 568.15  120.30 78.95   160.33 
1 1 1 -2  -2  8  o 3  387.83  39.95  4483.91   876.67   4410.20  1239.49  4557.68   1240.10  376.55  59.30  383.45  58.16  -6.90   83.06  
1 1 1 -2  -2  9  o 9  353.88  55.22  3893.82   1085.28  0.00     0.00     3893.82   1085.28  ?       ?      353.88  55.22  0.00    55.22  
1 1 1 -2  -2  10 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  -2  11 o 3  227.90  34.89  1578.49   441.95   0.00     0.00     1578.49   441.95   ?       ?      227.90  34.89  0.00    34.89  
1 1 1 -2  -2  12 o 15 260.48  27.03  2018.80   398.29   1996.74  562.66   2040.95   563.88   253.97  39.91  257.01  39.48  -3.04   56.13  
1 1 1 -2  -2  13 o 12 209.99  22.22  1304.39   263.80   1457.87  372.32   1149.67   373.83   219.47  30.36  192.80  35.07  26.67   46.39  
1 1 1 -2  -2  14 o 12 322.51  52.86  3388.63   944.80   3388.63  944.80   0.00      0.00     322.51  52.86  ?       ?      0.00    52.86  
1 1 1 -2  -2  15 o 3  39.42   13.11  42.48     34.69    42.48    34.69    0.00      0.00     39.42   13.11  ?       ?      0.00    13.11  
1 1 1 -2  -2  16 o 13 347.52  56.47  3902.47   1087.98  3902.47  1087.98  0.00      0.00     347.52  56.47  ?       ?      0.00    56.47  
1 1 1 -2  -2  17 o 6  459.04  78.02  7110.16   1982.42  0.00     0.00     7110.16   1982.42  ?       ?      459.04  78.02  0.00    78.02  
1 1 1 -2  -2  18 f 0  376.01  38.98  4231.13   829.26   4091.22  1171.24  4371.77   1174.28  360.82  58.55  374.33  56.39  -13.51  81.29  
1 1 1 -2  -2  19 o 14 121.93  19.66  440.94    132.92   440.94   132.92   0.00      0.00     121.93  19.66  ?       ?      0.00    19.66  
1 1 1 -2  -2  20 o 5  252.69  38.79  1945.70   544.77   1945.70  544.77   0.00      0.00     252.69  38.79  ?       ?      0.00    38.79  
1 1 1 -2  -2  21 o 8  390.86  42.64  4700.13   941.29   5025.01  1329.32  4373.42   1333.05  391.30  61.18  360.29  66.91  31.01   90.67  
1 1 1 -2  -2  22 o 8  278.56  29.45  2315.02   463.85   2327.69  649.24   2301.82   662.94   273.88  42.68  271.71  44.01  2.17    61.31  
1 1 1 -2  -2  23 o 8  177.47  19.54  926.03    195.75   173.62   256.43   1976.62   303.02   90.87   34.93  259.85  20.48  -168.99 40.49  
1 1 1 -2  -2  24 o 11 321.51  35.12  3155.03   637.74   3413.11  897.00   2891.23   906.89   325.52  49.56  295.14  55.56  30.38   74.46  
1 1 1 -2  -2  25 o 14 222.73  37.64  1574.81   464.12   0.00     0.00     1574.81   464.12   ?       ?      222.73  37.64  0.00    37.64  
1 1 1 -2  -2  26 o 7  193.22  33.94  1186.39   362.78   0.00     0.00     1186.39   362.78   ?       ?      193.22  33.94  0.00    33.94  
1 1 1 -2  -2  27 o 10 146.47  17.96  642.45    147.89   675.97   193.47   595.34    229.39   148.21  23.52  136.18  30.14  12.03   38.23  
1 1 1 -2  -2  28 o 6  52.42   17.98  75.88     65.28    69.61    73.75    98.57     140.24   52.38   19.01  66.49   25.76  -14.10  32.02  
1 1 1 -2  -2  29 o 15 142.11  25.09  642.48    197.22   642.48   197.22   0.00      0.00     142.11  25.09  ?       ?      0.00    25.09  
1 1 1 -2  -2  30 o 13 85.67   21.48  234.42    105.45   234.42   105.45   0.00      0.00     85.67   21.48  ?       ?      0.00    21.48  
1 1 1 -2  -2  31 o 19 189.98  36.14  1315.02   379.72   1315.02  379.72   0.00      0.00     189.98  36.14  ?       ?      0.00    36.14  
1 1 1 -2  -1  1  o 10 520.48  54.87  8200.69   1614.78  8298.64  2283.64  8102.73   2283.64  509.03  80.85  502.13  82.05  6.91    115.19 
1 1 1 -2  -1  2  o 7  614.05  65.97  11626.92  2288.96  11742.25 3237.08  11511.59  3237.07  593.58  98.44  586.62  99.69  6.96    140.10 
1 1 1 -2  -1  3  o 16 314.14  32.15  2904.63   571.67   2809.77  808.46   2999.50   808.48   304.45  47.83  315.36  46.01  -10.90  66.37  
1 1 1 -2  -1  4  o 18 292.83  29.93  2518.76   496.00   2511.65  701.45   2525.87   701.46   288.79  43.67  289.67  43.53  -0.88   61.66  
1 1 1 -2  -1  5  o 12 191.13  19.37  1065.03   209.65   1036.48  296.47   1093.59   296.50   186.84  28.55  192.20  27.67  -5.37   39.75  
1 1 1 -2  -1  6  o 17 484.12  41.41  6945.25   1139.78  7056.02  1974.10  6889.87   1395.96  471.81  75.43  478.06  51.69  -6.25   91.44  
1 1 1 -2  -1  7  o 12 397.68  29.69  4625.98   672.89   4488.69  824.08   4900.64   1165.60  389.60  37.30  402.07  51.69  -12.47  63.75  
1 1 1 -2  -1  8  o 16 686.81  73.25  14893.35  2843.48  14893.35 2843.48  0.00      0.00     686.81  73.25  ?       ?      0.00    73.25  
1 1 1 -2  -1  9  f 0  235.70  24.06  1628.42   321.02   1547.70  453.87   1709.22   454.11   226.81  36.06  239.15  34.04  -12.34  49.59  
1 1 1 -2  -1  10 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  -1  11 o 4  159.04  15.94  738.36    143.58   594.94   202.14   884.39    203.97   140.52  26.02  173.26  20.93  -32.74  33.39  
1 1 1 -2  -1  12 o 10 244.56  37.73  1835.66   512.71   0.00     0.00     1835.66   512.71   ?       ?      244.56  37.73  0.00    37.73  
1 1 1 -2  -1  13 o 5  204.35  31.36  1270.41   356.14   0.00     0.00     1270.41   356.14   ?       ?      204.35  31.36  0.00    31.36  
1 1 1 -2  -1  14 o 11 307.82  50.17  3069.06   856.06   0.00     0.00     3069.06   856.06   ?       ?      307.82  50.17  0.00    50.17  
1 1 1 -2  -1  15 o 6  92.73   10.20  250.87    53.38    212.04   74.03    292.91    77.03    84.15   15.91  99.68   13.83  -15.53  21.08  
1 1 1 -2  -1  16 o 13 136.26  20.74  553.36    157.14   553.36   157.14   0.00      0.00     136.26  20.74  ?       ?      0.00    20.74  
1 1 1 -2  -1  17 o 7  387.85  64.12  4944.03   1377.83  4944.03  1377.83  0.00      0.00     387.85  64.12  ?       ?      0.00    64.12  
1 1 1 -2  -1  18 o 18 331.57  51.83  3421.54   954.36   3421.54  954.36   0.00      0.00     331.57  51.83  ?       ?      0.00    51.83  
1 1 1 -2  -1  19 o 19 390.42  62.18  4832.43   1347.02  4832.43  1347.02  0.00      0.00     390.42  62.18  ?       ?      0.00    62.18  
1 1 1 -2  -1  20 o 2  530.11  58.31  8827.17   1745.06  9039.52  2467.47  8614.67   2468.31  511.24  87.20  496.21  89.96  15.03   125.29 
1 1 1 -2  -1  21 o 6  250.00  38.93  1920.77   540.52   0.00     0.00     1920.77   540.52   ?       ?      250.00  38.93  0.00    38.93  
1 1 1 -2  -1  22 f 0  194.35  20.70  1113.05   227.37   1144.68  317.14   1079.61   326.15   194.70  29.28  188.35  31.26  6.36    42.83  
1 1 1 -2  -1  23 o 8  338.35  36.76  3471.19   702.64   4140.26  991.64   2796.58   995.74   362.92  48.84  289.78  61.75  73.14   78.73  
1 1 1 -2  -1  24 o 19 414.95  46.18  5403.73   1081.52  6054.69  1528.24  4750.63   1530.76  423.00  65.01  364.16  75.70  58.84   99.78  
1 1 1 -2  -1  25 o 8  290.17  31.69  2577.11   519.38   2918.47  732.10   2231.22   736.94   301.14  43.62  257.15  51.72  43.99   67.65  
1 1 1 -2  -1  26 o 5  134.56  16.09  536.40    121.80   677.82   163.59   360.53    182.44   150.52  19.38  107.05  28.98  43.48   34.87  
1 1 1 -2  -1  27 o 2  163.53  28.68  842.22    259.39   0.00     0.00     842.22    259.39   ?       ?      163.53  28.68  0.00    28.68  
1 1 1 -2  -1  28 o 15 54.22   22.21  39.28     110.08   0.00     0.00     39.28     110.08   ?       ?      54.22   22.21  0.00    22.21  
1 1 1 -2  -1  29 o 1  62.68   18.51  120.27    71.19    121.48   88.65    118.07    119.46   63.94   20.95  66.26   24.17  -2.32   31.98  
1 1 1 -2  -1  30 o 11 177.78  20.89  980.64    209.09   1182.95  293.06   770.87    298.41   190.49  27.60  147.17  35.69  43.31   45.12  
1 1 1 -2  -1  31 o 11 56.74   19.18  94.93     74.19    164.25   96.37    -5.97     116.26   71.69   21.62  49.26   21.57  22.44   30.54  
1 1 1 -2  -1  32 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  0   1  o 4  99.92   10.13  289.93    57.28    279.13   81.00    300.74    81.01    97.33   14.98  101.21  14.34  -3.88   20.74  
1 1 1 -2  0   2  o 6  365.92  37.69  3963.65   780.35   4002.07  1103.59  3925.23   1103.58  361.82  54.85  358.02  55.49  3.80    78.02  
1 1 1 -2  0   3  o 6  707.15  77.88  15791.29  3109.44  15643.00 4397.41  15939.57  4397.41  665.87  119.43 673.74  117.99 -7.87   167.88 
1 1 1 -2  0   4  o 3  640.89  69.34  12752.88  2510.65  12903.44 3550.60  12602.32  3550.60  617.73  103.80 608.99  105.37 8.74    147.91 
1 1 1 -2  0   5  f 0  668.80  72.82  13984.23  2750.76  13747.76 3890.16  14220.70  3890.17  630.77  111.51 643.97  109.12 -13.20  156.02 
1 1 1 -2  0   6  o 4  439.71  45.75  5780.44   1138.06  5719.69  1609.46  5841.20   1609.46  427.61  67.83  432.65  66.96  -5.03   95.31  
1 1 1 -2  0   7  o 11 189.01  12.33  1032.15   133.09   837.01   162.92   1423.54   230.73   169.56  16.97  221.39  18.32  -51.83  24.97  
1 1 1 -2  0   8  o 8  427.18  42.80  5446.52   1035.40  5446.52  1035.40  0.00      0.00     427.18  42.80  ?       ?      0.00    42.80  
1 1 1 -2  0   9  o 5  170.27  25.34  859.78    240.17   859.78   240.17   0.00      0.00     170.27  25.34  ?       ?      0.00    25.34  
1 1 1 -2  0   10 o 19 336.21  52.26  3502.31   975.86   0.00     0.00     3502.31   975.86   ?       ?      336.21  52.26  0.00    52.26  
1 1 1 -2  0   11 o 15 374.32  39.38  4226.49   833.46   4258.80  1178.59  4194.17   1178.77  365.93  58.04  362.76  58.60  3.17    82.48  
1 1 1 -2  0   12 o 18 62.49   7.68   113.98    26.96    119.54   36.93    107.63    39.45    63.59   10.48  60.06   11.86  3.53    15.83  
1 1 1 -2  0   13 o 5  183.48  27.83  1015.99   283.95   1015.99  283.95   0.00      0.00     183.48  27.83  ?       ?      0.00    27.83  
1 1 1 -2  0   14 o 16 215.89  22.06  1379.56   269.57   1243.41  381.03   1515.99   381.43   200.61  34.32  223.49  30.53  -22.87  45.93  
1 1 1 -2  0   15 o 18 284.50  45.73  2586.43   721.52   0.00     0.00     2586.43   721.52   ?       ?      284.50  45.73  0.00    45.73  
1 1 1 -2  0   16 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  0   17 o 5  353.72  37.71  3804.32   753.96   4126.27  1066.11  3482.19   1066.42  359.09  53.34  325.58  59.24  33.51   79.71  
1 1 1 -2  0   18 o 15 172.09  17.93  866.35    174.58   989.13   245.94   741.65    247.86   182.74  24.03  156.74  28.60  26.00   37.35  
1 1 1 -2  0   19 o 12 386.80  61.74  4754.03   1324.95  4754.03  1324.95  0.00      0.00     386.80  61.74  ?       ?      0.00    61.74  
1 1 1 -2  0   20 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  0   21 o 2  325.28  51.91  3358.03   936.84   3358.03  936.84   0.00      0.00     325.28  51.91  ?       ?      0.00    51.91  
1 1 1 -2  0   22 o 9  93.37   11.98  255.66    62.75    297.78   84.11    202.79    94.24    100.33  15.07  81.82   20.19  18.52   25.19  
1 1 1 -2  0   23 o 6  197.01  20.81  1143.49   231.85   1414.76  325.82   865.23    329.99   217.75  26.62  166.97  35.52  50.78   44.39  
1 1 1 -2  0   24 o 17 221.60  23.31  1453.76   292.13   1691.43  411.05   1211.23   415.24   236.63  31.00  197.12  38.07  39.51   49.10  
1 1 1 -2  0   25 o 12 204.12  21.63  1238.46   249.64   1529.62  351.24   941.26    354.86   224.75  27.82  172.04  37.03  52.70   46.31  
1 1 1 -2  0   26 o 18 261.18  28.15  2089.27   415.41   2488.70  586.52   1687.25   588.43   278.85  37.60  222.02  47.60  56.83   60.65  
1 1 1 -2  0   27 o 15 49.75   15.89  71.34     51.23    66.24    67.47    78.29     78.73    50.92   18.22  55.07   19.69  -4.14   26.82  
1 1 1 -2  0   28 o 16 117.65  15.32  413.99    101.00   524.42   142.83   303.55    142.84   131.13  19.57  97.59   25.29  33.54   31.98  
1 1 1 -2  0   29 o 12 74.21   21.79  172.28    98.91    0.00     0.00     172.28    98.91    ?       ?      74.21   21.79  0.00    21.79  
1 1 1 -2  0   30 o 17 169.84  30.72  971.90    288.46   0.00     0.00     971.90    288.46   ?       ?      169.84  30.72  0.00    30.72  
1 1 1 -2  0   31 o 5  60.80   22.60  99.50     105.20   0.00     0.00     99.50     105.20   ?       ?      60.80   22.60  0.00    22.60  
1 1 1 -2  0   32 o 13 121.14  26.13  501.15    176.33   501.15   176.33   0.00      0.00     121.14  26.13  ?       ?      0.00    26.13  
1 1 1 -2  1   1  o 2  337.85  34.71  3368.53   663.60   3231.01  938.46   3506.04   938.48   325.41  51.99  340.14  49.52  -14.72  71.79  
1 1 1 -2  1   2  o 9  473.39  75.35  7106.96   1979.04  7106.96  1979.04  0.00      0.00     473.39  75.35  ?       ?      0.00    75.35  
1 1 1 -2  1   3  o 12 418.04  43.29  5208.15   1023.81  5454.78  1447.89  4961.53   1447.88  420.26  61.86  398.80  65.52  21.46   90.11  
1 1 1 -2  1   4  x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  1   5  o 7  841.83  184.49 31132.90  8668.84  0.00     0.00     31132.90  8668.84  ?       ?      841.83  184.49 0.00    184.49 
1 1 1 -2  1   6  o 3  337.61  51.51  3471.98   966.80   0.00     0.00     3471.98   966.80   ?       ?      337.61  51.51  0.00    51.51  
1 1 1 -2  1   7  o 1  400.65  62.28  4976.92   1385.92  4976.92  1385.92  0.00      0.00     400.65  62.28  ?       ?      0.00    62.28  
1 1 1 -2  1   8  o 18 312.60  47.59  2969.67   827.04   2969.67  827.04   0.00      0.00     312.60  47.59  ?       ?      0.00    47.59  
1 1 1 -2  1   9  x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  1   10 o 16 73.87   7.77   158.57    32.46    143.17   45.22    174.96    46.64    69.58   11.74  77.23   10.82  -7.65   15.96  
1 1 1 -2  1   11 o 6  258.56  39.50  2037.31   567.72   0.00     0.00     2037.31   567.72   ?       ?      258.56  39.50  0.00    39.50  
1 1 1 -2  1   12 o 1  116.92  11.86  398.19    78.48    312.32   110.62   485.20    111.36   102.00  19.60  128.61  15.39  -26.62  24.92  
1 1 1 -2  1   13 o 5  225.56  34.69  1559.80   434.88   1559.80  434.88   0.00      0.00     225.56  34.69  ?       ?      0.00    34.69  
1 1 1 -2  1   14 o 8  278.84  29.24  2339.02   461.15   2358.26  652.10   2319.77   652.24   273.10  43.02  270.57  43.46  2.53    61.15  
1 1 1 -2  1   15 o 19 182.40  18.83  980.41    194.36   1037.01  274.63   923.63    275.09   185.38  26.56  174.13  28.51  11.25   38.96  
1 1 1 -2  1   16 o 11 261.13  27.28  2040.93   402.92   2112.65  569.70   1969.16   569.92   260.25  39.36  250.23  41.10  10.03   56.91  
1 1 1 -2  1   17 o 7  146.58  22.35  641.70    182.15   0.00     0.00     641.70    182.15   ?       ?      146.58  22.35  0.00    22.35  
1 1 1 -2  1   18 o 2  542.56  104.05 11212.44  3122.92  0.00     0.00     11212.44  3122.92  ?       ?      542.56  104.05 0.00    104.05 
1 1 1 -2  1   19 o 16 288.89  44.53  2560.50   714.76   0.00     0.00     2560.50   714.76   ?       ?      288.89  44.53  0.00    44.53  
1 1 1 -2  1   20 o 6  176.02  18.16  905.88    180.86   1017.55  255.41   793.59    256.12   185.34  24.61  162.39  28.51  22.95   37.67  
1 1 1 -2  1   21 o 2  280.53  43.83  2443.95   682.69   2443.95  682.69   0.00      0.00     280.53  43.83  ?       ?      0.00    43.83  
1 1 1 -2  1   22 o 3  301.64  48.53  2907.43   811.84   2907.43  811.84   0.00      0.00     301.64  48.53  ?       ?      0.00    48.53  
1 1 1 -2  1   23 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  1   24 o 16 418.03  45.65  5474.32   1077.73  5898.07  1523.88  5050.28   1524.41  416.48  65.93  378.56  72.79  37.92   98.21  
1 1 1 -2  1   25 o 18 241.41  38.57  1837.51   516.49   1837.51  516.49   0.00      0.00     241.41  38.57  ?       ?      0.00    38.57  
1 1 1 -2  1   26 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  1   27 f 0  46.26   15.49  59.36     48.38    79.50    64.50    33.45     73.16    53.32   17.88  45.99   18.36  7.33    25.63  
1 1 1 -2  1   28 o 13 107.42  13.93  343.79    83.87    358.65   117.66   328.44    119.59   107.93  19.72  102.76  20.98  5.17    28.79  
1 1 1 -2  1   29 o 2  65.31   15.92  131.68    59.14    89.70    81.81    177.62    85.59    57.07   20.10  75.25   19.62  -18.18  28.08  
1 1 1 -2  1   30 o 18 223.69  25.40  1605.29   320.34   1837.24  455.31   1377.94   450.78   228.35  35.92  190.22  42.37  38.13   55.54  
1 1 1 -2  1   31 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  1   32 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  2   1  f 0  251.12  37.62  1886.61   525.67   0.00     0.00     1886.61   525.67   ?       ?      251.12  37.62  0.00    37.62  
1 1 1 -2  2   2  o 16 581.00  97.38  11251.27  3133.10  0.00     0.00     11251.27  3133.10  ?       ?      581.00  97.38  0.00    97.38  
1 1 1 -2  2   3  o 13 554.15  91.61  10100.48  2812.60  10100.48 2812.60  0.00      0.00     554.15  91.61  ?       ?      0.00    91.61  
1 1 1 -2  2   4  o 8  459.17  72.79  6661.17   1854.89  0.00     0.00     6661.17   1854.89  ?       ?      459.17  72.79  0.00    72.79  
1 1 1 -2  2   5  o 1  267.08  40.13  2141.14   596.27   0.00     0.00     2141.14   596.27   ?       ?      267.08  40.13  0.00    40.13  
1 1 1 -2  2   6  x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  2   7  x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  2   8  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  2   9  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  2   10 o 18 542.28  96.10  10350.65  2882.18  10350.65 2882.18  0.00      0.00     542.28  96.10  ?       ?      0.00    96.10  
1 1 1 -2  2   11 o 16 403.36  42.78  4952.32   975.45   5017.39  1379.49  4887.24   1379.51  393.54  63.20  387.60  64.25  5.94    90.12  
1 1 1 -2  2   12 o 19 385.98  41.28  4572.80   900.56   4602.29  1273.57  4543.30   1273.61  373.35  61.57  370.52  62.07  2.83    87.43  
1 1 1 -2  2   13 f 0  164.75  16.86  796.11    157.17   748.44   222.12   843.91    222.42   157.56  25.42  168.00  23.72  -10.43  34.77  
1 1 1 -2  2   14 o 6  147.93  22.32  655.88    183.68   0.00     0.00     655.88    183.68   ?       ?      147.93  22.32  0.00    22.32  
1 1 1 -2  2   15 o 1  46.45   6.52   63.25     16.91    72.34    22.23    50.77     26.05    49.49   8.11   41.20   10.86  8.28    13.55  
1 1 1 -2  2   16 o 3  240.70  25.01  1726.97   340.49   1749.23  481.55   1704.71   481.49   237.53  36.48  234.16  37.05  3.36    52.00  
1 1 1 -2  2   17 o 9  74.76   8.53   162.95    35.95    183.73   51.26    142.84    50.44    78.96   11.66  69.18   13.18  9.78    17.60  
1 1 1 -2  2   18 f 0  366.91  38.68  4078.45   802.41   4211.01  1134.83  3945.92   1134.72  362.83  56.31  349.58  58.62  13.26   81.28  
1 1 1 -2  2   19 o 5  171.56  25.79  877.26    246.19   0.00     0.00     877.26    246.19   ?       ?      171.56  25.79  0.00    25.79  
1 1 1 -2  2   20 o 18 333.01  52.36  3472.45   968.03   0.00     0.00     3472.45   968.03   ?       ?      333.01  52.36  0.00    52.36  
1 1 1 -2  2   21 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  2   22 o 13 49.83   15.34  71.89     48.20    71.89    48.20    0.00      0.00     49.83   15.34  ?       ?      0.00    15.34  
1 1 1 -2  2   23 o 19 133.77  21.41  535.62    158.90   535.62   158.90   0.00      0.00     133.77  21.41  ?       ?      0.00    21.41  
1 1 1 -2  2   24 o 8  368.64  62.91  4600.02   1283.53  4600.02  1283.53  0.00      0.00     368.64  62.91  ?       ?      0.00    62.91  
1 1 1 -2  2   25 o 9  72.93   12.93  158.52    52.17    188.69   70.79    122.67    77.17    79.13   16.13  64.37   19.34  14.76   25.18  
1 1 1 -2  2   26 o 1  116.38  14.00  399.91    91.68    391.79   127.54   408.58    131.86   113.51  20.32  115.90  20.57  -2.39   28.92  
1 1 1 -2  2   27 o 4  76.88   13.63  177.46    57.94    204.92   79.28    145.97    84.89    81.89   17.40  69.24   20.15  12.65   26.62  
1 1 1 -2  2   28 o 2  112.07  14.54  375.16    91.34    344.19   126.70   408.68    131.80   104.90  21.75  114.92  20.74  -10.02  30.06  
1 1 1 -2  2   29 o 15 173.18  30.21  994.31    289.45   0.00     0.00     994.31    289.45   ?       ?      173.18  30.21  0.00    30.21  
1 1 1 -2  2   30 o 16 217.72  25.09  1524.30   307.91   1530.79  436.31   1517.86   434.59   204.35  38.61  203.45  38.62  0.90    54.61  
1 1 1 -2  2   31 o 4  62.18   18.45  121.52    70.61    182.64   103.27   67.86     96.77    74.95   22.33  54.63   21.33  20.32   30.88  
1 1 1 -2  2   32 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  3   1  o 15 420.03  43.56  5259.88   1035.10  5131.00  1463.82  5388.76   1463.87  405.91  65.01  417.07  63.11  -11.16  90.61  
1 1 1 -2  3   2  f 0  663.10  72.27  13744.56  2706.39  13759.95 3827.41  13729.16  3827.41  632.47  109.37 631.60  109.53 0.87    154.79 
1 1 1 -2  3   3  o 5  690.04  75.85  15003.03  2955.04  14737.93 4179.06  15268.12  4179.06  647.28  116.76 661.68  114.14 -14.40  163.28 
1 1 1 -2  3   4  o 17 447.29  46.60  5992.86   1178.96  6175.29  1667.32  5810.42   1667.30  444.46  67.46  429.59  70.02  14.88   97.23  
1 1 1 -2  3   5  o 12 571.85  60.86  10021.29  1967.34  10316.28 2782.27  9726.30   2782.22  561.02  89.39  541.97  92.76  19.06   128.82 
1 1 1 -2  3   6  o 12 139.24  20.61  572.17    159.75   0.00     0.00     572.17    159.75   ?       ?      139.24  20.61  0.00    20.61  
1 1 1 -2  3   7  x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  3   8  x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  3   9  x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  3   10 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  3   11 o 16 261.40  40.23  2098.42   584.40   2098.42  584.40   0.00      0.00     261.40  40.23  ?       ?      0.00    40.23  
1 1 1 -2  3   12 o 16 170.04  25.56  867.61    241.77   867.61   241.77   0.00      0.00     170.04  25.56  ?       ?      0.00    25.56  
1 1 1 -2  3   13 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  3   14 o 5  205.26  21.14  1247.75   245.56   1179.55  347.18   1316.02   347.37   195.75  32.00  207.79  29.99  -12.04  43.86  
1 1 1 -2  3   15 o 5  164.99  25.07  822.06    229.96   822.06   229.96   0.00      0.00     164.99  25.07  ?       ?      0.00    25.07  
1 1 1 -2  3   16 o 13 343.04  36.79  3621.09   713.21   3867.37  1008.69  3374.86   1008.58  343.10  52.91  316.52  57.63  26.58   78.23  
1 1 1 -2  3   17 o 6  152.62  15.72  681.97    135.72   640.27   191.88   723.73    192.00   146.01  23.70  155.85  22.08  -9.84   32.39  
1 1 1 -2  3   18 o 10 235.76  36.05  1692.05   472.42   1692.05  472.42   0.00      0.00     235.76  36.05  ?       ?      0.00    36.05  
1 1 1 -2  3   19 o 7  216.58  22.23  1377.61   272.51   1385.84  385.39   1369.37   385.38   214.62  32.28  213.25  32.51  1.37    45.81  
1 1 1 -2  3   20 o 18 327.07  51.50  3353.65   935.00   0.00     0.00     3353.65   935.00   ?       ?      327.07  51.50  0.00    51.50  
1 1 1 -2  3   21 o 5  212.29  32.55  1369.03   384.01   0.00     0.00     1369.03   384.01   ?       ?      212.29  32.55  0.00    32.55  
1 1 1 -2  3   22 o 5  364.20  39.24  4100.67   807.40   4165.60  1141.93  4035.77   1141.73  352.76  58.43  346.15  59.61  6.60    83.47  
1 1 1 -2  3   23 f 0  210.59  32.81  1358.55   383.76   1358.55  383.76   0.00      0.00     210.59  32.81  ?       ?      0.00    32.81  
1 1 1 -2  3   24 o 16 77.97   14.34  181.47    61.84    170.10   87.15    192.99    87.75    75.02   19.91  79.79   19.36  -4.77   27.77  
1 1 1 -2  3   25 o 10 121.46  21.16  445.92    142.15   445.92   142.15   0.00      0.00     121.46  21.16  ?       ?      0.00    21.16  
1 1 1 -2  3   26 o 7  62.31   19.49  114.34    77.44    114.34   77.44    0.00      0.00     62.31   19.49  ?       ?      0.00    19.49  
1 1 1 -2  3   27 o 13 255.25  45.36  2277.41   640.31   2277.41  640.31   0.00      0.00     255.25  45.36  ?       ?      0.00    45.36  
1 1 1 -2  3   28 o 7  110.47  13.35  362.87    82.95    510.35   126.71   252.26    109.74   129.87  17.44  89.49   21.61  40.38   27.76  
1 1 1 -2  3   29 o 16 68.37   14.28  143.25    54.22    76.50    91.35    179.55    67.37    55.85   21.00  76.29   15.90  -20.44  26.34  
1 1 1 -2  3   30 f 0  68.23   14.86  144.06    56.54    246.39   99.11    94.68     68.85    87.84   20.09  56.30   18.46  31.54   27.28  
1 1 1 -2  3   31 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  3   32 o 17 35.49   15.22  3.34      55.46    6.83     99.81    1.79      66.71    46.49   20.18  38.36   16.57  8.13    26.11  
1 1 1 -2  4   1  o 11 809.20  92.34  21395.80  4212.95  21443.93 5958.01  21347.68  5958.01  750.96  143.43 748.70  143.85 2.27    203.14 
1 1 1 -2  4   2  o 12 684.67  75.04  14744.57  2901.13  15235.28 4102.84  14253.88  4102.80  663.41  111.70 636.57  116.57 26.84   161.44 
1 1 1 -2  4   3  o 16 211.35  31.52  1328.93   370.73   0.00     0.00     1328.93   370.73   ?       ?      211.35  31.52  0.00    31.52  
1 1 1 -2  4   4  o 15 321.69  48.97  3143.87   875.82   0.00     0.00     3143.87   875.82   ?       ?      321.69  48.97  0.00    48.97  
1 1 1 -2  4   5  o 10 606.46  65.52  11408.67  2244.98  11550.44 3174.92  11266.91  3174.86  585.08  97.99  576.40  99.55  8.69    139.68 
1 1 1 -2  4   6  o 12 635.34  69.96  12696.88  2509.55  11668.13 3549.02  13725.65  3549.05  572.29  112.04 632.91  101.08 -60.62  150.90 
1 1 1 -2  4   7  o 7  343.83  53.16  3645.28   1015.42  3645.28  1015.42  0.00      0.00     343.83  53.16  ?       ?      0.00    53.16  
1 1 1 -2  4   8  o 4  256.85  27.31  1944.16   396.51   0.00     0.00     1944.16   396.51   ?       ?      256.85  27.31  0.00    27.31  
1 1 1 -2  4   9  o 17 199.37  16.34  1155.89   185.42   1183.96  321.04   1141.84   227.14   199.13  28.93  197.44  20.33  1.68    35.36  
1 1 1 -2  4   10 o 18 405.96  32.81  4906.90   758.10   4437.31  1312.98  5141.75   928.52   367.96  64.51  412.25  39.73  -44.29  75.76  
1 1 1 -2  4   11 o 12 132.64  13.59  513.52    101.99   536.33   144.22   490.70    144.26   134.50  19.22  128.32  20.25  6.19    27.93  
1 1 1 -2  4   12 o 9  110.71  11.46  357.48    71.80    388.05   101.50   326.87    101.57   114.62  15.85  104.69  17.52  9.94    23.62  
1 1 1 -2  4   13 o 14 71.48   10.72  150.67    42.64    150.67   42.64    0.00      0.00     71.48   10.72  ?       ?      0.00    10.72  
1 1 1 -2  4   14 o 18 198.65  20.38  1167.84   229.15   1135.85  324.02   1199.85   324.13   192.49  30.33  198.32  29.36  -5.83   42.21  
1 1 1 -2  4   15 o 11 227.66  23.74  1545.06   305.69   1593.02  432.36   1497.11   432.27   226.86  34.27  219.20  35.57  7.66    49.39  
1 1 1 -2  4   16 o 19 388.11  42.58  4720.66   933.04   4944.90  1319.56  4496.46   1319.47  380.00  62.67  358.41  66.58  21.59   91.44  
1 1 1 -2  4   17 o 3  102.71  11.09  307.72    64.36    421.84   91.30    195.05    90.72    120.08  13.48  80.27   19.81  39.81   23.96  
1 1 1 -2  4   18 o 7  383.02  40.61  4459.51   879.25   4637.88  1243.50  4281.18   1243.39  379.65  58.97  362.53  61.97  17.12   85.54  
1 1 1 -2  4   19 o 19 284.39  29.41  2399.00   473.27   2404.59  669.34   2393.40   669.26   279.78  43.05  279.07  43.17  0.71    60.97  
1 1 1 -2  4   20 o 13 311.53  32.44  2899.86   571.71   2951.22  808.52   2848.50   808.51   307.83  47.26  301.83  48.29  6.00    67.57  
1 1 1 -2  4   21 f 0  396.60  68.69  5410.18   1507.39  0.00     0.00     5410.18   1507.39  ?       ?      396.60  68.69  0.00    68.69  
1 1 1 -2  4   22 o 16 297.26  48.42  2860.38   797.91   0.00     0.00     2860.38   797.91   ?       ?      297.26  48.42  0.00    48.42  
1 1 1 -2  4   23 o 6  317.64  33.73  3070.04   605.65   3094.08  856.98   3046.04   856.05   309.02  50.02  306.28  50.44  2.74    71.03  
1 1 1 -2  4   24 o 18 171.08  18.24  862.22    176.39   852.96   250.34   871.34    248.57   167.70  26.91  169.71  26.37  -2.01   37.68  
1 1 1 -2  4   25 o 1  261.79  43.23  2236.15   627.05   2236.15  627.05   0.00      0.00     261.79  43.23  ?       ?      0.00    43.23  
1 1 1 -2  4   26 o 18 159.41  26.02  788.42    229.90   788.42   229.90   0.00      0.00     159.41  26.02  ?       ?      0.00    26.02  
1 1 1 -2  4   27 o 11 99.99   20.06  308.73    111.16   308.73   111.16   0.00      0.00     99.99   20.06  ?       ?      0.00    20.06  
1 1 1 -2  4   28 o 13 142.87  16.60  614.84    133.58   541.26   190.59   685.89    187.28   129.40  26.55  148.13  22.75  -18.73  34.96  
1 1 1 -2  4   29 f 0  98.82   14.35  295.36    79.05    249.85   116.96   333.63    107.26   87.85   22.94  103.44  18.75  -15.59  29.63  
1 1 1 -2  4   30 o 14 187.65  21.60  1115.60   228.45   1106.63  325.35   1124.33   320.84   176.22  33.38  178.56  32.50  -2.34   46.59  
1 1 1 -2  4   31 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  4   32 o 12 39.43   16.77  10.64     66.39    0.00     0.00     10.64     66.39    ?       ?      39.43   16.77  0.00    16.77  
1 1 1 -2  5   1  o 9  461.31  73.69  6770.04   1885.78  6770.04  1885.78  0.00      0.00     461.31  73.69  ?       ?      0.00    73.69  
1 1 1 -2  5   2  o 5  627.25  110.53 13769.44  3834.64  13769.44 3834.64  0.00      0.00     627.25  110.53 ?       ?      0.00    110.53 
1 1 1 -2  5   3  o 3  847.78  223.62 39639.77  11038.06 39639.77 11038.06 0.00      0.00     847.78  223.62 ?       ?      0.00    223.62 
1 1 1 -2  5   4  o 5  956.62  123.22 33530.93  6609.53  32718.34 9347.29  34343.51  9347.27  799.58  203.24 832.27  198.45 -32.68  284.05 
1 1 1 -2  5   5  o 8  725.66  83.02  17217.45  3396.21  16370.95 4802.96  18063.96  4802.98  649.66  133.26 694.09  125.14 -44.43  182.81 
1 1 1 -2  5   6  o 13 421.68  34.58  5260.81   829.76   5091.81  1437.30  5345.30   1016.20  400.60  64.70  421.91  42.54  -21.31  77.43  
1 1 1 -2  5   7  x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  5   8  o 9  315.68  24.94  2923.03   448.31   3123.10  776.70   2823.08   548.99   319.76  43.43  308.26  31.46  11.50   53.63  
1 1 1 -2  5   9  o 16 221.25  22.71  1440.88   284.40   1464.83  402.19   1416.93   402.21   220.24  32.81  216.33  33.47  3.91    46.87  
1 1 1 -2  5   10 o 14 122.38  8.81   433.28    61.49    317.97   105.65   492.37    75.62    103.10  18.53  130.34  10.19  -27.23  21.15  
1 1 1 -2  5   11 o 16 248.28  19.87  1808.93   280.87   1677.92  486.21   1874.55   344.08   232.63  37.70  251.49  24.13  -18.86  44.76  
1 1 1 -2  5   12 o 14 97.53   9.87   277.05    54.53    256.99   77.02    297.22    77.21    93.01   14.93  100.41  13.76  -7.40   20.30  
1 1 1 -2  5   13 o 16 71.38   7.44   148.24    30.05    149.79   42.37    146.67    42.63    71.26   10.69  70.46   10.89  0.80    15.26  
1 1 1 -2  5   14 o 1  169.52  17.34  846.04    166.40   825.67   235.25   866.43    235.39   165.06  25.66  169.39  24.95  -4.34   35.79  
1 1 1 -2  5   15 o 13 67.56   8.16   133.34    31.01    156.20   43.98    110.75    43.74    72.78   10.86  60.73   12.94  12.04   16.89  
1 1 1 -2  5   16 o 6  419.93  76.92  6412.52   1785.98  6412.52  1785.98  0.00      0.00     419.93  76.92  ?       ?      0.00    76.92  
1 1 1 -2  5   17 o 17 128.67  13.59  483.44    98.84    531.96   139.75   434.90    139.80   134.09  18.66  120.51  20.97  13.58   28.07  
1 1 1 -2  5   18 o 10 137.46  20.86  561.10    159.47   561.10   159.47   0.00      0.00     137.46  20.86  ?       ?      0.00    20.86  
1 1 1 -2  5   19 o 11 296.70  31.00  2621.21   520.16   2785.81  735.72   2456.71   735.51   300.81  43.90  280.65  47.34  20.16   64.56  
1 1 1 -2  5   20 o 16 281.55  29.39  2363.59   468.05   2481.14  662.17   2246.22   661.67   283.32  41.98  268.16  44.54  15.16   61.21  
1 1 1 -2  5   21 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  5   22 o 15 324.78  54.62  3521.08   982.23   0.00     0.00     3521.08   982.23   ?       ?      324.78  54.62  0.00    54.62  
1 1 1 -2  5   23 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  5   24 o 2  190.04  20.06  1069.00   215.51   1085.22  305.88   1053.01   303.69   188.44  29.22  185.45  29.51  2.98    41.53  
1 1 1 -2  5   25 o 19 132.07  14.88  514.76    110.85   532.83   158.75   497.56    154.85   132.50  21.61  127.86  21.88  4.64    30.76  
1 1 1 -2  5   26 o 2  209.11  22.48  1328.54   265.66   1327.80  377.85   1329.27   373.60   202.49  33.69  202.91  33.22  -0.42   47.31  
1 1 1 -2  5   27 o 10 137.95  24.18  597.00    184.51   597.00   184.51   0.00      0.00     137.95  24.18  ?       ?      0.00    24.18  
1 1 1 -2  5   28 o 13 79.35   20.90  199.37    96.52    199.37   96.52    0.00      0.00     79.35   20.90  ?       ?      0.00    20.90  
1 1 1 -2  5   29 o 14 45.41   15.64  57.39     49.37    27.01    79.76    76.27     62.85    45.71   18.83  51.64   17.65  -5.94   25.81  
1 1 1 -2  5   30 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  5   31 o 4  88.05   19.81  253.47    97.70    0.00     0.00     253.47    97.70    ?       ?      88.05   19.81  0.00    19.81  
1 1 1 -2  5   32 o 1  69.64   16.58  156.81    65.32    58.88    106.89   215.18    82.52    53.46   21.89  81.04   18.18  -27.59  28.46  
1 1 1 -2  6   1  o 2  175.30  17.87  896.64    177.32   945.49   251.19   848.13    250.34   178.69  25.18  168.73  26.74  9.96    36.73  
1 1 1 -2  6   2  o 6  223.24  22.76  1459.74   287.63   1524.61  407.05   1395.06   406.48   225.99  32.29  215.55  33.97  10.44   46.87  
1 1 1 -2  6   3  o 12 478.84  79.39  7560.13   2106.03  7560.13  2106.03  0.00      0.00     478.84  79.39  ?       ?      0.00    79.39  
1 1 1 -2  6   4  x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  6   5  f 0  254.19  38.68  1958.02   546.66   1958.02  546.66   0.00      0.00     254.19  38.68  ?       ?      0.00    38.68  
1 1 1 -2  6   6  o 10 355.22  56.38  3987.54   1111.34  3987.54  1111.34  0.00      0.00     355.22  56.38  ?       ?      0.00    56.38  
1 1 1 -2  6   7  o 2  421.23  70.53  5907.81   1645.34  0.00     0.00     5907.81   1645.34  ?       ?      421.23  70.53  0.00    70.53  
1 1 1 -2  6   8  o 5  180.88  18.82  959.92    192.60   0.00     0.00     959.92    192.60   ?       ?      180.88  18.82  0.00    18.82  
1 1 1 -2  6   9  o 10 325.47  33.91  3202.65   624.22   0.00     0.00     3202.65   624.22   ?       ?      325.47  33.91  0.00    33.91  
1 1 1 -2  6   10 o 15 185.69  13.90  1003.30   147.05   803.80   254.10   1103.75   180.31   162.47  28.27  194.33  16.31  -31.86  32.64  
1 1 1 -2  6   11 f 0  86.60   8.01   217.74    39.36    292.81   66.31    176.89    48.92    100.00  11.78  77.47   11.34  22.53   16.35  
1 1 1 -2  6   12 o 16 173.31  17.75  884.81    174.09   859.18   246.17   910.44    246.22   168.23  26.36  173.57  25.47  -5.34   36.65  
1 1 1 -2  6   13 o 10 104.38  10.58  317.70    62.50    294.44   88.31    341.06    88.47    99.41   16.02  107.43  14.73  -8.02   21.76  
1 1 1 -2  6   14 f 0  129.20  13.40  488.48    97.97    490.96   138.59   486.01    138.51   128.20  19.44  127.52  19.54  0.69    27.57  
1 1 1 -2  6   15 o 9  243.03  25.25  1761.28   347.17   1753.41  490.84   1769.15   491.10   237.50  37.22  238.66  37.04  -1.17   52.52  
1 1 1 -2  6   16 o 15 232.13  23.43  1593.94   307.96   1448.39  435.42   1739.63   435.64   216.77  36.27  239.49  32.53  -22.72  48.72  
1 1 1 -2  6   17 o 19 196.17  20.26  1129.99   224.89   1160.22  318.03   1099.77   318.05   196.55  29.06  190.99  30.00  5.56    41.76  
1 1 1 -2  6   18 o 3  210.15  21.88  1298.21   260.14   1377.44  368.04   1219.09   367.76   214.18  30.82  200.58  33.09  13.60   45.22  
1 1 1 -2  6   19 o 5  370.44  39.59  4169.19   828.81   4376.39  1172.14  3962.02   1172.08  369.24  57.14  348.68  60.76  20.56   83.41  
1 1 1 -2  6   20 o 19 228.41  23.69  1546.07   306.12   1548.08  432.84   1544.07   433.00   224.68  34.67  224.36  34.74  0.32    49.08  
1 1 1 -2  6   21 o 18 273.80  44.12  2398.35   669.97   0.00     0.00     2398.35   669.97   ?       ?      273.80  44.12  0.00    44.12  
1 1 1 -2  6   22 o 1  413.61  78.72  6461.95   1800.79  0.00     0.00     6461.95   1800.79  ?       ?      413.61  78.72  0.00    78.72  
1 1 1 -2  6   23 o 19 308.71  51.15  3131.33   874.83   0.00     0.00     3131.33   874.83   ?       ?      308.71  51.15  0.00    51.15  
1 1 1 -2  6   24 o 8  240.00  25.33  1733.88   343.75   1637.79  486.92   1829.36   485.37   226.40  38.86  241.08  36.19  -14.68  53.10  
1 1 1 -2  6   25 o 1  65.99   13.73  131.55    50.30    84.35    79.85    162.61    64.77    56.42   19.86  73.14   15.88  -16.71  25.43  
1 1 1 -2  6   26 o 6  76.17   13.71  174.74    57.74    196.84   92.01    160.39    74.16    79.61   20.12  72.14   17.97  7.47    26.98  
1 1 1 -2  6   27 o 9  78.54   21.55  194.08    100.10   194.08   100.10   0.00      0.00     78.54   21.55  ?       ?      0.00    21.55  
1 1 1 -2  6   28 f 0  56.60   20.83  83.65     89.01    83.65    89.01    0.00      0.00     56.60   20.83  ?       ?      0.00    20.83  
1 1 1 -2  6   29 o 1  149.12  27.29  748.07    225.04   748.07   225.04   0.00      0.00     149.12  27.29  ?       ?      0.00    27.29  
1 1 1 -2  6   30 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  6   31 o 18 112.99  15.12  396.51    95.63    348.01   149.40   430.17    124.48   98.85   25.99  115.02  19.55  -16.17  32.52  
1 1 1 -2  6   32 o 4  137.72  26.45  687.34    201.50   0.00     0.00     687.34    201.50   ?       ?      137.72  26.45  0.00    26.45  
1 1 1 -2  7   1  o 19 296.30  30.54  2607.04   511.98   2771.08  724.37   2443.28   723.74   300.80  43.19  280.74  46.54  20.06   63.49  
1 1 1 -2  7   2  x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  7   3  o 2  355.15  56.81  4015.30   1119.25  0.00     0.00     4015.30   1119.25  ?       ?      355.15  56.81  0.00    56.81  
1 1 1 -2  7   4  x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  7   5  o 10 255.51  20.75  1911.50   301.72   1970.02  523.31   1882.36   369.28   254.23  36.94  252.17  25.88  2.05    45.10  
1 1 1 -2  7   6  x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  7   7  o 4  263.53  27.28  2069.84   406.78   2084.50  575.91   2055.25   574.62   259.22  39.99  257.25  40.23  1.97    56.72  
1 1 1 -2  7   8  o 1  219.29  33.74  1474.32   411.13   0.00     0.00     1474.32   411.13   ?       ?      219.29  33.74  0.00    33.74  
1 1 1 -2  7   9  o 11 307.60  50.36  3081.61   858.55   0.00     0.00     3081.61   858.55   ?       ?      307.60  50.36  0.00    50.36  
1 1 1 -2  7   10 o 5  202.69  31.20  1259.99   351.45   0.00     0.00     1259.99   351.45   ?       ?      202.69  31.20  0.00    31.20  
1 1 1 -2  7   11 o 3  297.76  49.16  2910.95   811.04   0.00     0.00     2910.95   811.04   ?       ?      297.76  49.16  0.00    49.16  
1 1 1 -2  7   12 o 18 252.75  40.26  2025.78   564.62   0.00     0.00     2025.78   564.62   ?       ?      252.75  40.26  0.00    40.26  
1 1 1 -2  7   13 o 7  49.40   11.70  73.33     32.65    0.00     0.00     73.33     32.65    ?       ?      49.40   11.70  0.00    11.70  
1 1 1 -2  7   14 o 14 199.88  30.67  1219.42   340.73   0.00     0.00     1219.42   340.73   ?       ?      199.88  30.67  0.00    30.67  
1 1 1 -2  7   15 o 1  312.22  33.19  2946.19   585.72   3085.01  828.36   2807.40   828.31   311.61  47.83  295.31  50.68  16.30   69.69  
1 1 1 -2  7   16 o 14 82.19   14.00  200.47    63.67    0.00     0.00     200.47    63.67    ?       ?      82.19   14.00  0.00    14.00  
1 1 1 -2  7   17 f 0  334.11  53.09  3530.38   984.21   0.00     0.00     3530.38   984.21   ?       ?      334.11  53.09  0.00    53.09  
1 1 1 -2  7   18 o 6  313.45  49.46  3086.03   860.56   0.00     0.00     3086.03   860.56   ?       ?      313.45  49.46  0.00    49.46  
1 1 1 -2  7   19 o 11 159.56  24.36  762.83    216.12   0.00     0.00     762.83    216.12   ?       ?      159.56  24.36  0.00    24.36  
1 1 1 -2  7   20 o 14 365.85  64.02  4648.20   1295.63  0.00     0.00     4648.20   1295.63  ?       ?      365.85  64.02  0.00    64.02  
1 1 1 -2  7   21 o 6  171.63  26.57  894.58    253.36   0.00     0.00     894.58    253.36   ?       ?      171.63  26.57  0.00    26.57  
1 1 1 -2  7   22 o 2  256.07  40.89  2073.27   580.93   0.00     0.00     2073.27   580.93   ?       ?      256.07  40.89  0.00    40.89  
1 1 1 -2  7   23 o 9  29.02   13.09  -23.76    46.09    -39.90   67.37    -9.57     63.18    34.42   15.64  36.90   16.03  -2.48   22.40  
1 1 1 -2  7   24 o 3  140.88  15.71  586.87    124.88   611.82   177.39   562.37    175.82   141.80  22.55  135.53  23.45  6.28    32.53  
1 1 1 -2  7   25 o 2  155.78  16.96  724.22    149.25   704.27   211.90   743.86    210.25   150.15  25.49  154.88  24.46  -4.72   35.33  
1 1 1 -2  7   26 o 5  58.72   19.11  100.99    73.82    100.99   73.82    0.00      0.00     58.72   19.11  ?       ?      0.00    19.11  
1 1 1 -2  7   27 o 7  79.55   20.06  199.90    91.57    199.90   91.57    0.00      0.00     79.55   20.06  ?       ?      0.00    20.06  
1 1 1 -2  7   28 o 11 93.07   21.53  279.93    112.77   279.93   112.77   0.00      0.00     93.07   21.53  ?       ?      0.00    21.53  
1 1 1 -2  7   29 o 9  45.99   19.19  24.81     84.27    24.81    84.27    0.00      0.00     45.99   19.19  ?       ?      0.00    19.19  
1 1 1 -2  7   30 o 17 48.01   18.44  55.48     71.43    0.00     0.00     55.48     71.43    ?       ?      48.01   18.44  0.00    18.44  
1 1 1 -2  7   31 o 13 54.12   17.99  91.74     65.34    128.24   108.65   71.06     81.79    63.47   23.07  51.70   19.77  11.77   30.38  
1 1 1 -2  7   32 o 6  151.20  19.71  760.40    167.04   601.18   243.26   902.45    229.77   117.49  34.08  156.94  26.44  -39.45  43.14  
1 1 1 -2  8   1  o 14 53.55   11.19  85.76     33.30    116.23   57.71    70.54     40.78    62.18   16.06  48.81   13.89  13.38   21.23  
1 1 1 -2  8   2  o 19 159.68  16.75  747.30    151.29   712.58   216.10   780.66    211.87   153.87  25.35  161.69  23.51  -7.83   34.57  
1 1 1 -2  8   3  o 17 211.61  21.89  1321.93   262.03   1370.80  370.99   1273.29   370.16   212.58  31.34  204.27  32.67  8.31    45.27  
1 1 1 -2  8   4  x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  8   5  x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  8   6  o 18 247.39  38.94  1909.11   534.69   0.00     0.00     1909.11   534.69   ?       ?      247.39  38.94  0.00    38.94  
1 1 1 -2  8   7  x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  8   8  o 7  67.35   15.79  137.00    59.97    0.00     0.00     137.00    59.97    ?       ?      67.35   15.79  0.00    15.79  
1 1 1 -2  8   9  o 9  243.91  20.50  1755.58   284.43   1668.80  493.45   1798.76   348.08   230.03  38.74  245.28  25.07  -15.25  46.15  
1 1 1 -2  8   10 o 8  167.96  12.68  820.99    121.33   659.60   208.15   904.04    149.32   147.21  25.56  175.85  14.93  -28.64  29.60  
1 1 1 -2  8   11 o 18 157.59  16.17  729.56    144.20   726.77   203.84   732.35    204.03   155.33  23.60  155.96  23.52  -0.63   33.32  
1 1 1 -2  8   12 o 13 61.59   7.02   110.54    24.37    118.88   34.03    101.75    34.93    63.51   9.64   58.46   10.81  5.05    14.48  
1 1 1 -2  8   13 o 8  116.64  9.52   394.57    63.18    235.78   99.48    501.89    81.78    88.16   20.10  131.45  10.94  -43.28  22.89  
1 1 1 -2  8   14 o 15 302.98  31.58  2758.40   541.17   2667.80  765.34   2848.99   765.32   290.04  47.62  300.97  45.73  -10.93  66.02  
1 1 1 -2  8   15 o 2  145.67  14.97  619.69    123.43   577.15   175.76   661.09    173.37   138.94  22.83  149.38  20.78  -10.44  30.87  
1 1 1 -2  8   16 o 11 389.65  64.05  4962.58   1382.93  0.00     0.00     4962.58   1382.93  ?       ?      389.65  64.05  0.00    64.05  
1 1 1 -2  8   17 f 0  222.99  34.08  1507.97   422.38   0.00     0.00     1507.97   422.38   ?       ?      222.99  34.08  0.00    34.08  
1 1 1 -2  8   18 o 13 269.93  28.02  2172.69   427.83   2147.48  605.00   2197.90   605.08   262.73  41.49  266.12  40.92  -3.39   58.27  
1 1 1 -2  8   19 o 5  224.10  23.17  1492.16   293.77   1449.85  414.94   1534.69   415.98   216.54  34.54  223.38  33.47  -6.83   48.09  
1 1 1 -2  8   20 o 15 90.62   11.70  241.25    59.46    240.89   84.20    241.61    83.97    89.50   17.01  89.65   16.93  -0.15   24.00  
1 1 1 -2  8   21 o 11 123.94  13.76  450.43    96.27    416.62   137.02   483.40    135.29   117.49  21.09  127.28  19.11  -9.78   28.46  
1 1 1 -2  8   22 o 1  161.33  17.31  767.16    157.85   750.63   223.78   783.53    222.69   157.18  25.69  160.91  24.91  -3.73   35.78  
1 1 1 -2  8   23 o 1  62.14   13.24  116.35    45.78    96.79    69.47    131.36    60.87    57.92   18.51  65.78   16.22  -7.87   24.61  
1 1 1 -2  8   24 o 19 293.21  32.27  2728.54   534.22   2615.92  755.50   2841.14   755.49   269.54  50.69  283.99  48.05  -14.45  69.84  
1 1 1 -2  8   25 f 0  149.67  16.69  670.92    140.96   683.23   199.33   658.60    199.36   147.77  24.34  144.77  24.88  3.00    34.81  
1 1 1 -2  8   26 o 3  75.91   19.52  180.74    85.53    180.74   85.53    0.00      0.00     75.91   19.52  ?       ?      0.00    19.52  
1 1 1 -2  8   27 o 9  61.43   19.84  114.81    79.69    114.81   79.69    0.00      0.00     61.43   19.84  ?       ?      0.00    19.84  
1 1 1 -2  8   28 o 6  90.48   20.90  265.94    106.40   265.94   106.40   0.00      0.00     90.48   20.90  ?       ?      0.00    20.90  
1 1 1 -2  8   29 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  8   30 o 4  113.55  15.44  402.96    98.04    391.16   142.71   413.50    134.91   106.09  24.00  110.69  22.01  -4.61   32.56  
1 1 1 -2  8   31 o 7  96.23   16.09  297.27    85.77    335.55   126.46   264.67    116.72   97.32   23.00  86.06   23.13  11.26   32.62  
1 1 1 -2  9   1  o 2  220.49  22.92  1441.77   285.94   1529.02  406.04   1355.94   402.73   223.66  32.58  209.55  34.69  14.11   47.59  
1 1 1 -2  9   2  o 19 349.05  59.24  4103.41   1144.70  0.00     0.00     4103.41   1144.70  ?       ?      349.05  59.24  0.00    59.24  
1 1 1 -2  9   3  o 15 288.31  46.72  2668.83   746.75   2668.83  746.75   0.00      0.00     288.31  46.72  ?       ?      0.00    46.72  
1 1 1 -2  9   4  o 18 115.90  9.21   389.52    60.78    512.60   114.00   340.62    71.85    132.06  15.32  107.96  11.78  24.10   19.33  
1 1 1 -2  9   5  x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  9   6  o 6  167.71  14.95  822.29    142.44   685.16   247.57   890.15    174.16   148.91  30.00  173.94  17.69  -25.03  34.82  
1 1 1 -2  9   7  o 9  149.03  13.88  648.90    117.37   782.33   170.49   528.70    161.81   162.71  18.58  132.50  22.05  30.22   28.84  
1 1 1 -2  9   8  o 5  233.33  20.90  1608.43   277.01   1469.07  481.11   1677.54   338.80   214.88  40.49  236.80  25.31  -21.92  47.75  
1 1 1 -2  9   9  o 17 224.31  22.63  1493.52   287.44   0.00     0.00     1493.52   287.44   ?       ?      224.31  22.63  0.00    22.63  
1 1 1 -2  9   10 o 19 221.54  34.77  1516.16   427.71   0.00     0.00     1516.16   427.71   ?       ?      221.54  34.77  0.00    34.77  
1 1 1 -2  9   11 o 19 202.59  21.77  1214.68   249.26   1270.54  349.23   1156.68   355.89   204.34  30.72  193.91  33.16  10.43   45.20  
1 1 1 -2  9   12 o 19 326.84  32.12  3213.41   594.93   2890.26  834.84   3546.86   848.05   300.31  50.20  336.49  45.03  -36.19  67.43  
1 1 1 -2  9   13 o 15 135.99  20.90  550.38    157.97   550.38   157.97   0.00      0.00     135.99  20.90  ?       ?      0.00    20.90  
1 1 1 -2  9   14 o 10 253.00  27.76  1900.61   396.57   1992.66  549.68   1800.68   572.70   255.30  38.72  240.78  43.01  14.52   57.87  
1 1 1 -2  9   15 o 18 280.46  27.90  2330.36   443.18   2134.47  612.26   2545.96   642.33   263.23  41.92  288.86  39.79  -25.62  57.80  
1 1 1 -2  9   16 o 15 182.85  21.46  986.36    220.99   994.58   282.34   973.36    355.08   181.97  27.92  177.61  36.06  4.36    45.60  
1 1 1 -2  9   17 o 12 198.33  20.82  1159.90   233.56   1210.54  330.93   1109.64   329.68   200.02  29.72  190.87  31.16  9.16    43.06  
1 1 1 -2  9   18 o 11 170.86  18.44  860.94    178.01   939.18   252.49   783.61    251.01   176.46  25.68  160.05  28.36  16.41   38.26  
1 1 1 -2  9   19 o 15 137.08  15.92  553.70    122.94   642.24   176.26   469.81    171.56   146.30  21.64  123.83  25.00  22.48   33.06  
1 1 1 -2  9   20 o 19 334.40  35.74  3450.58   675.55   3348.88  955.37   3552.29   955.37   315.54  54.72  326.82  52.71  -11.28  75.98  
1 1 1 -2  9   21 o 17 212.99  22.45  1350.37   270.38   1328.75  381.68   1372.15   383.07   207.04  33.24  210.69  32.73  -3.64   46.65  
1 1 1 -2  9   22 o 14 236.52  38.43  1792.67   503.91   1792.67  503.91   0.00      0.00     236.52  38.43  ?       ?      0.00    38.43  
1 1 1 -2  9   23 o 16 191.40  31.16  1163.91   330.64   1163.91  330.64   0.00      0.00     191.40  31.16  ?       ?      0.00    31.16  
1 1 1 -2  9   24 o 6  190.18  31.84  1177.38   335.31   1177.38  335.31   0.00      0.00     190.18  31.84  ?       ?      0.00    31.84  
1 1 1 -2  9   25 o 17 96.04   19.34  286.92    102.95   286.92   102.95   0.00      0.00     96.04   19.34  ?       ?      0.00    19.34  
1 1 1 -2  9   26 o 13 122.83  22.28  480.74    151.29   480.74   151.29   0.00      0.00     122.83  22.28  ?       ?      0.00    22.28  
1 1 1 -2  9   27 o 14 54.72   19.21  85.53     74.70    85.53    74.70    0.00      0.00     54.72   19.21  ?       ?      0.00    19.21  
1 1 1 -2  9   28 o 15 84.63   20.76  235.62    100.07   235.62   100.07   0.00      0.00     84.63   20.76  ?       ?      0.00    20.76  
1 1 1 -2  9   29 o 10 44.70   18.93  19.91     84.02    0.00     0.00     19.91     84.02    ?       ?      44.70   18.93  0.00    18.93  
1 1 1 -2  9   30 o 13 96.87   15.74  298.92    84.55    308.23   121.21   290.10    118.00   93.63   22.77  90.81   22.70  2.82    32.15  
1 1 1 -2  9   31 o 10 99.16   16.11  318.24    88.58    290.73   128.02   343.52    122.71   88.36   24.42  98.30   22.26  -9.94   33.05  
1 1 1 -2  10  1  o 5  339.16  56.34  3786.03   1058.48  3786.03  1058.48  0.00      0.00     339.16  56.34  ?       ?      0.00    56.34  
1 1 1 -2  10  2  o 1  223.02  23.94  1477.05   301.68   1344.19  423.99   1613.27   429.34   208.00  36.86  229.70  33.55  -21.70  49.84  
1 1 1 -2  10  3  o 10 259.43  41.47  2111.91   596.82   0.00     0.00     2111.91   596.82   ?       ?      259.43  41.47  0.00    41.47  
1 1 1 -2  10  4  o 8  270.06  43.20  2302.41   647.14   2302.41  647.14   0.00      0.00     270.06  43.20  ?       ?      0.00    43.20  
1 1 1 -2  10  5  o 14 447.07  50.32  6412.98   1269.09  0.00     0.00     6412.98   1269.09  ?       ?      447.07  50.32  0.00    50.32  
1 1 1 -2  10  6  o 6  180.22  17.14  952.11    175.15   0.00     0.00     952.11    175.15   ?       ?      180.22  17.14  0.00    17.14  
1 1 1 -2  10  7  o 4  70.66   10.32  146.92    40.61    97.83    80.26    163.82    47.08    59.59   19.94  74.51   11.37  -14.92  22.96  
1 1 1 -2  10  8  o 18 245.02  38.09  1857.71   518.35   0.00     0.00     1857.71   518.35   ?       ?      245.02  38.09  0.00    38.09  
1 1 1 -2  10  9  o 14 142.22  13.06  589.11    105.47   792.01   159.78   432.44    140.40   164.34  17.19  120.06  21.14  44.28   27.25  
1 1 1 -2  10  10 o 12 249.76  25.89  1849.78   365.81   0.00     0.00     1849.78   365.81   ?       ?      249.76  25.89  0.00    25.89  
1 1 1 -2  10  11 o 8  411.54  36.69  5099.33   857.62   5521.21  1484.35  4887.92   1050.76  409.09  65.41  397.06  47.01  12.03   80.55  
1 1 1 -2  10  12 o 2  349.71  36.72  3683.62   726.28   3684.47  1027.21  3682.76   1027.02  340.72  54.34  340.64  54.34  0.08    76.85  
1 1 1 -2  10  13 o 19 518.73  46.20  8246.96   1361.25  8698.54  2354.63  8020.27   1668.30  497.81  85.47  501.74  59.05  -3.93   103.89 
1 1 1 -2  10  14 o 18 336.63  29.41  3360.70   562.59   3695.28  964.70   3188.27   692.55   343.06  50.49  324.42  37.90  18.64   63.14  
1 1 1 -2  10  15 o 6  253.71  21.49  1889.67   310.09   1877.39  519.97   1896.45   386.30   247.33  37.82  252.55  27.07  -5.22   46.51  
1 1 1 -2  10  16 o 15 427.73  48.82  5832.22   1177.40  6425.67  1665.23  5238.96   1664.97  428.20  70.17  376.07  79.61  52.12   106.12 
1 1 1 -2  10  17 o 6  72.29   12.61  155.50    50.43    114.95   77.49    185.28    66.41    62.77   19.48  78.58   15.27  -15.81  24.75  
1 1 1 -2  10  18 o 3  238.04  38.28  1787.26   505.35   1787.26  505.35   0.00      0.00     238.04  38.28  ?       ?      0.00    38.28  
1 1 1 -2  10  19 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  10  20 o 15 371.48  68.06  5005.06   1397.93  5005.06  1397.93  0.00      0.00     371.48  68.06  ?       ?      0.00    68.06  
1 1 1 -2  10  21 o 6  192.23  31.20  1152.73   332.50   1152.73  332.50   0.00      0.00     192.23  31.20  ?       ?      0.00    31.20  
1 1 1 -2  10  22 o 10 150.56  24.68  700.93    205.95   700.93   205.95   0.00      0.00     150.56  24.68  ?       ?      0.00    24.68  
1 1 1 -2  10  23 o 4  114.92  20.43  407.22    129.84   407.22   129.84   0.00      0.00     114.92  20.43  ?       ?      0.00    20.43  
1 1 1 -2  10  24 o 3  187.03  20.04  1068.44   211.80   1001.40  298.24   1136.66   300.83   174.13  30.97  187.24  28.92  -13.11  42.37  
1 1 1 -2  10  25 o 14 105.13  13.89  332.56    81.75    324.86   113.14   340.96    118.26   101.48  20.13  103.84  20.57  -2.36   28.78  
1 1 1 -2  10  26 o 13 159.57  18.13  788.70    163.13   774.30   228.78   803.59    232.69   151.49  27.31  154.45  27.24  -2.95   38.57  
1 1 1 -2  10  27 o 4  153.87  18.36  743.40    158.96   789.42   224.66   697.26    224.96   151.82  26.75  140.66  28.83  11.16   39.33  
1 1 1 -2  10  28 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  10  29 o 3  182.06  23.62  1145.00   241.08   1254.46  340.65   1035.17   341.23   173.92  35.33  151.03  39.07  22.88   52.67  
1 1 1 -2  10  30 o 13 127.82  16.93  530.73    121.16   487.15   167.97   578.00    174.92   113.42  26.31  125.22  25.21  -11.80  36.44  
1 1 1 -2  11  1  o 6  431.29  47.00  5732.47   1144.84  5345.21  1618.53  6120.23   1619.57  397.70  73.60  430.93  67.70  -33.24  100.00 
1 1 1 -2  11  2  o 6  260.27  41.08  2084.01   593.40   0.00     0.00     2084.01   593.40   ?       ?      260.27  41.08  0.00    41.08  
1 1 1 -2  11  3  o 16 239.22  37.54  1748.92   498.60   1748.92  498.60   0.00      0.00     239.22  37.54  ?       ?      0.00    37.54  
1 1 1 -2  11  4  x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  11  5  o 6  218.00  33.15  1438.21   401.77   0.00     0.00     1438.21   401.77   ?       ?      218.00  33.15  0.00    33.15  
1 1 1 -2  11  6  f 0  303.38  29.24  2732.18   502.92   0.00     0.00     2732.18   502.92   ?       ?      303.38  29.24  0.00    29.24  
1 1 1 -2  11  7  o 9  136.90  12.63  544.98    98.14    814.46   157.63   374.40    125.41   166.97  16.67  111.88  20.27  55.09   26.24  
1 1 1 -2  11  8  o 11 360.93  57.93  4160.96   1159.69  0.00     0.00     4160.96   1159.69  ?       ?      360.93  57.93  0.00    57.93  
1 1 1 -2  11  9  o 19 240.41  23.98  1700.92   326.48   1809.94  468.01   1597.58   455.67   245.10  34.19  229.51  35.75  15.59   49.47  
1 1 1 -2  11  10 o 8  172.70  17.33  871.47    169.49   976.59   251.83   784.43    229.17   181.35  24.84  162.05  25.47  19.30   35.58  
1 1 1 -2  11  11 f 0  87.12   15.08  225.41    72.70    0.00     0.00     225.41    72.70    ?       ?      87.12   15.08  0.00    15.08  
1 1 1 -2  11  12 o 9  257.77  23.19  1952.54   339.45   2259.39  578.97   1791.80   419.03   272.48  38.05  244.77  30.48  27.71   48.75  
1 1 1 -2  11  13 o 10 140.96  14.87  580.85    118.51   748.80   185.58   465.18    154.01   159.06  20.82  124.45  22.38  34.61   30.57  
1 1 1 -2  11  14 o 3  211.82  16.35  1309.38   197.28   997.08   317.52   1505.73   251.77   180.34  31.83  226.48  19.56  -46.14  37.36  
1 1 1 -2  11  15 o 7  291.68  22.51  2514.83   374.05   2043.94  625.42   2777.06   466.72   252.22  44.84  304.73  26.96  -52.51  52.32  
1 1 1 -2  11  16 o 13 195.05  19.02  1122.65   210.27   1197.62  327.36   1069.99   274.35   197.83  29.75  188.14  26.10  9.69    39.58  
1 1 1 -2  11  17 o 2  203.62  19.78  1224.81   228.30   1236.44  354.83   1216.59   298.22   200.23  31.94  200.71  26.53  -0.47   41.52  
1 1 1 -2  11  18 o 16 388.30  45.03  4818.86   985.11   5396.60  1394.00  4242.51   1392.33  392.17  64.13  336.47  74.09  55.70   97.99  
1 1 1 -2  11  19 o 13 134.91  12.51  531.39    95.77    433.63   148.32   601.28    125.41   119.42  22.46  142.96  15.53  -23.54  27.31  
1 1 1 -2  11  20 o 3  285.36  32.20  2536.38   518.26   2765.52  733.42   2307.86   732.44   287.14  46.05  257.40  51.37  29.75   68.99  
1 1 1 -2  11  21 o 7  106.63  13.75  337.36    82.24    286.43   116.95   387.18    115.66   96.00   21.73  113.01  18.47  -17.01  28.51  
1 1 1 -2  11  22 o 13 182.07  20.50  1008.51   210.54   1067.49  297.92   949.66    297.58   182.21  29.49  170.35  31.59  11.86   43.22  
1 1 1 -2  11  23 o 7  92.60   14.73  259.12    75.70    299.96   110.24   222.68    104.13   97.89   20.28  83.88   21.52  14.02   29.57  
1 1 1 -2  11  24 o 3  138.52  16.08  581.54    125.47   548.44   174.00   617.39    181.10   130.36  24.14  138.84  23.56  -8.47   33.73  
1 1 1 -2  11  25 f 0  169.99  19.31  902.95    185.14   895.27   260.13   910.84    263.56   161.46  29.14  162.75  29.29  -1.29   41.31  
1 1 1 -2  11  26 o 4  139.54  17.13  606.09    134.36   649.64   187.31   559.93    192.84   139.43  24.28  126.89  27.28  12.54   36.53  
1 1 1 -2  11  27 o 13 187.04  40.81  1502.64   425.83   1502.64  425.83   0.00      0.00     187.04  40.81  ?       ?      0.00    40.81  
1 1 1 -2  11  28 o 8  49.91   20.40  50.10     92.70    0.00     0.00     50.10     92.70    ?       ?      49.91   20.40  0.00    20.40  
1 1 1 -2  11  29 o 7  120.44  16.60  469.79    111.74   508.12   155.87   429.25    160.28   118.79  23.69  106.04  26.43  12.75   35.49  
1 1 1 -2  12  1  o 18 196.50  32.72  1161.87   356.13   0.00     0.00     1161.87   356.13   ?       ?      196.50  32.72  0.00    32.72  
1 1 1 -2  12  2  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  12  3  f 0  264.34  43.37  2137.75   635.41   2137.75  635.41   0.00      0.00     264.34  43.37  ?       ?      0.00    43.37  
1 1 1 -2  12  4  o 12 81.55   15.49  198.23    69.88    0.00     0.00     198.23    69.88    ?       ?      81.55   15.49  0.00    15.49  
1 1 1 -2  12  5  o 19 202.69  14.65  1191.37   169.34   1166.51  294.96   1203.60   206.81   198.26  26.59  203.23  17.91  -4.97   32.06  
1 1 1 -2  12  6  f 0  382.11  34.61  4346.31   750.94   0.00     0.00     4346.31   750.94   ?       ?      382.11  34.61  0.00    34.61  
1 1 1 -2  12  7  o 17 190.45  28.73  1085.11   304.36   0.00     0.00     1085.11   304.36   ?       ?      190.45  28.73  0.00    28.73  
1 1 1 -2  12  8  o 5  131.58  17.17  509.14    126.63   395.03   212.45   572.02    157.71   114.03  31.44  138.98  20.37  -24.95  37.47  
1 1 1 -2  12  9  o 14 266.51  33.17  2132.21   496.55   1616.64  709.28   2627.80   695.39   223.48  55.53  292.43  42.68  -68.95  70.04  
1 1 1 -2  12  10 o 15 218.99  28.62  1434.43   351.20   974.90   506.30   1860.60   487.57   174.91  48.66  247.53  35.31  -72.62  60.12  
1 1 1 -2  12  11 o 2  168.85  36.03  886.95    338.65   0.00     0.00     886.95    338.65   ?       ?      168.85  36.03  0.00    36.03  
1 1 1 -2  12  12 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  12  13 f 0  229.82  21.01  1559.88   274.10   1669.95  453.36   1496.46   344.12   232.35  35.08  222.86  27.48  9.49    44.56  
1 1 1 -2  12  14 o 7  210.18  19.77  1303.86   235.79   1417.15  374.74   1229.61   303.37   215.01  31.28  201.73  26.86  13.28   41.23  
1 1 1 -2  12  15 o 2  184.76  18.22  1005.25   190.72   1000.50  289.11   1008.91   253.76   181.02  28.78  183.18  24.77  -2.16   37.97  
1 1 1 -2  12  16 o 8  206.28  21.23  1260.83   247.85   1131.38  352.92   1386.80   348.15   190.98  33.41  213.65  29.15  -22.67  44.33  
1 1 1 -2  12  17 o 15 237.81  24.84  1692.46   334.13   1598.25  473.63   1785.80   471.43   225.11  38.00  239.59  35.33  -14.48  51.89  
1 1 1 -2  12  18 o 7  200.95  21.26  1204.20   241.50   1380.73  368.48   1071.28   319.74   211.00  31.37  185.52  31.12  25.48   44.19  
1 1 1 -2  12  19 o 15 172.32  18.45  885.13    179.65   825.61   254.35   944.38    253.78   162.45  28.30  175.02  26.05  -12.57  38.47  
1 1 1 -2  12  20 o 12 268.19  23.92  2200.60   364.48   2089.77  586.27   2270.42   465.33   245.44  43.19  267.12  30.92  -21.68  53.11  
1 1 1 -2  12  21 o 5  268.25  30.76  2322.29   465.10   2369.12  657.04   2275.25   658.45   253.99  46.79  247.22  48.13  6.77    67.12  
1 1 1 -2  12  22 o 9  183.93  32.25  1136.01   328.17   0.00     0.00     1136.01   328.17   ?       ?      183.93  32.25  0.00    32.25  
1 1 1 -2  12  23 o 17 65.65   16.38  134.46    61.51    128.62   82.24    141.89    92.66    64.44   20.08  67.52   21.35  -3.08   29.31  
1 1 1 -2  12  24 o 7  128.46  24.09  544.28    171.10   0.00     0.00     544.28    171.10   ?       ?      128.46  24.09  0.00    24.09  
1 1 1 -2  12  25 o 10 48.43   17.52  63.94     62.56    81.04    83.48    42.03     94.50    54.49   20.15  50.10   20.55  4.39    28.78  
1 1 1 -2  12  26 o 17 68.67   17.84  153.34    70.97    136.88   91.57    178.09    112.30   64.86   21.29  72.56   23.56  -7.70   31.76  
1 1 1 -2  12  27 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  12  28 o 10 56.17   17.57  104.08    62.89    126.96   79.94    66.90     101.90   61.18   19.88  52.62   21.44  8.55    29.24  
1 1 1 -2  13  1  o 3  553.56  49.91  9466.27   1569.16  9486.86  2726.26  9456.07   1918.86  508.75  96.88  542.48  62.77  -33.73  115.44 
1 1 1 -2  13  2  o 16 188.85  18.20  1042.50   194.84   1220.13  400.33   987.36    223.04   199.75  36.25  183.05  21.64  16.70   42.22  
1 1 1 -2  13  3  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  13  4  o 13 259.28  42.56  2077.67   611.55   0.00     0.00     2077.67   611.55   ?       ?      259.28  42.56  0.00    42.56  
1 1 1 -2  13  5  o 9  426.72  73.76  6209.07   1741.52  0.00     0.00     6209.07   1741.52  ?       ?      426.72  73.76  0.00    73.76  
1 1 1 -2  13  6  o 18 129.72  33.53  519.56    251.47   0.00     0.00     519.56    251.47   ?       ?      129.72  33.53  0.00    33.53  
1 1 1 -2  13  7  o 10 267.22  44.66  2241.82   660.92   0.00     0.00     2241.82   660.92   ?       ?      267.22  44.66  0.00    44.66  
1 1 1 -2  13  8  o 15 180.48  22.80  967.95    230.98   1368.69  488.92   852.82    262.07   208.04  42.38  167.72  28.22  40.32   50.92  
1 1 1 -2  13  9  o 10 375.79  34.79  4290.80   741.90   3298.69  1285.96  4785.76   908.31   300.25  74.87  393.04  40.85  -92.79  85.29  
1 1 1 -2  13  10 o 14 116.36  19.18  404.95    123.63   314.32   352.59   417.65    132.01   110.92  41.34  117.97  20.22  -7.05   46.02  
1 1 1 -2  13  11 o 7  473.85  49.77  7248.57   1333.73  0.00     0.00     7248.57   1333.73  ?       ?      473.85  49.77  0.00    49.77  
1 1 1 -2  13  12 o 3  188.98  29.85  1090.67   313.15   0.00     0.00     1090.67   313.15   ?       ?      188.98  29.85  0.00    29.85  
1 1 1 -2  13  13 f 0  325.88  54.64  3525.94   986.09   0.00     0.00     3525.94   986.09   ?       ?      325.88  54.64  0.00    54.64  
1 1 1 -2  13  14 o 13 332.46  56.40  3710.07   1037.91  0.00     0.00     3710.07   1037.91  ?       ?      332.46  56.40  0.00    56.40  
1 1 1 -2  13  15 o 3  104.79  21.01  333.24    121.99   0.00     0.00     333.24    121.99   ?       ?      104.79  21.01  0.00    21.01  
1 1 1 -2  13  16 o 8  200.91  32.10  1256.33   357.72   0.00     0.00     1256.33   357.72   ?       ?      200.91  32.10  0.00    32.10  
1 1 1 -2  13  17 o 10 111.11  21.06  377.42    129.43   0.00     0.00     377.42    129.43   ?       ?      111.11  21.06  0.00    21.06  
1 1 1 -2  13  18 o 11 228.62  22.18  1583.21   287.43   1711.02  440.74   1488.62   379.15   229.76  34.48  216.11  31.49  13.66   46.69  
1 1 1 -2  13  19 o 10 410.20  38.97  5687.43   906.75   5626.75  1542.13  5719.49   1121.00  331.08  81.66  391.54  51.09  -60.46  96.32  
1 1 1 -2  13  20 o 15 278.24  28.28  2472.62   445.38   2689.40  727.08   2342.42   563.47   265.11  49.60  259.65  39.01  5.46    63.10  
1 1 1 -2  13  21 o 10 225.67  22.70  1591.87   290.06   1650.83  451.69   1550.49   378.38   215.39  37.91  214.91  31.61  0.48    49.36  
1 1 1 -2  13  22 o 14 142.39  17.11  621.61    137.08   677.14   195.69   568.10    192.08   144.19  24.52  130.50  26.54  13.68   36.13  
1 1 1 -2  13  23 o 4  42.26   16.28  39.26     55.74    71.64    69.70    -18.16    92.83    51.20   18.49  42.70   18.96  8.50    26.49  
1 1 1 -2  13  24 o 16 157.46  31.04  903.73    270.55   0.00     0.00     903.73    270.55   ?       ?      157.46  31.04  0.00    31.04  
1 1 1 -2  13  25 o 10 50.75   16.86  78.51     57.40    82.70    76.77    73.21     86.44    53.48   19.40  52.96   20.30  0.53    28.08  
1 1 1 -2  13  26 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  13  27 o 14 55.14   22.86  72.90     118.52   0.00     0.00     72.90     118.52   ?       ?      55.14   22.86  0.00    22.86  
1 1 1 -2  14  1  o 6  242.34  26.17  1744.10   358.33   0.00     0.00     1744.10   358.33   ?       ?      242.34  26.17  0.00    26.17  
1 1 1 -2  14  2  o 7  318.38  59.01  3339.94   1038.88  3339.94  1038.88  0.00      0.00     318.38  59.01  ?       ?      0.00    59.01  
1 1 1 -2  14  3  o 2  203.70  23.13  1229.17   265.70   0.00     0.00     1229.17   265.70   ?       ?      203.70  23.13  0.00    23.13  
1 1 1 -2  14  4  o 4  382.81  30.26  4376.89   659.57   5408.07  1201.63  3932.23   789.07   411.10  52.08  358.15  39.01  52.95   65.07  
1 1 1 -2  14  5  o 5  333.78  30.78  3341.03   583.19   4085.35  1077.94  3033.00   693.45   354.36  54.75  313.70  39.37  40.66   67.44  
1 1 1 -2  14  6  o 2  365.37  32.81  4024.12   680.85   4343.30  1238.65  3885.93   815.03   359.10  62.35  354.48  40.79  4.62    74.51  
1 1 1 -2  14  7  o 13 186.98  26.66  1051.07   278.05   0.00     0.00     1051.07   278.05   ?       ?      186.98  26.66  0.00    26.66  
1 1 1 -2  14  8  o 4  155.05  22.27  717.34    192.53   0.00     0.00     717.34    192.53   ?       ?      155.05  22.27  0.00    22.27  
1 1 1 -2  14  9  o 14 105.16  43.06  165.09    413.79   0.00     0.00     165.09    413.79   ?       ?      105.16  43.06  0.00    43.06  
1 1 1 -2  14  10 o 19 78.24   38.44  -1107.17  597.69   0.00     0.00     -1107.17  597.69   ?       ?      78.24   38.44  0.00    38.44  
1 1 1 -2  14  11 o 15 521.04  137.75 14878.61  4182.19  0.00     0.00     14878.61  4182.19  ?       ?      521.04  137.75 0.00    137.75 
1 1 1 -2  14  12 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  14  13 o 1  191.50  18.91  1083.17   205.20   1108.96  316.43   1064.45   269.57   189.92  30.02  187.63  25.70  2.28    39.52  
1 1 1 -2  14  14 o 13 220.18  23.24  1455.37   289.36   1811.01  463.86   1228.81   370.23   239.93  34.68  197.34  33.90  42.59   48.50  
1 1 1 -2  14  15 o 1  171.58  17.85  875.10    173.27   909.14   259.51   847.72    232.75   171.18  27.33  166.10  25.20  5.08    37.17  
1 1 1 -2  14  16 o 15 89.59   13.81  239.70    68.76    256.05   98.59    224.23    95.94    91.21   19.42  85.15   19.97  6.06    27.86  
1 1 1 -2  14  17 o 6  304.10  26.99  2884.01   466.22   2778.09  762.98   2947.12   588.98   273.73  50.41  299.76  34.88  -26.03  61.30  
1 1 1 -2  14  18 o 2  118.15  14.68  417.28    97.43    402.96   134.60   433.03    141.20   113.67  21.41  117.83  21.67  -4.16   30.47  
1 1 1 -2  14  19 o 17 130.03  24.30  540.55    174.70   0.00     0.00     540.55    174.70   ?       ?      130.03  24.30  0.00    24.30  
1 1 1 -2  14  20 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  14  21 o 15 100.95  22.85  334.69    129.30   0.00     0.00     334.69    129.30   ?       ?      100.95  22.85  0.00    22.85  
1 1 1 -2  14  22 o 17 97.22   21.97  312.15    119.71   0.00     0.00     312.15    119.71   ?       ?      97.22   21.97  0.00    21.97  
1 1 1 -2  14  23 o 9  125.13  26.39  547.84    183.60   0.00     0.00     547.84    183.60   ?       ?      125.13  26.39  0.00    26.39  
1 1 1 -2  14  24 o 6  63.51   23.09  127.12    108.86   0.00     0.00     127.12    108.86   ?       ?      63.51   23.09  0.00    23.09  
1 1 1 -2  14  25 o 2  80.50   24.81  238.07    125.94   0.00     0.00     238.07    125.94   ?       ?      80.50   24.81  0.00    24.81  
1 1 1 -2  14  26 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  15  1  o 16 70.08   33.14  -381.39   352.31   0.00     0.00     -381.39   352.31   ?       ?      70.08   33.14  0.00    33.14  
1 1 1 -2  15  2  x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  15  3  o 1  308.96  48.33  3020.45   829.13   0.00     0.00     3020.45   829.13   ?       ?      308.96  48.33  0.00    48.33  
1 1 1 -2  15  4  o 4  194.82  39.40  1187.31   425.51   0.00     0.00     1187.31   425.51   ?       ?      194.82  39.40  0.00    39.40  
1 1 1 -2  15  5  o 19 48.23   20.95  -15.34    107.80   0.00     0.00     -15.34    107.80   ?       ?      48.23   20.95  0.00    20.95  
1 1 1 -2  15  6  o 19 136.91  24.23  566.02    183.47   0.00     0.00     566.02    183.47   ?       ?      136.91  24.23  0.00    24.23  
1 1 1 -2  15  7  o 16 63.73   21.11  113.47    89.93    -1137.33 815.55   128.87    90.48    97.12   47.09  66.77   21.10  30.35   51.60  
1 1 1 -2  15  8  o 11 154.00  22.86  711.36    195.96   0.00     0.00     711.36    195.96   ?       ?      154.00  22.86  0.00    22.86  
1 1 1 -2  15  9  o 2  113.22  20.55  387.04    128.64   594.64   643.44   378.39    131.29   144.91  55.43  111.76  21.24  33.15   59.36  
1 1 1 -2  15  10 o 14 184.22  25.83  1029.64   265.67   0.00     0.00     1029.64   265.67   ?       ?      184.22  25.83  0.00    25.83  
1 1 1 -2  15  11 o 18 169.39  22.53  865.02    213.63   534.81   558.04   921.72    231.24   134.97  51.62  174.51  23.69  -39.54  56.80  
1 1 1 -2  15  12 o 7  236.66  39.76  1836.08   521.01   0.00     0.00     1836.08   521.01   ?       ?      236.66  39.76  0.00    39.76  
1 1 1 -2  15  13 o 8  176.27  29.60  981.09    288.89   0.00     0.00     981.09    288.89   ?       ?      176.27  29.60  0.00    29.60  
1 1 1 -2  15  14 o 10 167.47  27.67  883.92    256.73   1103.19  301.73   308.85    488.64   186.64  29.11  113.00  46.59  73.64   54.93  
1 1 1 -2  15  15 o 4  108.77  18.99  362.23    114.29   341.87   118.96   606.45    412.06   105.12  20.45  130.77  45.17  -25.65  49.58  
1 1 1 -2  15  16 o 9  57.26   18.38  96.70     68.47    92.41    69.40    252.72    418.37   56.40   18.54  102.84  42.82  -46.45  46.66  
1 1 1 -2  15  17 o 19 132.52  21.95  550.76    161.11   579.73   172.05   344.35    459.19   135.53  22.93  108.31  44.95  27.22   50.46  
1 1 1 -2  15  18 o 18 177.62  31.35  1074.79   307.94   1074.79  307.94   0.00      0.00     177.62  31.35  ?       ?      0.00    31.35  
1 1 1 -2  15  19 o 4  107.11  20.82  367.27    123.41   367.27   123.41   0.00      0.00     107.11  20.82  ?       ?      0.00    20.82  
1 1 1 -2  15  20 o 4  82.50   20.03  220.77    93.93    219.88   94.71    274.43    734.06   82.27   20.20  103.20  48.51  -20.93  52.54  
1 1 1 -2  15  21 o 1  107.44  16.02  359.44    95.80    373.88   122.81   336.98    153.14   106.96  20.75  97.86   26.58  9.11    33.72  
1 1 1 -2  15  22 o 4  66.54   17.61  143.73    68.30    150.06   82.59    130.02    121.47   67.45   19.94  65.15   24.27  2.30    31.41  
1 1 1 -2  15  23 o 8  59.24   18.00  114.44    66.63    52.51    79.38    262.15    122.60   48.17   19.16  85.71   23.98  -37.54  30.70  
1 1 1 -2  15  24 o 7  78.65   18.81  209.74    83.75    246.73   100.10   123.41    152.93   84.08   20.84  64.12   26.21  19.96   33.49  
1 1 1 -2  15  25 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  16  1  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  16  2  o 11 184.87  29.68  1052.59   304.31   0.00     0.00     1052.59   304.31   ?       ?      184.87  29.68  0.00    29.68  
1 1 1 -2  16  3  o 11 226.99  28.50  1570.38   363.21   1961.37  733.92   1443.56   417.98   237.39  54.94  214.33  35.19  23.06   65.25  
1 1 1 -2  16  4  o 7  170.50  26.57  888.17    251.62   361.13   665.78   976.00    271.78   131.25  54.27  178.57  27.38  -47.32  60.79  
1 1 1 -2  16  5  o 7  222.05  30.85  1524.30   382.67   1374.20  763.47   1574.67   442.24   193.10  61.31  223.17  35.72  -30.07  70.96  
1 1 1 -2  16  6  f 0  209.63  27.53  1344.84   323.30   0.00     0.00     1344.84   323.30   ?       ?      209.63  27.53  0.00    27.53  
1 1 1 -2  16  7  o 7  49.49   18.59  54.55     71.54    0.00     0.00     54.55     71.54    ?       ?      49.49   18.59  0.00    18.59  
1 1 1 -2  16  8  f 0  172.97  23.03  907.65    222.98   508.98   801.78   941.07    232.14   140.57  58.95  175.95  23.58  -35.38  63.49  
1 1 1 -2  16  9  o 18 116.78  19.94  414.58    128.89   -319.50  611.99   448.65    131.85   96.46   45.00  121.72  19.53  -25.25  49.05  
1 1 1 -2  16  10 o 15 100.20  22.00  311.39    123.06   0.00     0.00     311.39    123.06   ?       ?      100.20  22.00  0.00    22.00  
1 1 1 -2  16  11 o 12 236.38  34.57  1814.55   455.22   1390.93  780.58   2032.89   560.39   182.20  62.20  244.62  41.38  -62.42  74.70  
1 1 1 -2  16  12 o 19 150.57  26.10  713.91    217.45   0.00     0.00     713.91    217.45   ?       ?      150.57  26.10  0.00    26.10  
1 1 1 -2  16  13 o 5  121.47  23.85  465.25    160.34   0.00     0.00     465.25    160.34   ?       ?      121.47  23.85  0.00    23.85  
1 1 1 -2  16  14 f 0  219.74  31.61  1591.99   387.31   0.00     0.00     1591.99   387.31   ?       ?      219.74  31.61  0.00    31.61  
1 1 1 -2  16  15 o 13 137.28  24.18  602.51    183.59   705.27   198.25   -16.01    486.39   148.85  24.02  91.17   41.66  57.68   48.08  
1 1 1 -2  16  16 o 1  147.69  24.83  707.01    203.05   0.00     0.00     707.01    203.05   ?       ?      147.69  24.83  0.00    24.83  
1 1 1 -2  16  17 o 11 61.97   17.09  120.41    62.75    135.84   72.95    76.51     123.05   65.58   18.55  59.75   23.83  5.83    30.20  
1 1 1 -2  16  18 o 16 88.68   16.15  245.03    79.18    270.76   95.58    188.74    141.37   92.21   18.70  76.35   26.45  15.86   32.39  
1 1 1 -2  16  19 o 11 38.87   15.87  21.80     56.07    0.69     61.97    117.00    131.60   37.05   15.99  65.03   25.02  -27.98  29.69  
1 1 1 -2  16  20 o 8  49.07   17.47  68.52     61.92    99.95    69.05    -60.52    139.90   56.56   18.48  47.94   22.07  8.62    28.78  
1 1 1 -2  16  21 o 1  75.79   17.45  187.37    74.33    187.05   85.99    188.32    147.84   74.69   19.75  73.74   26.89  0.95    33.37  
1 1 1 -2  16  22 o 16 92.30   20.64  292.34    106.60   289.98   107.29   472.29    936.41   91.77   20.84  90.19   44.97  1.57    49.56  
1 1 1 -2  16  23 o 7  63.22   20.15  137.87    82.39    133.97   82.66    743.59    1029.67  62.43   20.21  88.03   44.34  -25.61  48.73  
1 1 1 -2  17  1  x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  17  2  x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  17  3  o 16 273.53  29.40  2321.81   454.48   1847.78  935.42   2468.29   519.98   209.51  68.00  279.44  33.05  -69.93  75.61  
1 1 1 -2  17  4  o 11 314.38  29.56  3069.85   527.23   3234.11  1047.92  3014.18   610.06   284.24  65.56  306.70  35.29  -22.46  74.45  
1 1 1 -2  17  5  o 12 151.56  21.56  698.55    182.29   725.41   742.03   696.83    188.06   146.39  58.47  151.06  22.36  -4.68   62.60  
1 1 1 -2  17  6  o 11 165.80  27.22  861.21    250.10   0.00     0.00     861.21    250.10   ?       ?      165.80  27.22  0.00    27.22  
1 1 1 -2  17  7  o 9  191.49  28.37  1155.35   302.45   1594.64  888.37   1097.76   321.66   189.26  66.27  184.76  31.45  4.50    73.35  
1 1 1 -2  17  8  o 7  133.82  23.25  556.58    172.14   0.00     0.00     556.58    172.14   ?       ?      133.82  23.25  0.00    23.25  
1 1 1 -2  17  9  o 10 236.00  34.52  1840.85   453.84   1663.64  854.16   1910.56   535.72   188.91  65.04  234.13  41.37  -45.22  77.09  
1 1 1 -2  17  10 f 0  246.25  46.22  2234.76   629.35   0.00     0.00     2234.76   629.35   ?       ?      246.25  46.22  0.00    46.22  
1 1 1 -2  17  11 o 15 116.43  22.39  427.51    144.20   514.16   618.79   422.54    148.28   123.18  51.73  115.38  23.19  7.80    56.69  
1 1 1 -2  17  12 o 10 127.43  22.74  514.58    160.23   0.00     0.00     514.58    160.23   ?       ?      127.43  22.74  0.00    22.74  
1 1 1 -2  17  13 o 2  56.86   21.63  78.00     97.68    0.00     0.00     78.00     97.68    ?       ?      56.86   21.63  0.00    21.63  
1 1 1 -2  17  14 o 7  113.41  24.10  420.79    152.09   0.00     0.00     420.79    152.09   ?       ?      113.41  24.10  0.00    24.10  
1 1 1 -2  17  15 o 12 124.97  24.68  516.06    170.77   0.00     0.00     516.06    170.77   ?       ?      124.97  24.68  0.00    24.68  
1 1 1 -2  17  16 o 10 56.59   16.81  99.80     58.58    96.39    68.48    109.10    113.13   56.28   18.41  62.62   23.40  -6.34   29.77  
1 1 1 -2  17  17 o 15 85.09   25.83  250.12    137.19   0.00     0.00     250.12    137.19   ?       ?      85.09   25.83  0.00    25.83  
1 1 1 -2  17  18 o 15 51.58   17.33  80.39     60.55    106.47   67.36    -29.39    138.20   57.96   18.19  50.04   22.60  7.92    29.01  
1 1 1 -2  17  19 f 0  74.50   16.59  179.18    69.12    156.36   78.70    256.17    144.55   68.60   19.22  83.76   26.69  -15.16  32.89  
1 1 1 -2  17  20 o 13 46.90   17.13  62.33     60.01    61.96    65.87    64.12     145.60   47.60   17.84  58.06   24.77  -10.46  30.53  
1 1 1 -2  17  21 f 0  73.42   28.31  202.67    168.79   0.00     0.00     202.67    168.79   ?       ?      73.42   28.31  0.00    28.31  
1 1 1 -2  18  1  o 2  127.82  19.48  498.37    138.45   0.00     0.00     498.37    138.45   ?       ?      127.82  19.48  0.00    19.48  
1 1 1 -2  18  2  o 9  107.24  19.28  353.28    114.36   161.68   729.65   358.11    115.79   116.30  52.28  107.95  19.40  8.35    55.77  
1 1 1 -2  18  3  o 6  102.20  18.63  320.55    105.27   0.00     0.00     320.55    105.27   ?       ?      102.20  18.63  0.00    18.63  
1 1 1 -2  18  4  o 9  121.14  44.21  508.10    399.73   0.00     0.00     508.10    399.73   ?       ?      121.14  44.21  0.00    44.21  
1 1 1 -2  18  5  f 0  169.66  47.62  1106.82   482.69   0.00     0.00     1106.82   482.69   ?       ?      169.66  47.62  0.00    47.62  
1 1 1 -2  18  6  o 8  178.06  50.54  1272.04   540.51   0.00     0.00     1272.04   540.51   ?       ?      178.06  50.54  0.00    50.54  
1 1 1 -2  18  7  o 1  198.91  56.29  1716.31   671.45   0.00     0.00     1716.31   671.45   ?       ?      198.91  56.29  0.00    56.29  
1 1 1 -2  18  8  o 5  184.57  26.17  1091.66   269.55   0.00     0.00     1091.66   269.55   ?       ?      184.57  26.17  0.00    26.17  
1 1 1 -2  18  9  o 5  160.08  24.10  815.73    214.65   431.65   780.94   847.12    223.25   119.75  53.94  162.83  24.65  -43.07  59.31  
1 1 1 -2  18  10 o 7  120.46  22.34  462.70    148.77   -619.47  822.38   499.32    151.27   93.28   45.67  125.53  21.78  -32.26  50.60  
1 1 1 -2  18  11 o 19 157.74  27.46  826.92    239.61   459.42   803.66   862.77    251.03   116.55  53.36  160.56  28.27  -44.01  60.39  
1 1 1 -2  18  12 o 12 148.87  27.74  747.21    228.32   0.00     0.00     747.21    228.32   ?       ?      148.87  27.74  0.00    27.74  
1 1 1 -2  18  13 o 8  104.43  24.32  364.44    143.04   0.00     0.00     364.44    143.04   ?       ?      104.43  24.32  0.00    24.32  
1 1 1 -2  18  14 o 19 49.65   20.82  30.04     99.93    0.00     0.00     30.04     99.93    ?       ?      49.65   20.82  0.00    20.82  
1 1 1 -2  18  15 o 10 113.96  26.28  453.19    168.39   0.00     0.00     453.19    168.39   ?       ?      113.96  26.28  0.00    26.28  
1 1 1 -2  18  16 o 3  64.21   24.37  122.23    123.69   0.00     0.00     122.23    123.69   ?       ?      64.21   24.37  0.00    24.37  
1 1 1 -2  18  17 o 17 96.15   26.65  340.78    152.17   0.00     0.00     340.78    152.17   ?       ?      96.15   26.65  0.00    26.65  
1 1 1 -2  18  18 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  19  1  o 14 90.46   17.75  253.01    88.89    241.36   868.91   253.13    89.36    118.69  54.76  90.45   17.84  28.24   57.59  
1 1 1 -2  19  2  o 13 237.88  28.19  1830.22   377.44   2167.89  1039.49  1778.93   405.09   190.27  70.97  231.63  31.26  -41.36  77.55  
1 1 1 -2  19  3  f 0  165.93  24.47  875.00    226.10   847.11   977.28   876.58    232.40   137.00  61.13  165.58  25.25  -28.59  66.14  
1 1 1 -2  19  4  o 8  115.54  20.28  417.51    129.59   906.49   997.35   409.12    130.70   137.37  61.49  114.15  20.71  23.22   64.88  
1 1 1 -2  19  5  o 4  173.31  24.11  956.74    233.40   0.00     0.00     956.74    233.40   ?       ?      173.31  24.11  0.00    24.11  
1 1 1 -2  19  6  o 13 271.28  35.22  2578.77   535.58   0.00     0.00     2578.77   535.58   ?       ?      271.28  35.22  0.00    35.22  
1 1 1 -2  19  7  o 14 82.76   20.60  219.43    97.45    0.00     0.00     219.43    97.45    ?       ?      82.76   20.60  0.00    20.60  
1 1 1 -2  19  8  o 11 100.12  21.47  322.96    119.67   0.00     0.00     322.96    119.67   ?       ?      100.12  21.47  0.00    21.47  
1 1 1 -2  19  9  o 1  85.99   41.37  -264.12   600.16   0.00     0.00     -264.12   600.16   ?       ?      85.99   41.37  0.00    41.37  
1 1 1 -2  19  10 o 11 108.54  48.70  465.35    629.65   0.00     0.00     465.35    629.65   ?       ?      108.54  48.70  0.00    48.70  
1 1 1 -2  19  11 o 6  93.05   44.34  36.35     654.43   0.00     0.00     36.35     654.43   ?       ?      93.05   44.34  0.00    44.34  
1 1 1 -2  19  12 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -2  19  13 o 7  81.10   24.25  227.97    121.60   0.00     0.00     227.97    121.60   ?       ?      81.10   24.25  0.00    24.25  
1 1 1 -2  19  14 o 9  83.31   24.37  244.70    123.89   0.00     0.00     244.70    123.89   ?       ?      83.31   24.37  0.00    24.37  
1 1 1 -2  19  15 o 17 65.49   24.18  138.15    120.16   0.00     0.00     138.15    120.16   ?       ?      65.49   24.18  0.00    24.18  
1 1 1 -2  20  1  o 1  141.01  24.57  646.64    191.68   280.67   1179.31  656.58    194.26   117.55  56.90  142.01  24.73  -24.45  62.04  
1 1 1 -2  20  2  o 6  159.52  23.40  818.28    207.95   -15.05   1135.95  847.18    211.53   110.67  54.08  162.38  23.36  -51.71  58.91  
1 1 1 -2  20  3  o 2  42.26   17.49  20.87     69.20    1119.49  1189.47  17.14     69.32    130.45  61.45  41.71   17.40  88.74   63.87  
1 1 1 -2  20  4  o 12 161.31  25.09  855.80    224.76   0.00     0.00     855.80    224.76   ?       ?      161.31  25.09  0.00    25.09  
1 1 1 -2  20  5  o 7  193.19  28.14  1266.66   302.90   1322.59  1448.03  1264.10   309.75   127.00  61.84  192.13  28.98  -65.12  68.30  
1 1 1 -2  20  6  o 9  160.10  25.16  852.26    223.60   -674.81  1219.76  905.35    227.45   98.52   49.44  165.47  24.70  -66.95  55.27  
1 1 1 -2  20  7  f 0  93.09   21.11  283.90    110.20   0.00     0.00     283.90    110.20   ?       ?      93.09   21.11  0.00    21.11  
1 1 1 -2  20  8  o 8  169.91  27.65  998.15    260.43   126.44   1201.13  1041.16   266.78   103.81  51.62  173.51  27.71  -69.70  58.59  
1 1 1 -2  20  9  o 18 185.35  29.64  1223.91   304.75   1260.90  1240.91  1221.53   314.38   117.23  57.12  183.65  30.92  -66.43  64.95  
1 1 1 -1  -19 1  o 9  45.46   18.65  25.24     77.74    22.81    77.90    633.35    1230.99  45.14   18.60  140.69  65.00  -95.55  67.61  
1 1 1 -1  -19 2  o 3  200.71  34.82  1353.64   386.68   1353.64  386.68   0.00      0.00     200.71  34.82  ?       ?      0.00    34.82  
1 1 1 -1  -19 3  o 15 167.56  27.76  900.77    257.71   844.55   262.17   2512.38   1403.70  161.12  29.43  193.13  79.22  -32.01  84.51  
1 1 1 -1  -19 4  o 8  156.78  26.77  785.80    232.28   785.80   232.28   0.00      0.00     156.78  26.77  ?       ?      0.00    26.77  
1 1 1 -1  -19 5  o 2  113.37  20.81  399.86    130.45   399.86   130.45   0.00      0.00     113.37  20.81  ?       ?      0.00    20.81  
1 1 1 -1  -19 6  o 19 272.39  32.53  2441.19   498.68   2441.19  498.68   0.00      0.00     272.39  32.53  ?       ?      0.00    32.53  
1 1 1 -1  -18 1  o 5  82.57   20.78  211.60    98.39    209.14   98.89    452.35    977.16   82.08   20.93  138.85  61.59  -56.77  65.05  
1 1 1 -1  -18 2  o 15 148.29  25.05  684.44    205.65   684.44   205.65   0.00      0.00     148.29  25.05  ?       ?      0.00    25.05  
1 1 1 -1  -18 3  o 18 256.25  28.90  2056.82   417.69   1981.76  445.18   2608.88   1207.32  249.34  31.83  227.80  77.36  21.54   83.65  
1 1 1 -1  -18 4  o 7  57.81   19.81  92.66     79.19    82.35    79.40    2045.34   1092.63  55.83   19.79  205.39  73.34  -149.56 75.97  
1 1 1 -1  -18 5  o 11 151.41  22.62  703.97    190.59   692.78   193.33   1090.23   1135.98  149.93  23.21  162.60  69.27  -12.67  73.05  
1 1 1 -1  -18 6  o 15 223.95  33.32  1623.26   415.30   1566.74  447.09   1978.78   1121.33  217.04  37.22  199.07  73.81  17.97   82.67  
1 1 1 -1  -18 7  o 19 49.41   18.24  58.67     68.30    60.07    68.46    -242.42   1005.87  49.72   18.27  119.20  56.26  -69.49  59.15  
1 1 1 -1  -18 8  o 1  136.51  22.84  577.64    172.66   591.40   175.06   85.19     1047.41  138.14  22.87  127.69  59.33  10.45   63.59  
1 1 1 -1  -18 9  o 7  79.27   18.88  194.75    84.66    194.56   84.97    220.28    989.93   79.22   18.94  128.18  58.88  -48.96  61.86  
1 1 1 -1  -18 10 o 14 108.16  19.08  358.94    114.15   364.76   114.84   -123.08   1044.74  109.07  19.03  121.00  57.18  -11.93  60.26  
1 1 1 -1  -17 1  o 11 241.89  29.17  1800.85   396.84   1800.85  396.84   0.00      0.00     241.89  29.17  ?       ?      0.00    29.17  
1 1 1 -1  -17 2  o 19 388.80  30.60  4653.08   677.47   4309.09  771.89   5806.71   1413.58  368.47  36.99  393.24  64.88  -24.77  74.68  
1 1 1 -1  -17 3  o 10 175.69  26.05  946.93    254.78   946.93   254.78   0.00      0.00     175.69  26.05  ?       ?      0.00    26.05  
1 1 1 -1  -17 4  o 17 220.82  27.97  1501.42   346.62   1501.42  346.62   0.00      0.00     220.82  27.97  ?       ?      0.00    27.97  
1 1 1 -1  -17 5  o 5  301.11  31.59  2828.75   537.94   2828.75  537.94   0.00      0.00     301.11  31.59  ?       ?      0.00    31.59  
1 1 1 -1  -17 6  o 2  358.34  25.29  3891.24   516.99   4168.01  585.13   2906.19   1103.88  368.89  27.84  263.12  71.31  105.77  76.55  
1 1 1 -1  -17 7  o 3  169.29  20.24  860.99    192.78   798.54   197.96   2009.27   848.82   162.38  21.79  225.00  63.15  -62.62  66.80  
1 1 1 -1  -17 8  o 7  104.01  18.84  328.87    108.37   324.07   109.38   583.94    797.37   103.14  19.18  142.00  59.11  -38.86  62.15  
1 1 1 -1  -17 9  o 11 184.00  22.92  1029.96   236.86   1031.69  246.09   1008.15   873.03   183.72  23.90  162.42  63.89  21.30   68.21  
1 1 1 -1  -17 10 o 15 166.97  25.66  864.33    238.11   848.27   247.60   1062.02   868.73   164.69  27.13  163.84  63.94  0.85    69.46  
1 1 1 -1  -17 11 o 14 162.93  25.34  824.69    229.29   803.60   236.51   1154.59   935.41   160.16  26.66  166.19  65.89  -6.02   71.08  
1 1 1 -1  -17 12 o 1  138.65  22.72  593.99    174.60   562.10   177.89   1433.03   912.47   134.29  23.95  177.89  66.46  -43.60  70.65  
1 1 1 -1  -17 13 o 2  35.62   15.85  -21.94    65.21    -21.90   65.37    -31.33    925.50   35.68   15.87  119.98  55.76  -84.30  57.97  
1 1 1 -1  -16 1  o 12 176.58  52.01  1050.14   562.72   1050.14  562.72   0.00      0.00     176.58  52.01  ?       ?      0.00    52.01  
1 1 1 -1  -16 2  o 13 110.68  45.49  202.93    464.04   202.93   464.04   0.00      0.00     110.68  45.49  ?       ?      0.00    45.49  
1 1 1 -1  -16 3  o 2  112.02  44.32  273.11    422.37   273.11   422.37   0.00      0.00     112.02  44.32  ?       ?      0.00    44.32  
1 1 1 -1  -16 4  f 0  104.55  19.25  329.51    111.27   329.51   111.27   0.00      0.00     104.55  19.25  ?       ?      0.00    19.25  
1 1 1 -1  -16 5  o 16 191.71  24.99  1107.57   268.45   1161.42  286.72   725.09    764.15   195.96  26.14  155.88  60.21  40.07   65.64  
1 1 1 -1  -16 6  o 16 86.34   20.15  227.47    98.02    210.26   99.01    1072.70   693.93   82.96   20.82  175.48  58.65  -92.52  62.23  
1 1 1 -1  -16 7  f 0  256.66  18.39  1939.31   269.13   2233.01  295.32   500.23    653.70   275.35  18.80  138.00  54.96  137.35  58.09  
1 1 1 -1  -16 8  o 8  47.74   17.76  51.85     65.06    50.28    65.35    228.28    692.55   47.49   17.78  125.61  53.81  -78.12  56.67  
1 1 1 -1  -16 9  o 8  299.76  28.30  2744.53   481.19   2421.47  544.16   3902.99   1030.46  277.12  34.98  331.94  56.07  -54.82  66.09  
1 1 1 -1  -16 10 o 1  200.55  22.19  1209.41   251.20   1137.15  266.19   1796.94   759.05   193.44  24.52  219.10  59.03  -25.66  63.92  
1 1 1 -1  -16 11 o 16 205.75  22.31  1274.95   259.34   1192.38  275.08   1934.92   777.67   197.84  24.76  226.37  59.19  -28.53  64.16  
1 1 1 -1  -16 12 o 11 48.35   17.88  54.83     65.74    54.83    65.74    0.00      0.00     48.35   17.88  ?       ?      0.00    17.88  
1 1 1 -1  -16 13 o 14 72.24   18.71  160.08    78.22    161.87   78.64    -3.42     752.21   72.64   18.74  116.19  52.58  -43.56  55.82  
1 1 1 -1  -16 14 o 15 46.25   17.92  42.07     67.82    39.08    68.08    432.70    778.04   45.76   17.89  132.57  56.92  -86.81  59.67  
1 1 1 -1  -16 15 f 0  160.31  24.19  795.98    215.67   732.89   223.02   1706.68   847.32   152.67  26.40  197.03  64.77  -44.36  69.94  
1 1 1 -1  -16 16 o 13 108.72  20.08  363.72    120.69   356.01   121.75   801.32    916.83   107.40  20.49  147.63  62.53  -40.24  65.81  
1 1 1 -1  -15 1  o 15 201.17  33.40  1229.94   372.21   1229.94  372.21   0.00      0.00     201.17  33.40  ?       ?      0.00    33.40  
1 1 1 -1  -15 2  o 19 575.87  62.21  10757.40  2023.98  10757.40 2023.98  0.00      0.00     575.87  62.21  ?       ?      0.00    62.21  
1 1 1 -1  -15 3  o 13 304.62  38.87  2836.30   664.32   2836.30  664.32   0.00      0.00     304.62  38.87  ?       ?      0.00    38.87  
1 1 1 -1  -15 4  o 12 166.54  21.61  822.31    201.75   822.31   201.75   0.00      0.00     166.54  21.61  ?       ?      0.00    21.61  
1 1 1 -1  -15 5  f 0  466.82  91.68  8393.16   2369.24  8393.16  2369.24  0.00      0.00     466.82  91.68  ?       ?      0.00    91.68  
1 1 1 -1  -15 6  o 10 31.60   15.74  -290.24   113.75   -290.24  113.75   0.00      0.00     31.60   15.74  ?       ?      0.00    15.74  
1 1 1 -1  -15 7  o 14 221.10  45.34  1578.36   556.16   1578.36  556.16   0.00      0.00     221.10  45.34  ?       ?      0.00    45.34  
1 1 1 -1  -15 8  f 0  133.08  19.13  527.17    141.97   527.17   141.97   0.00      0.00     133.08  19.13  ?       ?      0.00    19.13  
1 1 1 -1  -15 9  o 12 317.47  26.87  3017.93   485.09   3001.18  563.43   3065.91   953.62   314.09  31.68  299.54  57.55  14.55   65.69  
1 1 1 -1  -15 10 o 4  238.09  25.80  1704.26   346.96   1813.42  386.24   1247.93   789.71   244.72  28.00  187.42  62.56  57.30   68.54  
1 1 1 -1  -15 11 o 16 69.17   18.70  144.93    76.02    148.62   76.67    -72.10    588.64   70.00   18.72  106.16  47.40  -36.16  50.96  
1 1 1 -1  -15 12 o 7  93.86   18.32  266.89    95.15    252.99   96.33    825.23    610.34   91.18   19.02  155.94  54.90  -64.77  58.10  
1 1 1 -1  -15 13 o 3  152.81  21.16  703.44    180.62   763.74   187.99   -21.51    651.76   159.36  21.06  111.56  49.84  47.81   54.11  
1 1 1 -1  -15 14 o 12 148.60  19.41  662.03    161.60   662.03   161.60   0.00      0.00     148.60  19.41  ?       ?      0.00    19.41  
1 1 1 -1  -15 15 o 1  86.24   17.92  226.77    85.83    232.83   86.53    -141.78   675.13   87.43   17.85  107.31  49.05  -19.88  52.19  
1 1 1 -1  -15 16 o 13 173.77  20.11  908.63    196.95   825.86   203.30   2172.53   794.45   164.81  22.04  237.23  58.67  -72.42  62.67  
1 1 1 -1  -15 17 o 18 115.36  39.21  434.65    310.12   434.65   310.12   0.00      0.00     115.36  39.21  ?       ?      0.00    39.21  
1 1 1 -1  -15 18 o 17 112.81  52.52  -146.58   827.48   0.00     0.00     -146.58   827.48   ?       ?      112.81  52.52  0.00    52.52  
1 1 1 -1  -14 1  o 16 689.27  57.28  15081.58  2246.16  14546.91 2735.37  16188.51  3935.77  656.94  73.81  638.44  111.44 18.50   133.66 
1 1 1 -1  -14 2  o 19 140.10  25.14  590.26    194.76   537.16   201.02   1402.81   786.37   133.06  27.23  207.17  61.60  -74.11  67.35  
1 1 1 -1  -14 3  o 10 479.80  83.89  7983.13   2226.59  7983.13  2226.59  0.00      0.00     479.80  83.89  ?       ?      0.00    83.89  
1 1 1 -1  -14 4  o 5  108.82  20.96  355.08    126.19   441.92   127.99   -2665.88  754.88   122.13  18.86  70.89   35.96  51.24   40.61  
1 1 1 -1  -14 5  o 19 650.09  37.32  12603.09  1386.74  5444.63  1885.08  21046.02  2047.23  394.66  85.67  835.78  42.81  -441.13 95.77  
1 1 1 -1  -14 6  o 8  269.52  33.52  2176.28   507.39   2176.28  507.39   0.00      0.00     269.52  33.52  ?       ?      0.00    33.52  
1 1 1 -1  -14 7  o 15 220.26  23.84  1430.66   296.66   1442.60  324.30   1369.41   734.39   220.61  26.11  205.31  59.12  15.30   64.63  
1 1 1 -1  -14 8  o 5  407.51  38.98  5039.87   900.83   5166.97  1085.57  4758.82   1614.29  407.63  47.27  367.27  78.92  40.36   91.99  
1 1 1 -1  -14 9  o 15 166.90  42.94  885.41    413.77   885.41   413.77   0.00      0.00     166.90  42.94  ?       ?      0.00    42.94  
1 1 1 -1  -14 10 o 9  105.71  39.54  276.05    323.08   276.05   323.08   0.00      0.00     105.71  39.54  ?       ?      0.00    39.54  
1 1 1 -1  -14 11 o 15 157.33  41.04  792.06    374.42   792.06   374.42   0.00      0.00     157.33  41.04  ?       ?      0.00    41.04  
1 1 1 -1  -14 12 f 0  96.50   18.01  279.92    96.09    279.92   96.09    0.00      0.00     96.50   18.01  ?       ?      0.00    18.01  
1 1 1 -1  -14 13 o 4  154.15  20.39  708.75    175.99   704.40   184.21   754.20    595.73   153.35  21.52  153.43  54.22  -0.08   58.33  
1 1 1 -1  -14 14 o 5  50.19   17.56  65.80     62.38    66.83    62.75    -20.54    575.29   50.47   17.62  107.10  47.39  -56.63  50.56  
1 1 1 -1  -14 15 o 9  100.11  35.18  289.03    250.48   291.87   278.96   277.19    569.08   102.12  36.98  120.12  49.97  -17.99  62.16  
1 1 1 -1  -14 16 o 14 90.64   35.04  192.28    259.03   157.22   284.80   360.14    623.16   89.97   36.13  126.61  52.44  -36.64  63.68  
1 1 1 -1  -14 17 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  -14 18 o 18 98.77   34.94  289.17    247.50   260.34   265.47   480.76    684.30   96.84   35.91  132.58  54.94  -35.74  65.64  
1 1 1 -1  -14 19 o 10 79.76   32.65  108.97    237.86   72.69    252.30   399.02    713.30   78.41   32.99  127.65  54.65  -49.24  63.83  
1 1 1 -1  -14 20 o 6  95.55   34.81  268.75    247.60   210.34   261.94   758.88    758.76   90.74   35.19  143.95  58.55  -53.21  68.31  
1 1 1 -1  -13 1  o 18 322.78  31.21  3089.88   571.02   3089.88  571.02   0.00      0.00     322.78  31.21  ?       ?      0.00    31.21  
1 1 1 -1  -13 2  o 16 82.60   18.41  205.27    85.09    215.78   86.43    -126.93   485.91   84.73   18.30  97.87   43.42  -13.13  47.12  
1 1 1 -1  -13 3  o 5  95.31   17.44  270.96    91.92    272.56   94.13    238.09    426.40   95.53   17.82  112.73  44.55  -17.20  47.98  
1 1 1 -1  -13 4  o 14 287.39  33.66  2475.57   544.78   2625.77  725.35   2281.19   825.12   291.60  44.76  266.49  55.73  25.12   71.48  
1 1 1 -1  -13 5  o 8  44.36   14.27  55.27     41.27    64.78    41.45    -1001.67  436.95   47.17   14.17  63.68   31.57  -16.51  34.61  
1 1 1 -1  -13 6  o 7  447.42  32.94  5946.69   840.20   5391.95  1014.12  7161.07   1500.43  421.23  42.52  476.99  55.85  -55.76  70.19  
1 1 1 -1  -13 7  o 1  464.51  43.53  6541.78   1147.34  5466.17  1585.36  7724.66   1662.55  407.58  70.30  494.00  59.84  -86.42  92.32  
1 1 1 -1  -13 8  o 3  225.61  43.31  1572.28   540.57   2687.22  684.18   -280.05   881.87   297.47  41.17  127.90  57.49  169.57  70.71  
1 1 1 -1  -13 9  f 0  597.04  29.42  10470.56  1005.13  3517.28  1353.40  19022.86  1500.97  323.71  74.39  803.14  32.62  -479.43 81.23  
1 1 1 -1  -13 10 o 3  291.71  26.62  2507.61   440.93   2515.93  511.84   2483.68   868.29   290.84  31.14  278.72  56.21  12.12   64.26  
1 1 1 -1  -13 11 o 4  89.06   19.52  239.19    97.02    240.36   98.76    206.72    519.36   89.25   19.79  118.00  48.27  -28.75  52.17  
1 1 1 -1  -13 12 o 6  193.22  27.24  1120.85   293.80   1202.56  337.71   866.49    595.86   199.21  30.50  165.49  54.31  33.72   62.29  
1 1 1 -1  -13 13 o 5  283.29  49.47  2594.11   775.21   2594.11  775.21   0.00      0.00     283.29  49.47  ?       ?      0.00    49.47  
1 1 1 -1  -13 14 f 0  156.19  36.80  771.19    324.52   771.19   324.52   0.00      0.00     156.19  36.80  ?       ?      0.00    36.80  
1 1 1 -1  -13 15 o 11 252.64  45.32  2072.03   633.09   2072.03  633.09   0.00      0.00     252.64  45.32  ?       ?      0.00    45.32  
1 1 1 -1  -13 16 o 1  384.01  46.46  4823.94   1003.33  4876.87  1378.31  4764.28   1463.35  361.55  68.92  349.33  75.20  12.22   102.01 
1 1 1 -1  -13 17 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  -13 18 o 4  147.87  32.89  700.69    271.97   581.22   305.26   1160.56   598.90   133.13  38.04  179.07  53.88  -45.94  65.96  
1 1 1 -1  -13 19 o 11 161.34  32.58  835.23    291.37   862.08   327.81   734.15    635.92   162.17  36.14  146.77  55.35  15.40   66.10  
1 1 1 -1  -13 20 o 1  224.64  33.16  1617.88   414.75   1565.36  490.54   1749.55   776.69   215.03  41.24  208.24  61.04  6.79    73.66  
1 1 1 -1  -13 21 o 11 88.42   28.67  241.75    166.33   281.55   172.09   -323.47   648.52   94.28   28.99  96.94   45.57  -2.65   54.01  
1 1 1 -1  -12 1  o 1  267.05  22.72  2081.98   344.98   1975.16  403.16   2374.07   666.67   259.03  27.53  279.79  42.87  -20.75  50.95  
1 1 1 -1  -12 2  o 5  347.70  35.37  3586.45   696.24   3586.45  696.24   0.00      0.00     347.70  35.37  ?       ?      0.00    35.37  
1 1 1 -1  -12 3  o 4  880.35  75.39  24747.53  3773.49  23920.73 4619.06  26406.50  6542.96  837.68  97.90  809.18  146.23 28.51   175.98 
1 1 1 -1  -12 4  o 16 262.98  30.82  2047.18   456.47   2232.07  611.08   1813.77   686.59   271.99  40.36  241.30  51.16  30.69   65.16  
1 1 1 -1  -12 5  o 13 257.95  22.29  1942.98   326.85   1764.70  387.97   2378.93   606.68   244.47  28.16  281.32  38.58  -36.85  47.76  
1 1 1 -1  -12 6  o 19 206.29  19.40  1242.38   227.07   1222.33  262.87   1301.30   450.69   203.94  22.85  206.19  39.51  -2.25   45.64  
1 1 1 -1  -12 7  o 6  283.89  24.94  2365.61   402.33   2327.92  483.63   2450.31   725.02   280.06  30.58  281.72  46.45  -1.66   55.61  
1 1 1 -1  -12 8  o 19 140.46  18.70  581.31    147.04   700.88   159.74   -82.44    376.35   154.52  18.37  87.45   38.53  67.07   42.68  
1 1 1 -1  -12 9  o 3  431.54  32.33  5522.11   795.05   4948.24  963.51   6746.58   1407.41  403.87  42.18  464.92  53.72  -61.05  68.30  
1 1 1 -1  -12 10 o 10 514.06  53.95  8198.26   1568.49  8198.26  1568.49  0.00      0.00     514.06  53.95  ?       ?      0.00    53.95  
1 1 1 -1  -12 11 o 11 158.41  48.42  767.76    481.13   2590.04  606.21   -2333.76  790.87   293.72  36.75  77.81   39.15  215.91  53.70  
1 1 1 -1  -12 12 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  -12 13 o 16 423.84  75.68  6104.93   1773.94  0.00     0.00     6104.93   1773.94  ?       ?      423.84  75.68  0.00    75.68  
1 1 1 -1  -12 14 o 16 301.70  35.17  2758.19   597.80   2706.64  802.75   2822.37   895.71   291.54  49.75  294.80  54.95  -3.26   74.12  
1 1 1 -1  -12 15 o 2  189.03  29.82  1086.44   312.90   1093.85  389.33   1072.91   525.86   186.89  37.59  181.13  49.27  5.75    61.98  
1 1 1 -1  -12 16 o 18 264.69  45.92  2252.00   672.44   2252.00  672.44   0.00      0.00     264.69  45.92  ?       ?      0.00    45.92  
1 1 1 -1  -12 17 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  -12 18 o 18 59.90   27.88  -188.15   232.74   -188.15  232.74   0.00      0.00     59.90   27.88  ?       ?      0.00    27.88  
1 1 1 -1  -12 19 o 4  216.17  30.88  1454.07   372.32   1411.03  458.01   1537.92   639.31   207.82  39.84  207.73  53.34  0.09    66.58  
1 1 1 -1  -12 20 o 6  188.77  29.40  1112.25   308.22   1049.36  353.45   1311.91   629.74   180.13  35.44  188.67  54.87  -8.54   65.32  
1 1 1 -1  -12 21 o 11 71.99   27.51  119.39    158.40   119.39   158.40   0.00      0.00     71.99   27.51  ?       ?      0.00    27.51  
1 1 1 -1  -12 22 o 14 92.47   28.25  269.01    163.73   275.06   168.65   169.65    683.24   93.45   28.69  116.68  51.64  -23.23  59.07  
1 1 1 -1  -12 23 o 10 72.81   29.19  103.62    185.56   103.62   185.56   0.00      0.00     72.81   29.19  ?       ?      0.00    29.19  
1 1 1 -1  -11 1  o 13 316.46  30.87  2973.52   553.64   3295.03  792.07   2666.36   774.18   328.40  43.05  292.92  47.68  35.48   64.24  
1 1 1 -1  -11 2  o 1  410.18  67.21  5451.60   1527.86  5451.60  1527.86  0.00      0.00     410.18  67.21  ?       ?      0.00    67.21  
1 1 1 -1  -11 3  o 19 234.98  37.43  1670.13   487.98   1670.13  487.98   0.00      0.00     234.98  37.43  ?       ?      0.00    37.43  
1 1 1 -1  -11 4  f 0  55.96   13.38  93.83     42.41    83.26    43.36    327.07    203.62   52.83   14.05  105.04  31.37  -52.21  34.38  
1 1 1 -1  -11 5  o 15 186.72  17.94  1015.76   189.92   725.91   238.81   1514.54   313.27   155.68  27.74  227.19  24.40  -71.51  36.94  
1 1 1 -1  -11 6  o 11 524.14  43.52  8198.48   1297.62  8294.34  1587.39  8005.41   2252.86  522.10  53.73  495.14  82.13  26.96   98.15  
1 1 1 -1  -11 7  o 8  159.75  14.49  741.16    131.45   631.29   148.34   1143.05   283.69   146.81  17.98  196.80  25.73  -50.00  31.38  
1 1 1 -1  -11 8  o 2  228.49  17.42  1515.50   226.80   1320.63  267.44   2014.55   427.99   212.39  22.27  261.36  29.01  -48.97  36.57  
1 1 1 -1  -11 9  o 14 325.13  31.47  3124.74   580.07   3335.81  705.70   2685.07   1018.52  334.08  37.44  289.13  63.14  44.95   73.40  
1 1 1 -1  -11 10 o 14 381.65  31.72  4309.45   688.74   4137.22  838.13   4667.61   1208.64  370.67  40.02  385.72  56.24  -15.06  69.02  
1 1 1 -1  -11 11 o 14 129.99  29.03  514.47    211.17   740.44   262.76   102.37    354.85   156.22  30.39  96.33   39.71  59.89   50.00  
1 1 1 -1  -11 12 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  -11 13 o 9  315.91  37.07  2992.32   659.54   3279.77  903.46   2664.36   965.02   325.62  49.92  288.27  60.26  37.34   78.25  
1 1 1 -1  -11 14 o 14 315.83  59.72  3185.22   1043.07  0.00     0.00     3185.22   1043.07  ?       ?      315.83  59.72  0.00    59.72  
1 1 1 -1  -11 15 o 11 116.79  45.49  284.04    438.97   0.00     0.00     284.04    438.97   ?       ?      116.79  45.49  0.00    45.49  
1 1 1 -1  -11 16 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  -11 17 o 4  187.77  27.97  1066.45   292.27   966.54   359.44   1261.42   502.12   175.54  36.85  197.65  45.23  -22.12  58.34  
1 1 1 -1  -11 18 o 11 141.88  34.36  633.61    276.81   633.61   276.81   0.00      0.00     141.88  34.36  ?       ?      0.00    34.36  
1 1 1 -1  -11 19 o 19 106.53  27.83  352.49    172.01   384.57   184.25   134.80    479.96   111.10  28.69  107.41  45.36  3.68    53.67  
1 1 1 -1  -11 20 o 15 146.18  30.03  671.07    243.60   671.07   243.60   0.00      0.00     146.18  30.03  ?       ?      0.00    30.03  
1 1 1 -1  -11 21 f 0  139.18  29.62  612.28    229.43   612.28   229.43   0.00      0.00     139.18  29.62  ?       ?      0.00    29.62  
1 1 1 -1  -11 22 o 4  310.72  37.11  3125.09   648.96   2845.70  851.30   3512.70   1002.70  278.49  55.20  305.00  59.40  -26.51  81.09  
1 1 1 -1  -11 23 o 16 81.21   28.92  185.74    169.82   177.00   178.15   272.67    561.90   80.79   29.51  115.26  48.90  -34.48  57.11  
1 1 1 -1  -11 24 o 9  64.34   26.59  55.38     159.69   63.71    165.94   -48.99    587.21   66.11   27.19  100.84  45.96  -34.73  53.40  
1 1 1 -1  -10 1  o 5  229.86  20.10  1550.79   262.52   1647.08  452.58   1501.96   322.28   231.99  35.08  224.70  25.43  7.29    43.33  
1 1 1 -1  -10 2  o 8  229.44  16.67  1533.75   218.07   1533.75  218.07   0.00      0.00     229.44  16.67  ?       ?      0.00    16.67  
1 1 1 -1  -10 3  o 4  138.92  14.89  564.27    116.91   391.83   141.14   941.14    208.66   114.00  22.37  178.65  20.73  -64.66  30.50  
1 1 1 -1  -10 4  f 0  623.36  60.25  12465.29  2129.17  10317.67 2606.47  16772.63  3691.29  537.52  87.47  669.45  99.03  -131.93 132.13 
1 1 1 -1  -10 5  o 2  557.21  106.53 11775.15  3283.61  11775.15 3283.61  0.00      0.00     557.21  106.53 ?       ?      0.00    106.53 
1 1 1 -1  -10 6  o 5  545.72  98.30  10632.26  2966.36  10632.26 2966.36  0.00      0.00     545.72  98.30  ?       ?      0.00    98.30  
1 1 1 -1  -10 7  o 12 320.04  50.12  3151.21   890.60   3151.21  890.60   0.00      0.00     320.04  50.12  ?       ?      0.00    50.12  
1 1 1 -1  -10 8  o 1  357.51  32.36  3766.96   656.85   3871.93  802.29   3553.54   1143.95  360.26  39.44  336.18  61.54  24.08   73.09  
1 1 1 -1  -10 9  o 1  744.27  64.83  17140.55  2742.33  16569.22 3357.57  18285.45  4752.95  715.42  83.31  711.15  120.74 4.27    146.69 
1 1 1 -1  -10 10 o 13 206.48  23.86  1251.78   277.68   1166.95  378.99   1350.09   407.99   196.82  34.82  212.09  34.71  -15.26  49.16  
1 1 1 -1  -10 11 o 16 279.69  30.30  2310.76   478.67   2380.87  668.41   2236.94   685.80   280.14  42.93  270.39  45.82  9.75    62.79  
1 1 1 -1  -10 12 o 19 748.10  88.10  19074.43  3711.27  17997.67 5246.09  20153.20  5250.98  645.24  145.15 700.64  135.45 -55.40  198.54 
1 1 1 -1  -10 13 o 18 56.45   24.61  -26.66    150.02   189.10   176.59   -586.41   284.42   84.67   29.55  53.53   26.34  31.13   39.59  
1 1 1 -1  -10 14 o 1  410.70  44.13  5128.92   1024.05  4964.38  1432.14  5301.05   1464.85  391.09  66.15  405.00  65.22  -13.91  92.89  
1 1 1 -1  -10 15 o 2  146.72  37.02  661.86    311.73   661.86   311.73   0.00      0.00     146.72  37.02  ?       ?      0.00    37.02  
1 1 1 -1  -10 16 o 4  426.99  74.99  6067.71   1771.10  0.00     0.00     6067.71   1771.10  ?       ?      426.99  74.99  0.00    74.99  
1 1 1 -1  -10 17 o 1  438.97  79.33  6714.38   1925.57  0.00     0.00     6714.38   1925.57  ?       ?      438.97  79.33  0.00    79.33  
1 1 1 -1  -10 18 o 11 366.06  66.75  4600.17   1351.01  0.00     0.00     4600.17   1351.01  ?       ?      366.06  66.75  0.00    66.75  
1 1 1 -1  -10 19 o 13 270.67  53.19  2433.59   797.06   0.00     0.00     2433.59   797.06   ?       ?      270.67  53.19  0.00    53.19  
1 1 1 -1  -10 20 o 9  127.54  25.71  499.37    181.73   498.16   200.03   505.06    434.96   126.72  28.22  130.18  46.30  -3.46   54.22  
1 1 1 -1  -10 21 o 1  59.30   24.09  47.56     128.35   50.16    134.63   21.64     424.98   60.71   24.67  95.50   41.54  -34.79  48.31  
1 1 1 -1  -10 22 o 8  135.43  47.39  599.84    454.35   0.00     0.00     599.84    454.35   ?       ?      135.43  47.39  0.00    47.39  
1 1 1 -1  -10 23 f 0  175.82  32.43  989.71    315.28   989.71   315.28   0.00      0.00     175.82  32.43  ?       ?      0.00    32.43  
1 1 1 -1  -10 24 o 18 151.27  30.82  737.65    258.56   737.65   258.56   0.00      0.00     151.27  30.82  ?       ?      0.00    30.82  
1 1 1 -1  -10 25 o 16 303.34  39.04  3122.95   664.02   3063.32  878.60   3202.38   1014.03  277.76  57.01  270.25  65.95  7.51    87.18  
1 1 1 -1  -9  1  o 14 73.34   12.14  159.37    49.31    159.37   49.31    0.00      0.00     73.34   12.14  ?       ?      0.00    12.14  
1 1 1 -1  -9  2  o 12 396.51  40.47  4847.46   908.21   4445.63  1283.01  5251.04   1285.80  361.89  64.10  399.43  57.75  -37.54  86.28  
1 1 1 -1  -9  3  o 7  424.88  49.80  5736.14   1191.72  6242.81  1684.37  5228.29   1686.34  422.90  71.96  378.11  80.18  44.79   107.73 
1 1 1 -1  -9  4  o 19 227.97  26.05  1548.62   334.75   1777.29  471.33   1315.89   475.50   241.06  35.09  204.13  41.98  36.93   54.71  
1 1 1 -1  -9  5  o 18 305.07  32.27  2800.86   556.65   2824.90  785.08   2776.56   789.37   298.86  47.33  295.80  48.14  3.07    67.51  
1 1 1 -1  -9  6  o 2  251.11  20.82  1848.48   297.44   1954.21  364.20   1636.72   515.44   257.08  24.99  229.59  40.59  27.49   47.67  
1 1 1 -1  -9  7  o 16 288.18  21.05  2428.35   345.90   2125.70  421.19   3055.26   606.19   267.65  27.82  319.22  33.58  -51.57  43.61  
1 1 1 -1  -9  8  f 0  490.79  46.90  7370.47   1305.26  7462.37  1597.70  7186.03   2263.37  485.83  58.46  449.24  90.89  36.59   108.07 
1 1 1 -1  -9  9  o 18 380.48  60.79  4575.99   1283.13  4575.99  1283.13  0.00      0.00     380.48  60.79  ?       ?      0.00    60.79  
1 1 1 -1  -9  10 o 12 133.58  26.46  536.54    195.74   536.54   195.74   0.00      0.00     133.58  26.46  ?       ?      0.00    26.46  
1 1 1 -1  -9  11 o 14 152.04  27.69  692.29    232.75   692.29   232.75   0.00      0.00     152.04  27.69  ?       ?      0.00    27.69  
1 1 1 -1  -9  12 o 11 322.41  33.53  3072.35   611.52   2906.38  859.07   3242.83   870.67   308.06  50.31  326.68  47.85  -18.62  69.43  
1 1 1 -1  -9  13 o 11 518.50  52.88  8212.27   1552.03  6646.27  2190.74  9790.24   2199.09  442.30  89.36  554.11  70.75  -111.80 113.97 
1 1 1 -1  -9  14 o 18 227.21  25.57  1522.82   327.69   1325.14  441.55   1765.19   488.91   208.26  38.34  241.78  36.35  -33.52  52.83  
1 1 1 -1  -9  15 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  -9  16 o 5  309.38  33.29  2852.40   581.93   2483.01  792.98   3283.49   856.66   281.63  50.92  326.61  47.05  -44.97  69.33  
1 1 1 -1  -9  17 o 1  599.13  57.96  11213.92  1968.69  7514.83  2766.71  15007.72  2801.91  444.82  109.17 678.26  73.11  -233.45 131.39 
1 1 1 -1  -9  18 o 7  481.20  45.98  7093.40   1254.69  4822.25  1752.28  9482.97   1797.38  369.14  84.52  547.16  58.11  -178.01 102.57 
1 1 1 -1  -9  19 o 18 248.54  29.77  1854.75   416.33   1966.58  545.04   1698.11   645.09   252.32  38.87  228.89  50.45  23.43   63.69  
1 1 1 -1  -9  20 o 16 232.74  47.25  1759.98   609.64   0.00     0.00     1759.98   609.64   ?       ?      232.74  47.25  0.00    47.25  
1 1 1 -1  -9  21 o 17 264.23  51.28  2333.23   749.78   0.00     0.00     2333.23   749.78   ?       ?      264.23  51.28  0.00    51.28  
1 1 1 -1  -9  22 o 5  341.11  67.21  4361.94   1269.28  0.00     0.00     4361.94   1269.28  ?       ?      341.11  67.21  0.00    67.21  
1 1 1 -1  -9  23 o 13 106.36  25.30  353.29    152.19   366.33   174.09   310.99    313.49   107.81  27.91  105.45  39.04  2.35    47.99  
1 1 1 -1  -9  24 o 6  199.26  27.42  1231.98   305.29   1463.14  398.37   903.00    475.23   213.69  33.58  159.14  48.02  54.54   58.60  
1 1 1 -1  -9  25 o 7  141.72  29.49  644.98    232.11   644.98   232.11   0.00      0.00     141.72  29.49  ?       ?      0.00    29.49  
1 1 1 -1  -9  26 o 8  180.08  31.23  1056.86   311.18   1056.86  311.18   0.00      0.00     180.08  31.23  ?       ?      0.00    31.23  
1 1 1 -1  -9  27 o 18 112.27  24.20  401.83    151.38   401.83   151.38   0.00      0.00     112.27  24.20  ?       ?      0.00    24.20  
1 1 1 -1  -8  1  o 19 171.99  12.91  858.50    126.55   878.31   179.06   838.73    178.87   173.04  18.30  168.96  18.76  4.08    26.21  
1 1 1 -1  -8  2  o 16 7.59    3.14   0.42      2.22     -4.42    8.46     0.78      2.31     12.47   5.62   8.03    3.24   4.44    6.48   
1 1 1 -1  -8  3  o 7  213.90  35.58  1403.80   421.55   1403.80  421.55   0.00      0.00     213.90  35.58  ?       ?      0.00    35.58  
1 1 1 -1  -8  4  o 2  193.39  16.65  1092.09   183.07   1269.71  224.24   737.06    317.03   208.13  18.98  153.66  36.49  54.47   41.13  
1 1 1 -1  -8  5  o 12 164.54  15.12  790.24    141.22   615.88   194.70   983.81    205.15   142.97  24.61  182.76  19.87  -39.79  31.63  
1 1 1 -1  -8  6  o 7  166.49  18.46  815.35    173.47   895.40   241.27   729.69    249.60   172.92  25.03  154.63  29.19  18.28   38.45  
1 1 1 -1  -8  7  o 17 128.28  18.11  487.14    129.62   738.74   177.48   199.50    189.76   158.05  20.01  86.79   30.61  71.26   36.57  
1 1 1 -1  -8  8  f 0  273.65  43.25  2335.11   656.82   0.00     0.00     2335.11   656.82   ?       ?      273.65  43.25  0.00    43.25  
1 1 1 -1  -8  9  o 18 151.45  17.89  674.01    152.56   814.44   220.49   545.03    211.31   165.34  23.93  133.69  28.41  31.65   37.14  
1 1 1 -1  -8  10 o 8  83.83   17.67  211.00    82.37    274.76   127.82   165.71    107.73   95.26   23.52  75.25   22.90  20.01   32.82  
1 1 1 -1  -8  11 o 6  440.95  46.79  5908.76   1166.35  5824.10  1648.01  5993.71   1650.93  423.90  70.18  430.88  69.08  -6.97   98.47  
1 1 1 -1  -8  12 o 10 595.52  105.26 12436.46  3466.84  12436.46 3466.84  0.00      0.00     595.52  105.26 ?       ?      0.00    105.26 
1 1 1 -1  -8  13 o 8  358.05  55.80  3952.03   1109.63  3952.03  1109.63  0.00      0.00     358.05  55.80  ?       ?      0.00    55.80  
1 1 1 -1  -8  14 o 6  449.34  72.36  6454.06   1803.29  6454.06  1803.29  0.00      0.00     449.34  72.36  ?       ?      0.00    72.36  
1 1 1 -1  -8  15 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  -8  16 o 7  556.65  105.30 11595.87  3241.67  0.00     0.00     11595.87  3241.67  ?       ?      556.65  105.30 0.00    105.30 
1 1 1 -1  -8  17 o 8  305.30  32.15  2776.82   554.97   2416.23  758.48   3192.31   814.17   277.83  49.36  322.18  45.27  -44.35  66.98  
1 1 1 -1  -8  18 o 17 285.20  33.52  2429.02   538.29   2848.03  724.07   1911.35   804.82   305.81  42.38  243.63  58.32  62.18   72.10  
1 1 1 -1  -8  19 o 9  148.44  28.15  666.03    231.12   666.03   231.12   0.00      0.00     148.44  28.15  ?       ?      0.00    28.15  
1 1 1 -1  -8  20 o 17 136.48  38.50  579.51    314.60   0.00     0.00     579.51    314.60   ?       ?      136.48  38.50  0.00    38.50  
1 1 1 -1  -8  21 o 7  86.81   23.17  229.36    117.60   288.69   133.26   20.46     250.06   97.13   24.03  76.39   32.52  20.74   40.44  
1 1 1 -1  -8  22 o 10 183.67  23.52  1011.63   242.35   1058.98  316.00   944.00    377.66   185.32  30.78  171.41  39.23  13.91   49.86  
1 1 1 -1  -8  23 o 15 170.70  38.40  946.73    367.17   0.00     0.00     946.73    367.17   ?       ?      170.70  38.40  0.00    38.40  
1 1 1 -1  -8  24 o 8  138.66  38.78  638.10    320.65   0.00     0.00     638.10    320.65   ?       ?      138.66  38.78  0.00    38.78  
1 1 1 -1  -8  25 o 3  63.05   29.64  -239.81   274.52   0.00     0.00     -239.81   274.52   ?       ?      63.05   29.64  0.00    29.64  
1 1 1 -1  -8  26 o 6  158.62  22.14  771.22    196.11   815.15   235.20   670.99    355.25   161.14  26.34  138.54  41.45  22.60   49.11  
1 1 1 -1  -8  27 o 18 109.37  18.98  367.53    114.84   451.50   124.07   -134.23   303.29   121.73  18.32  70.77   32.54  50.97   37.34  
1 1 1 -1  -8  28 o 7  107.80  22.87  368.97    137.16   368.97   137.16   0.00      0.00     107.80  22.87  ?       ?      0.00    22.87  
1 1 1 -1  -7  1  o 14 269.44  15.76  2103.01   242.68   2100.30  342.88   2105.73   343.54   268.01  22.49  268.36  22.51  -0.35   31.82  
1 1 1 -1  -7  2  o 10 203.01  90.94  1.54      2186.27  2.80     3091.85  0.28      3091.86  231.24  105.41 231.19  105.40 0.04    149.07 
1 1 1 -1  -7  3  o 4  116.68  9.87   394.53    65.51    367.75   78.95    453.75    117.39   112.28  12.46  124.15  16.91  -11.87  21.00  
1 1 1 -1  -7  4  o 5  223.75  20.49  1466.31   260.24   1605.90  318.61   1186.50   451.09   233.38  24.13  195.12  41.55  38.26   48.04  
1 1 1 -1  -7  5  f 0  224.78  34.24  1533.39   427.88   1533.39  427.88   0.00      0.00     224.78  34.24  ?       ?      0.00    34.24  
1 1 1 -1  -7  6  o 6  130.79  11.29  496.73    83.94    496.73   83.94    0.00      0.00     130.79  11.29  ?       ?      0.00    11.29  
1 1 1 -1  -7  7  o 3  332.41  35.37  3345.21   664.53   3633.01  939.91   3057.56   939.67   338.39  49.88  306.64  55.42  31.76   74.56  
1 1 1 -1  -7  8  o 2  214.32  22.24  1356.48   269.70   1212.74  380.89   1501.01   381.93   198.59  34.67  222.91  30.66  -24.32  46.28  
1 1 1 -1  -7  9  o 14 192.61  20.78  1093.86   226.17   1259.94  322.08   932.29    317.67   204.78  28.14  174.16  32.98  30.62   43.36  
1 1 1 -1  -7  10 o 12 53.09   18.95  70.23     72.94    0.00     0.00     70.23     72.94    ?       ?      53.09   18.95  0.00    18.95  
1 1 1 -1  -7  11 o 5  321.62  51.49  3275.45   918.56   0.00     0.00     3275.45   918.56   ?       ?      321.62  51.49  0.00    51.49  
1 1 1 -1  -7  12 o 10 85.92   22.84  222.38    114.60   0.00     0.00     222.38    114.60   ?       ?      85.92   22.84  0.00    22.84  
1 1 1 -1  -7  13 f 0  301.24  32.23  2689.47   548.73   3029.49  776.45   2350.19   775.60   315.88  44.01  274.98  51.01  40.90   67.37  
1 1 1 -1  -7  14 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  -7  15 o 14 781.99  172.40 27028.08  7530.71  0.00     0.00     27028.08  7530.71  ?       ?      781.99  172.40 0.00    172.40 
1 1 1 -1  -7  16 o 2  92.04   21.97  255.32    114.45   255.32   114.45   0.00      0.00     92.04   21.97  ?       ?      0.00    21.97  
1 1 1 -1  -7  17 f 0  352.62  56.26  3930.76   1100.63  3930.76  1100.63  0.00      0.00     352.62  56.26  ?       ?      0.00    56.26  
1 1 1 -1  -7  18 o 6  278.29  29.55  2300.78   464.84   2186.05  644.66   2425.03   670.89   266.00  43.74  280.76  42.99  -14.76  61.33  
1 1 1 -1  -7  19 o 10 282.47  32.63  2381.10   519.42   2901.24  717.66   1808.89   752.73   308.78  41.54  237.34  56.13  71.44   69.83  
1 1 1 -1  -7  20 o 5  536.95  62.75  9241.74   1897.71  10323.27 2677.35  8149.79   2690.22  541.03  89.32  464.35  103.56 76.68   136.76 
1 1 1 -1  -7  21 o 6  310.68  34.84  2922.71   610.65   3215.20  853.17   2615.48   874.39   318.97  48.09  282.70  55.86  36.27   73.71  
1 1 1 -1  -7  22 o 3  364.46  42.26  4174.95   867.76   4651.16  1219.24  3686.10   1235.31  370.40  59.34  320.12  69.24  50.28   91.19  
1 1 1 -1  -7  23 o 8  48.94   19.02  44.79     76.67    64.24    81.92    -92.54    217.69   53.35   19.92  63.16   28.46  -9.81   34.74  
1 1 1 -1  -7  24 o 16 231.23  26.94  1629.15   350.91   1755.76  475.64   1477.93   519.82   234.83  36.46  210.19  44.47  24.65   57.51  
1 1 1 -1  -7  25 o 12 90.55   19.62  251.64    99.05    263.71   108.26   189.64    245.39   92.45   20.89  88.67   34.15  3.79    40.03  
1 1 1 -1  -7  26 o 14 87.28   34.37  174.72    252.93   0.00     0.00     174.72    252.93   ?       ?      87.28   34.37  0.00    34.37  
1 1 1 -1  -7  27 o 2  110.08  37.15  398.36    278.35   0.00     0.00     398.36    278.35   ?       ?      110.08  37.15  0.00    37.15  
1 1 1 -1  -7  28 o 15 219.64  28.55  1552.03   351.53   1794.68  470.71   1246.03   528.59   228.44  37.17  176.81  49.91  51.63   62.23  
1 1 1 -1  -6  1  f 0  8.64    2.87   2.03      1.66     3.64     3.80     1.64      1.85     12.17   4.33   8.33    3.01   3.83    5.27   
1 1 1 -1  -6  2  o 6  10.90   5.48   -48.00    15.48    0.00     0.00     -48.00    15.48    ?       ?      10.90   5.48   0.00    5.48   
1 1 1 -1  -6  3  o 9  621.04  54.39  11775.12  1919.46  11896.57 2350.76  11532.17  3324.84  614.40  67.77  571.48  105.22 42.92   125.16 
1 1 1 -1  -6  4  f 0  92.36   7.45   246.75    39.19    222.94   46.75    302.99    71.86    87.54   9.45   101.81  12.56  -14.27  15.72  
1 1 1 -1  -6  5  o 13 602.42  64.11  11488.19  2183.11  10665.88 3086.88  12311.04  3087.89  543.49  102.70 594.84  93.51  -51.35  138.89 
1 1 1 -1  -6  6  f 0  301.96  21.42  2661.28   368.82   2402.84  451.36   3180.58   639.80   285.16  27.93  326.13  34.71  -40.96  44.55  
1 1 1 -1  -6  7  o 3  300.08  31.29  2686.13   531.02   2713.53  750.84   2658.70   751.11   295.57  45.73  292.24  46.31  3.33    65.08  
1 1 1 -1  -6  8  o 14 213.89  22.18  1348.09   268.42   1323.00  378.91   1373.36   380.29   208.79  32.68  213.00  32.10  -4.21   45.81  
1 1 1 -1  -6  9  o 13 218.22  22.53  1405.63   278.22   1238.13  392.48   1574.81   394.44   200.65  35.36  228.52  30.86  -27.87  46.93  
1 1 1 -1  -6  10 o 18 275.65  28.89  2272.48   450.42   2295.66  635.74   2249.11   638.24   271.18  42.21  268.00  42.93  3.17    60.21  
1 1 1 -1  -6  11 o 12 129.62  14.26  491.65    104.37   402.82   142.30   595.09    153.55   115.53  22.26  141.74  19.38  -26.20  29.51  
1 1 1 -1  -6  12 o 14 139.45  16.32  570.76    128.15   632.11   184.10   513.09    178.49   145.46  22.80  130.29  24.77  15.16   33.66  
1 1 1 -1  -6  13 o 7  314.42  49.81  3100.89   869.12   0.00     0.00     3100.89   869.12   ?       ?      314.42  49.81  0.00    49.81  
1 1 1 -1  -6  14 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  -6  15 o 10 412.93  65.76  5394.68   1506.65  0.00     0.00     5394.68   1506.65  ?       ?      412.93  65.76  0.00    65.76  
1 1 1 -1  -6  16 f 0  187.58  20.87  1030.22   220.94   1246.00  310.64   809.29    314.32   205.30  27.01  163.20  34.62  42.11   43.91  
1 1 1 -1  -6  17 o 15 398.06  41.71  4754.94   938.96   4704.39  1325.14  4805.91   1330.64  386.33  61.83  390.83  61.32  -4.50   87.09  
1 1 1 -1  -6  18 o 14 155.62  25.56  724.39    220.41   724.39   220.41   0.00      0.00     155.62  25.56  ?       ?      0.00    25.56  
1 1 1 -1  -6  19 o 7  477.05  84.54  7995.25   2230.52  7995.25  2230.52  0.00      0.00     477.05  84.54  ?       ?      0.00    84.54  
1 1 1 -1  -6  20 o 15 207.84  33.23  1305.19   383.15   1305.19  383.15   0.00      0.00     207.84  33.23  ?       ?      0.00    33.23  
1 1 1 -1  -6  21 o 11 484.11  56.43  7403.55   1538.93  8623.69  2171.53  6172.46   2181.25  503.91  77.55  409.07  94.75  94.84   122.44 
1 1 1 -1  -6  22 o 3  230.79  39.65  1657.57   506.45   0.00     0.00     1657.57   506.45   ?       ?      230.79  39.65  0.00    39.65  
1 1 1 -1  -6  23 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  -6  24 o 12 229.12  26.74  1589.30   345.11   1859.69  471.85   1278.29   506.06   244.05  34.65  195.81  45.83  48.24   57.46  
1 1 1 -1  -6  25 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  -6  26 o 10 150.50  26.28  706.85    218.82   706.85   218.82   0.00      0.00     150.50  26.28  ?       ?      0.00    26.28  
1 1 1 -1  -6  27 o 8  125.74  23.84  494.01    165.78   494.01   165.78   0.00      0.00     125.74  23.84  ?       ?      0.00    23.84  
1 1 1 -1  -6  28 o 16 102.66  35.08  342.14    248.37   0.00     0.00     342.14    248.37   ?       ?      102.66  35.08  0.00    35.08  
1 1 1 -1  -6  29 o 1  97.46   35.28  306.27    253.86   0.00     0.00     306.27    253.86   ?       ?      97.46   35.28  0.00    35.28  
1 1 1 -1  -5  1  o 6  387.43  56.62  4595.48   1222.16  6893.95  1496.93  0.30      2116.58  476.27  55.81  208.77  91.70  267.50  107.35 
1 1 1 -1  -5  2  o 11 409.57  30.04  4906.49   701.34   3617.45  991.66   6196.45   992.01   344.68  51.71  458.09  38.07  -113.41 64.21  
1 1 1 -1  -5  3  o 2  789.51  63.89  19148.21  2870.80  20133.25 4972.51  18655.74  3515.95  753.96  118.82 764.05  81.41  -10.10  144.03 
1 1 1 -1  -5  4  o 8  434.95  68.85  5964.30   1661.82  5964.30  1661.82  0.00      0.00     434.95  68.85  ?       ?      0.00    68.85  
1 1 1 -1  -5  5  x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  -5  6  o 3  132.69  20.44  521.11    150.70   521.11   150.70   0.00      0.00     132.69  20.44  ?       ?      0.00    20.44  
1 1 1 -1  -5  7  o 10 204.33  20.97  1222.53   242.52   1154.46  342.72   1290.79   343.23   196.08  31.52  208.08  29.56  -12.00  43.21  
1 1 1 -1  -5  8  o 12 209.16  21.53  1283.95   254.86   1224.13  360.11   1343.98   360.74   201.46  32.22  211.78  30.55  -10.32  44.41  
1 1 1 -1  -5  9  o 6  227.72  23.47  1528.97   302.43   1419.61  426.62   1639.44   428.78   215.64  35.71  233.03  32.97  -17.39  48.60  
1 1 1 -1  -5  10 f 0  383.55  40.96  4514.09   887.96   4364.62  1255.12  4663.86   1256.41  362.42  62.59  376.78  60.10  -14.36  86.78  
1 1 1 -1  -5  11 o 14 382.81  41.14  4516.90   889.90   4470.22  1257.93  4563.67   1259.09  365.73  62.13  370.20  61.40  -4.47   87.35  
1 1 1 -1  -5  12 o 13 277.60  43.97  2419.68   677.37   0.00     0.00     2419.68   677.37   ?       ?      277.60  43.97  0.00    43.97  
1 1 1 -1  -5  13 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  -5  14 o 9  211.37  32.70  1352.94   383.99   0.00     0.00     1352.94   383.99   ?       ?      211.37  32.70  0.00    32.70  
1 1 1 -1  -5  15 o 16 302.43  47.09  2824.36   790.96   0.00     0.00     2824.36   790.96   ?       ?      302.43  47.09  0.00    47.09  
1 1 1 -1  -5  16 o 11 285.76  43.87  2482.91   696.62   0.00     0.00     2482.91   696.62   ?       ?      285.76  43.87  0.00    43.87  
1 1 1 -1  -5  17 o 9  422.33  67.37  5654.79   1578.44  0.00     0.00     5654.79   1578.44  ?       ?      422.33  67.37  0.00    67.37  
1 1 1 -1  -5  18 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  -5  19 o 4  231.41  35.77  1623.65   459.84   1623.65  459.84   0.00      0.00     231.41  35.77  ?       ?      0.00    35.77  
1 1 1 -1  -5  20 o 9  229.39  24.10  1552.96   312.65   1434.18  431.75   1683.92   453.35   216.76  35.96  235.77  34.52  -19.01  49.84  
1 1 1 -1  -5  21 f 0  385.11  62.86  4804.85   1341.80  4804.85  1341.80  0.00      0.00     385.11  62.86  ?       ?      0.00    62.86  
1 1 1 -1  -5  22 o 10 264.03  41.22  2146.42   604.43   2146.42  604.43   0.00      0.00     264.03  41.22  ?       ?      0.00    41.22  
1 1 1 -1  -5  23 f 0  74.36   28.64  113.42    172.64   0.00     0.00     113.42    172.64   ?       ?      74.36   28.64  0.00    28.64  
1 1 1 -1  -5  24 o 17 251.25  28.33  1912.18   401.55   2183.64  558.51   1621.71   577.74   263.51  38.02  221.49  46.90  42.01   60.37  
1 1 1 -1  -5  25 o 9  71.30   19.81  154.17    83.97    163.09   95.75    124.49    174.73   73.49   21.40  75.19   28.85  -1.70   35.92  
1 1 1 -1  -5  26 o 8  66.83   20.14  134.03    83.63    135.59   94.92    128.62    176.77   67.85   21.63  75.39   29.00  -7.54   36.18  
1 1 1 -1  -5  27 o 7  258.96  30.86  2127.32   449.71   2479.93  626.89   1753.48   645.49   269.85  41.82  215.98  52.57  53.88   67.17  
1 1 1 -1  -5  28 o 14 109.35  17.85  364.00    108.17   427.92   126.19   186.87    210.06   118.26  19.25  83.89   31.77  34.37   37.15  
1 1 1 -1  -5  29 o 5  158.88  21.01  779.14    186.96   958.79   239.64   499.71    298.87   174.36  24.63  118.90  38.42  55.46   45.64  
1 1 1 -1  -5  30 f 0  74.46   19.49  175.05    84.28    195.85   91.93    65.55     210.97   78.56   20.25  70.68   29.97  7.88    36.17  
1 1 1 -1  -4  1  o 1  120.94  9.28   422.84    63.94    145.46   89.17    716.45    91.74    70.40   20.69  157.54  10.20  -87.14  23.07  
1 1 1 -1  -4  2  o 2  755.13  75.43  17855.91  3225.98  14394.69 4561.95  21318.00  4562.51  627.98  130.80 800.01  101.64 -172.03 165.64 
1 1 1 -1  -4  3  o 14 459.04  51.70  6351.98   1338.84  7410.90  1893.31  5292.85   1893.51  487.40  69.65  403.04  84.54  84.35   109.53 
1 1 1 -1  -4  4  o 8  600.70  62.99  11053.54  2139.75  11053.54 2139.75  0.00      0.00     600.70  62.99  ?       ?      0.00    62.99  
1 1 1 -1  -4  5  o 4  183.70  17.26  981.47    179.85   1093.95  220.18   755.94    311.78   193.60  20.10  157.77  35.31  35.83   40.63  
1 1 1 -1  -4  6  o 14 595.43  64.23  10965.98  2160.67  11333.32 3055.68  10598.65  3055.63  582.51  94.62  559.61  98.72  22.90   136.75 
1 1 1 -1  -4  7  o 16 705.32  79.41  16042.41  3159.53  16166.17 4468.24  15918.65  4468.25  662.56  121.97 655.91  123.19 6.65    173.36 
1 1 1 -1  -4  8  o 10 468.25  77.16  7186.23   2002.01  7186.23  2002.01  0.00      0.00     468.25  77.16  ?       ?      0.00    77.16  
1 1 1 -1  -4  9  o 12 176.23  26.54  926.01    260.17   926.01   260.17   0.00      0.00     176.23  26.54  ?       ?      0.00    26.54  
1 1 1 -1  -4  10 o 19 365.99  38.66  4055.91   800.01   4070.19  1131.15  4041.61   1131.63  356.19  57.26  354.74  57.54  1.45    81.18  
1 1 1 -1  -4  11 o 14 201.38  21.00  1194.04   239.21   1270.36  337.53   1117.02   339.06   205.41  29.47  191.60  31.95  13.81   43.46  
1 1 1 -1  -4  12 o 14 202.45  20.84  1207.95   238.79   1159.88  336.85   1256.51   338.56   195.30  31.09  203.87  29.81  -8.57   43.07  
1 1 1 -1  -4  13 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  -4  14 o 7  127.59  13.72  475.90    98.93    493.88   139.36   457.63    140.45   128.89  19.44  123.73  20.49  5.15    28.24  
1 1 1 -1  -4  15 o 11 255.82  39.59  2011.83   562.69   2011.83  562.69   0.00      0.00     255.82  39.59  ?       ?      0.00    39.59  
1 1 1 -1  -4  16 o 15 334.36  35.22  3342.94   665.87   3512.40  941.37   3173.25   941.99   336.16  50.33  317.66  53.56  18.50   73.49  
1 1 1 -1  -4  17 f 0  460.18  49.39  6442.65   1284.43  6839.96  1816.20  6045.12   1816.72  461.35  70.84  429.56  76.48  31.79   104.24 
1 1 1 -1  -4  18 o 16 82.36   17.07  203.00    78.07    203.00   78.07    0.00      0.00     82.36   17.07  ?       ?      0.00    17.07  
1 1 1 -1  -4  19 o 3  176.93  27.35  934.27    268.85   0.00     0.00     934.27    268.85   ?       ?      176.93  27.35  0.00    27.35  
1 1 1 -1  -4  20 o 15 395.15  65.65  5137.75   1436.92  0.00     0.00     5137.75   1436.92  ?       ?      395.15  65.65  0.00    65.65  
1 1 1 -1  -4  21 o 4  395.54  42.75  4793.25   955.30   5007.87  1348.33  4576.92   1353.69  391.57  62.05  371.23  65.94  20.34   90.54  
1 1 1 -1  -4  22 o 9  306.84  33.39  2819.93   578.65   3295.47  813.83   2333.72   822.92   327.03  44.50  269.47  55.06  57.55   70.80  
1 1 1 -1  -4  23 o 17 157.02  25.43  740.68    221.43   740.68   221.43   0.00      0.00     157.02  25.43  ?       ?      0.00    25.43  
1 1 1 -1  -4  24 o 17 214.97  34.18  1429.93   407.66   1429.93  407.66   0.00      0.00     214.97  34.18  ?       ?      0.00    34.18  
1 1 1 -1  -4  25 o 16 108.99  20.63  360.50    124.38   360.50   124.38   0.00      0.00     108.99  20.63  ?       ?      0.00    20.63  
1 1 1 -1  -4  26 o 6  206.21  23.45  1284.88   272.62   1566.88  380.29   986.75    391.01   224.46  30.29  172.32  40.26  52.13   50.38  
1 1 1 -1  -4  27 f 0  102.48  15.89  315.31    90.46    435.56   114.06   111.37    148.54   120.48  16.96  69.61   26.63  50.87   31.57  
1 1 1 -1  -4  28 o 1  46.54   17.84  45.53     66.78    17.36    78.64    118.33    126.43   44.62   18.57  67.52   24.83  -22.90  31.01  
1 1 1 -1  -4  29 o 17 115.63  16.59  404.70    106.95   567.49   136.75   148.28    171.63   136.78  17.84  75.64   28.70  61.14   33.79  
1 1 1 -1  -4  30 o 5  117.79  17.41  424.87    114.18   449.13   146.23   386.98    182.75   118.98  22.23  107.20  29.00  11.78   36.54  
1 1 1 -1  -4  31 o 5  63.20   19.68  123.46    79.02    116.94   93.34    139.96    148.46   62.82   21.51  71.14   26.76  -8.31   34.33  
1 1 1 -1  -3  1  o 11 461.18  35.16  6250.34   923.79   5246.76  1599.91  6752.26   1131.46  408.02  70.88  477.24  41.72  -69.22  82.24  
1 1 1 -1  -3  2  o 14 423.15  27.63  5218.39   667.42   4985.77  943.85   5451.03   943.89   409.97  40.64  429.46  38.70  -19.49  56.12  
1 1 1 -1  -3  3  o 3  412.94  27.15  4967.87   640.00   4726.84  905.09   5208.91   905.12   399.30  40.02  420.00  37.95  -20.70  55.15  
1 1 1 -1  -3  4  o 2  1253.47 119.12 54615.05  8468.75  53520.83 10372.02 56803.50  14668.39 1167.65 158.85 994.60  255.55 173.05  300.90 
1 1 1 -1  -3  5  o 2  824.27  169.48 27836.15  7751.41  0.00     0.00     27836.15  7751.41  ?       ?      824.27  169.48 0.00    169.48 
1 1 1 -1  -3  6  o 19 700.96  127.05 17683.07  4924.42  0.00     0.00     17683.07  4924.42  ?       ?      700.96  127.05 0.00    127.05 
1 1 1 -1  -3  7  o 16 345.13  52.94  3642.70   1015.41  0.00     0.00     3642.70   1015.41  ?       ?      345.13  52.94  0.00    52.94  
1 1 1 -1  -3  8  o 13 618.05  67.46  11953.79  2354.63  12015.64 3329.86  11891.93  3330.04  590.57  101.90 586.82  102.58 3.74    144.59 
1 1 1 -1  -3  9  o 9  316.35  32.56  2963.68   582.83   2863.09  824.06   3064.37   824.44   305.29  48.65  316.81  46.73  -11.52  67.46  
1 1 1 -1  -3  10 o 7  454.34  48.37  6322.77   1242.19  6175.78  1756.56  6469.82   1756.89  432.34  73.40  444.28  71.30  -11.94  102.32 
1 1 1 -1  -3  11 o 10 116.71  17.92  403.66    116.22   403.66   116.22   0.00      0.00     116.71  17.92  ?       ?      0.00    17.92  
1 1 1 -1  -3  12 o 11 164.70  24.99  812.68    228.87   812.68   228.87   0.00      0.00     164.70  24.99  ?       ?      0.00    24.99  
1 1 1 -1  -3  13 o 7  176.90  27.01  943.30    265.65   0.00     0.00     943.30    265.65   ?       ?      176.90  27.01  0.00    27.01  
1 1 1 -1  -3  14 o 9  267.79  27.84  2143.48   421.78   2079.29  596.30   2207.75   596.69   257.59  41.75  266.32  40.29  -8.72   58.02  
1 1 1 -1  -3  15 o 3  345.87  36.99  3646.20   723.15   3799.07  1022.44  3493.17   1022.94  342.72  53.73  326.41  56.64  16.31   78.08  
1 1 1 -1  -3  16 o 14 128.49  20.52  491.70    146.26   0.00     0.00     491.70    146.26   ?       ?      128.49  20.52  0.00    20.52  
1 1 1 -1  -3  17 o 15 381.45  40.68  4389.64   877.07   4885.54  1240.18  3893.44   1240.56  394.34  56.39  346.68  64.71  47.66   85.83  
1 1 1 -1  -3  18 o 12 202.99  21.21  1206.25   243.51   1340.06  343.29   1070.74   345.48   212.40  28.90  188.43  33.15  23.98   43.98  
1 1 1 -1  -3  19 o 19 227.31  23.72  1516.21   304.99   1687.74  429.67   1342.00   433.01   237.88  32.30  210.33  37.22  27.55   49.28  
1 1 1 -1  -3  20 o 15 359.00  38.07  3879.70   772.70   4227.48  1092.29  3531.32   1093.23  367.14  53.39  331.63  59.62  35.51   80.03  
1 1 1 -1  -3  21 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  -3  22 o 4  385.09  64.09  4887.27   1366.98  0.00     0.00     4887.27   1366.98  ?       ?      385.09  64.09  0.00    64.09  
1 1 1 -1  -3  23 o 3  121.78  16.43  436.87    111.94   412.17   144.80   473.53    176.45   117.03  22.37  125.00  25.45  -7.97   33.89  
1 1 1 -1  -3  24 o 3  64.69   16.87  126.01    63.27    134.43   76.99    108.50    111.04   67.08   19.09  65.44   23.38  1.64    30.18  
1 1 1 -1  -3  25 o 2  227.64  24.69  1555.57   317.44   1770.45  445.98   1334.91   451.93   238.93  33.43  203.66  40.08  35.27   52.19  
1 1 1 -1  -3  26 o 3  41.66   17.20  15.91     66.70    15.91    66.70    0.00      0.00     41.66   17.20  ?       ?      0.00    17.20  
1 1 1 -1  -3  27 o 18 211.74  35.17  1452.24   412.51   1452.24  412.51   0.00      0.00     211.74  35.17  ?       ?      0.00    35.17  
1 1 1 -1  -3  28 o 10 109.86  15.67  362.17    96.04    414.36   127.68   294.15    145.75   116.26  19.84  96.09   25.86  20.17   32.59  
1 1 1 -1  -3  29 o 10 126.91  16.72  486.04    118.82   683.04   159.92   243.29    177.52   149.80  19.02  88.21   29.66  61.59   35.24  
1 1 1 -1  -3  30 o 2  81.30   17.45  205.32    79.01    252.49   100.82   130.24    127.19   89.48   20.12  68.50   24.95  20.98   32.05  
1 1 1 -1  -3  31 f 0  51.01   18.98  65.27     74.28    81.93    94.53    38.38     120.13   56.85   21.36  54.90   22.91  1.95    31.32  
1 1 1 -1  -2  1  o 3  479.13  50.16  6900.76   1359.21  7039.93  1922.22  6761.59   1922.21  472.56  73.22  461.94  75.06  10.62   104.86 
1 1 1 -1  -2  2  o 18 183.93  13.52  978.88    141.76   914.00   200.46   1043.80   200.50   176.80  20.11  189.30  18.69  -12.50  27.45  
1 1 1 -1  -2  3  o 16 196.66  13.91  1118.74   156.03   1150.58  220.68   1086.92   220.65   198.70  19.60  192.98  20.22  5.72    28.16  
1 1 1 -1  -2  4  o 6  259.87  23.03  1968.43   340.02   2109.78  416.41   1685.66   588.98   268.28  27.42  235.15  45.27  33.13   52.93  
1 1 1 -1  -2  5  o 6  226.49  33.82  1528.13   426.29   1528.13  426.29   0.00      0.00     226.49  33.82  ?       ?      0.00    33.82  
1 1 1 -1  -2  6  o 14 804.50  91.21  21010.33  4138.26  20271.90 5852.37  21748.77  5852.41  731.11  144.56 765.98  138.18 -34.87  199.98 
1 1 1 -1  -2  7  o 10 954.83  115.80 31580.36  6217.61  31463.78 8793.01  31696.94  8793.05  847.18  185.92 851.90  185.10 -4.72   262.35 
1 1 1 -1  -2  8  o 14 120.69  18.32  429.73    122.94   0.00     0.00     429.73    122.94   ?       ?      120.69  18.32  0.00    18.32  
1 1 1 -1  -2  9  x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  -2  10 o 10 192.80  28.92  1108.67   310.26   0.00     0.00     1108.67   310.26   ?       ?      192.80  28.92  0.00    28.92  
1 1 1 -1  -2  11 o 17 79.04   8.84   181.91    39.41    141.89   55.54    222.48    55.92    68.84   14.51  87.15   11.45  -18.31  18.49  
1 1 1 -1  -2  12 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  -2  13 o 10 319.21  51.66  3279.75   914.32   3279.75  914.32   0.00      0.00     319.21  51.66  ?       ?      0.00    51.66  
1 1 1 -1  -2  14 o 18 196.56  30.10  1174.22   328.85   1174.22  328.85   0.00      0.00     196.56  30.10  ?       ?      0.00    30.10  
1 1 1 -1  -2  15 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  -2  16 o 10 296.65  47.23  2786.38   777.34   2786.38  777.34   0.00      0.00     296.65  47.23  ?       ?      0.00    47.23  
1 1 1 -1  -2  17 o 8  414.09  44.50  5266.43   1041.28  5679.70  1472.43  4852.98   1472.75  416.93  63.52  379.99  70.10  36.94   94.60  
1 1 1 -1  -2  18 f 0  132.91  14.15  515.06    106.28   562.81   148.79   465.31    151.86   138.13  19.29  124.84  21.99  13.29   29.25  
1 1 1 -1  -2  19 o 18 404.93  42.79  4935.46   979.70   5595.09  1385.42  4275.68   1385.58  423.34  58.58  363.69  68.89  59.65   90.42  
1 1 1 -1  -2  20 o 19 129.81  14.21  491.68    104.14   579.78   146.24   401.02    148.35   140.36  18.61  115.47  23.18  24.89   29.73  
1 1 1 -1  -2  21 o 10 327.47  34.55  3222.99   639.66   3495.36  904.38   2950.33   904.85   334.26  48.55  303.82  53.85  30.44   72.50  
1 1 1 -1  -2  22 o 16 204.14  21.51  1228.35   248.28   1399.44  349.88   1054.82   352.38   215.90  28.96  185.25  34.40  30.65   44.97  
1 1 1 -1  -2  23 o 9  174.07  27.97  912.26    270.02   0.00     0.00     912.26    270.02   ?       ?      174.07  27.97  0.00    27.97  
1 1 1 -1  -2  24 o 9  109.87  22.33  365.10    136.01   0.00     0.00     365.10    136.01   ?       ?      109.87  22.33  0.00    22.33  
1 1 1 -1  -2  25 f 0  32.51   14.23  -11.38    50.62    15.85    63.26    -59.85    84.39    40.82   16.79  37.51   17.22  3.31    24.05  
1 1 1 -1  -2  26 o 19 137.31  15.92  557.38    123.15   692.97   171.00   411.27    177.51   152.12  20.07  114.67  27.35  37.45   33.92  
1 1 1 -1  -2  27 o 9  112.28  15.73  376.02    98.62    439.92   122.86   260.27    165.36   120.89  18.27  91.80   28.45  29.09   33.81  
1 1 1 -1  -2  28 o 6  58.05   20.68  89.30     86.84    89.30    86.84    0.00      0.00     58.05   20.68  ?       ?      0.00    20.68  
1 1 1 -1  -2  29 o 19 78.91   22.08  195.57    103.93   195.57   103.93   0.00      0.00     78.91   22.08  ?       ?      0.00    22.08  
1 1 1 -1  -2  30 o 7  135.77  18.22  563.65    138.43   670.10   181.35   415.04    214.27   146.13  22.33  110.17  31.99  35.96   39.01  
1 1 1 -1  -2  31 o 19 68.31   20.77  146.85    88.66    156.02   106.64   126.32    159.56   70.63   22.96  70.42   27.43  0.21    35.77  
1 1 1 -1  -2  32 o 2  79.09   29.26  194.73    176.08   0.00     0.00     194.73    176.08   ?       ?      79.09   29.26  0.00    29.26  
1 1 1 -1  -1  1  o 14 190.00  19.24  1052.37   206.98   978.51   292.71   1126.25   292.73   181.31  29.11  195.28  26.82  -13.97  39.58  
1 1 1 -1  -1  2  o 6  403.66  41.78  4845.28   954.27   4885.42  1349.54  4805.14   1349.54  397.85  61.03  394.24  61.65  3.61    86.75  
1 1 1 -1  -1  3  o 1  253.39  21.40  1868.35   308.36   1796.18  436.08   1940.52   436.09   246.42  31.55  256.59  30.18  -10.16  43.66  
1 1 1 -1  -1  4  o 16 728.59  80.69  16851.39  3318.55  17351.26 4693.14  16351.52  4693.13  700.66  121.06 674.85  125.77 25.81   174.56 
1 1 1 -1  -1  5  o 7  520.18  54.86  8190.78   1613.67  7951.17  2282.07  8430.40   2282.09  496.80  82.94  513.70  79.99  -16.90  115.23 
1 1 1 -1  -1  6  o 12 518.37  54.64  8131.45   1601.57  8190.23  2264.94  8072.67   2264.97  505.72  80.73  501.56  81.46  4.16    114.68 
1 1 1 -1  -1  7  o 1  450.45  46.63  6070.33   1188.42  5687.56  1680.62  6453.14   1680.74  424.72  71.46  455.70  66.18  -30.98  97.40  
1 1 1 -1  -1  8  o 9  131.33  13.43  501.58    99.80    515.23   141.13   487.93    141.14   132.26  19.14  128.53  19.76  3.73    27.51  
1 1 1 -1  -1  9  o 17 449.89  46.96  6086.61   1195.10  5734.30  1690.06  6438.97   1690.19  424.11  71.99  452.75  67.06  -28.63  98.38  
1 1 1 -1  -1  10 o 11 343.67  35.50  3508.01   690.33   3412.79  976.20   3603.25   976.36   332.34  52.94  342.40  51.25  -10.05  73.68  
1 1 1 -1  -1  11 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  -1  12 o 8  114.79  17.53  390.18    111.87   0.00     0.00     390.18    111.87   ?       ?      114.79  17.53  0.00    17.53  
1 1 1 -1  -1  13 o 11 241.58  37.31  1793.66   500.77   0.00     0.00     1793.66   500.77   ?       ?      241.58  37.31  0.00    37.31  
1 1 1 -1  -1  14 o 6  78.06   9.06   177.81    39.84    157.46   55.07    200.15    57.71    72.62   13.71  82.31   12.62  -9.69   18.63  
1 1 1 -1  -1  15 o 17 346.47  37.19  3686.46   728.04   3967.41  1029.53  3405.44   1029.68  348.44  53.15  318.44  58.48  30.00   79.02  
1 1 1 -1  -1  16 o 1  341.18  56.74  3847.19   1072.32  3847.19  1072.32  0.00      0.00     341.18  56.74  ?       ?      0.00    56.74  
1 1 1 -1  -1  17 o 13 411.08  70.95  5792.14   1613.92  5792.14  1613.92  0.00      0.00     411.08  70.95  ?       ?      0.00    70.95  
1 1 1 -1  -1  18 f 0  149.39  22.63  663.56    187.99   663.56   187.99   0.00      0.00     149.39  22.63  ?       ?      0.00    22.63  
1 1 1 -1  -1  19 o 4  281.96  43.21  2425.04   677.14   2425.04  677.14   0.00      0.00     281.96  43.21  ?       ?      0.00    43.21  
1 1 1 -1  -1  20 o 2  431.04  70.42  6036.35   1682.33  6036.35  1682.33  0.00      0.00     431.04  70.42  ?       ?      0.00    70.42  
1 1 1 -1  -1  21 o 14 268.44  41.56  2215.99   619.77   2215.99  619.77   0.00      0.00     268.44  41.56  ?       ?      0.00    41.56  
1 1 1 -1  -1  22 o 11 307.07  49.15  2997.02   837.20   2997.02  837.20   0.00      0.00     307.07  49.15  ?       ?      0.00    49.15  
1 1 1 -1  -1  23 o 15 274.14  43.06  2339.94   655.33   2339.94  655.33   0.00      0.00     274.14  43.06  ?       ?      0.00    43.06  
1 1 1 -1  -1  24 o 16 322.70  52.22  3337.61   934.38   3337.61  934.38   0.00      0.00     322.70  52.22  ?       ?      0.00    52.22  
1 1 1 -1  -1  25 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  -1  26 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  -1  27 o 12 64.53   20.76  121.42    87.30    0.00     0.00     121.42    87.30    ?       ?      64.53   20.76  0.00    20.76  
1 1 1 -1  -1  28 o 8  159.96  27.29  807.69    241.65   0.00     0.00     807.69    241.65   ?       ?      159.96  27.29  0.00    27.29  
1 1 1 -1  -1  29 o 17 256.63  49.95  2514.07   709.40   2514.07  709.40   0.00      0.00     256.63  49.95  ?       ?      0.00    49.95  
1 1 1 -1  -1  30 o 14 93.29   24.03  281.30    129.46   281.30   129.46   0.00      0.00     93.29   24.03  ?       ?      0.00    24.03  
1 1 1 -1  -1  31 o 5  118.15  25.28  459.80    166.26   459.80   166.26   0.00      0.00     118.15  25.28  ?       ?      0.00    25.28  
1 1 1 -1  -1  32 o 6  124.80  26.73  529.68    185.74   529.68   185.74   0.00      0.00     124.80  26.73  ?       ?      0.00    26.73  
1 1 1 -1  0   1  f 0  424.88  66.41  5627.13   1566.91  0.00     0.00     5627.13   1566.91  ?       ?      424.88  66.41  0.00    66.41  
1 1 1 -1  0   2  o 4  221.81  33.05  1465.05   407.98   0.00     0.00     1465.05   407.98   ?       ?      221.81  33.05  0.00    33.05  
1 1 1 -1  0   3  o 18 767.08  84.06  18826.38  3641.04  19730.71 5149.23  17922.05  5149.18  742.53  125.25 697.96  133.37 44.57   182.97 
1 1 1 -1  0   4  o 8  235.62  35.19  1656.62   461.45   1656.62  461.45   0.00      0.00     235.62  35.19  ?       ?      0.00    35.19  
1 1 1 -1  0   5  o 5  550.01  58.10  9208.38   1806.85  8718.69  2555.26  9698.09   2555.29  515.95  89.52  548.72  83.77  -32.77  122.60 
1 1 1 -1  0   6  o 12 186.51  18.93  1014.01   199.91   1017.33  282.71   1010.69   282.72   185.29  27.40  184.65  27.51  0.64    38.83  
1 1 1 -1  0   7  o 9  348.93  35.76  3597.34   706.25   3183.53  998.75   4011.21   998.82   321.39  56.18  364.36  48.99  -42.97  74.54  
1 1 1 -1  0   8  o 6  309.70  46.95  2902.64   808.57   0.00     0.00     2902.64   808.57   ?       ?      309.70  46.95  0.00    46.95  
1 1 1 -1  0   9  o 9  441.74  46.17  5857.19   1153.47  5583.06  1631.19  6131.37   1631.31  419.69  70.18  442.35  66.28  -22.66  96.53  
1 1 1 -1  0   10 o 9  369.03  38.27  4056.87   799.03   3980.36  1129.95  4133.38   1130.03  357.93  56.89  365.46  55.61  -7.54   79.56  
1 1 1 -1  0   11 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  0   12 o 11 109.81  11.36  351.02    70.60    367.73   99.58    334.13    100.11   111.68  15.99  106.17  17.00  5.51    23.34  
1 1 1 -1  0   13 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  0   14 o 10 257.21  40.31  2063.74   575.60   0.00     0.00     2063.74   575.60   ?       ?      257.21  40.31  0.00    40.31  
1 1 1 -1  0   15 o 11 85.91   9.48   215.28    46.00    223.21   64.53    207.08    65.58    86.85   13.37  83.43   14.20  3.42    19.51  
1 1 1 -1  0   16 o 16 287.12  30.17  2486.03   489.93   2624.97  692.86   2347.09   692.88   288.23  43.20  270.51  46.28  17.72   63.31  
1 1 1 -1  0   17 o 10 118.82  12.48  412.11    83.87    441.27   118.13   382.48    119.08   122.10  17.34  113.16  19.00  8.94    25.73  
1 1 1 -1  0   18 o 4  129.42  19.77  497.35    142.20   497.35   142.20   0.00      0.00     129.42  19.77  ?       ?      0.00    19.77  
1 1 1 -1  0   19 o 18 358.22  56.74  4046.30   1128.01  4046.30  1128.01  0.00      0.00     358.22  56.74  ?       ?      0.00    56.74  
1 1 1 -1  0   20 o 17 426.91  45.15  5531.38   1089.73  5570.05  1541.03  5492.70   1541.20  415.75  66.83  412.41  67.43  3.33    94.94  
1 1 1 -1  0   21 f 0  91.03   11.12  242.18    56.93    267.15   77.35    212.68    84.08    95.11   14.64  84.13   17.96  10.98   23.17  
1 1 1 -1  0   22 o 1  605.09  72.86  12621.29  2480.13  13066.22 3507.43  12176.35  3507.44  554.35  114.02 525.92  118.97 28.43   164.79 
1 1 1 -1  0   23 o 18 377.44  64.09  4798.60   1338.95  4798.60  1338.95  0.00      0.00     377.44  64.09  ?       ?      0.00    64.09  
1 1 1 -1  0   24 o 19 271.68  28.49  2202.74   437.73   2244.44  618.10   2160.79   620.01   268.84  41.37  263.16  42.49  5.67    59.30  
1 1 1 -1  0   25 o 19 198.53  31.56  1208.10   347.70   0.00     0.00     1208.10   347.70   ?       ?      198.53  31.56  0.00    31.56  
1 1 1 -1  0   26 o 9  133.49  15.71  526.48    118.07   588.80   165.83   462.40    168.15   139.72  21.35  122.51  24.76  17.21   32.70  
1 1 1 -1  0   27 o 18 244.58  41.45  1986.40   561.15   0.00     0.00     1986.40   561.15   ?       ?      244.58  41.45  0.00    41.45  
1 1 1 -1  0   28 o 1  42.86   18.77  -15.07    88.05    0.00     0.00     -15.07    88.05    ?       ?      42.86   18.77  0.00    18.77  
1 1 1 -1  0   29 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  0   30 o 12 160.21  18.66  784.68    168.41   894.07   238.14   675.26    238.18   166.90  25.68  141.82  30.18  25.09   39.63  
1 1 1 -1  0   31 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  0   32 o 8  78.72   25.19  205.83    128.71   205.83   128.71   0.00      0.00     78.72   25.19  ?       ?      0.00    25.19  
1 1 1 -1  1   1  o 5  287.05  43.27  2480.71   690.86   0.00     0.00     2480.71   690.86   ?       ?      287.05  43.27  0.00    43.27  
1 1 1 -1  1   2  o 3  309.70  46.91  2901.31   807.91   0.00     0.00     2901.31   807.91   ?       ?      309.70  46.91  0.00    46.91  
1 1 1 -1  1   3  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  1   4  x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  1   5  o 4  657.10  115.77 15110.71  4207.53  15110.71 4207.53  0.00      0.00     657.10  115.77 ?       ?      0.00    115.77 
1 1 1 -1  1   6  o 1  528.72  86.33  9085.94   2530.01  9085.94  2530.01  0.00      0.00     528.72  86.33  ?       ?      0.00    86.33  
1 1 1 -1  1   7  o 10 389.25  60.26  4679.56   1303.13  4679.56  1303.13  0.00      0.00     389.25  60.26  ?       ?      0.00    60.26  
1 1 1 -1  1   8  o 3  229.66  23.38  1542.17   304.00   1578.54  429.90   1505.80   429.93   230.24  33.51  224.54  34.45  5.70    48.06  
1 1 1 -1  1   9  o 12 482.68  50.86  7046.51   1388.01  7147.44  1962.93  6945.58   1962.95  472.93  74.79  465.26  76.12  7.67    106.71 
1 1 1 -1  1   10 o 3  360.06  55.97  4018.71   1119.30  4018.71  1119.30  0.00      0.00     360.06  55.97  ?       ?      0.00    55.97  
1 1 1 -1  1   11 f 0  260.00  39.49  2048.88   570.96   0.00     0.00     2048.88   570.96   ?       ?      260.00  39.49  0.00    39.49  
1 1 1 -1  1   12 o 2  275.84  28.47  2255.25   444.29   2223.08  628.28   2287.43   628.37   269.00  42.06  273.22  41.35  -4.23   58.99  
1 1 1 -1  1   13 o 12 323.67  34.00  3159.55   622.28   3096.10  879.99   3223.02   880.08   311.48  50.98  318.65  49.73  -7.17   71.22  
1 1 1 -1  1   14 o 7  53.59   10.50  85.65     31.13    0.00     0.00     85.65     31.13    ?       ?      53.59   10.50  0.00    10.50  
1 1 1 -1  1   15 o 9  158.26  24.01  753.32    211.28   0.00     0.00     753.32    211.28   ?       ?      158.26  24.01  0.00    24.01  
1 1 1 -1  1   16 o 12 204.47  31.48  1280.17   357.69   0.00     0.00     1280.17   357.69   ?       ?      204.47  31.48  0.00    31.48  
1 1 1 -1  1   17 o 13 103.05  10.92  309.71    63.59    325.11   89.59    294.08    90.28    104.84  15.34  99.40   16.39  5.44    22.45  
1 1 1 -1  1   18 o 15 195.62  29.82  1154.72   324.26   0.00     0.00     1154.72   324.26   ?       ?      195.62  29.82  0.00    29.82  
1 1 1 -1  1   19 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  1   20 o 2  390.33  62.74  4872.74   1358.20  4872.74  1358.20  0.00      0.00     390.33  62.74  ?       ?      0.00    62.74  
1 1 1 -1  1   21 o 12 207.92  31.62  1301.38   365.49   1301.38  365.49   0.00      0.00     207.92  31.62  ?       ?      0.00    31.62  
1 1 1 -1  1   22 o 5  282.57  29.60  2388.94   473.03   2311.00  668.99   2466.88   668.95   271.23  44.51  281.29  42.77  -10.06  61.73  
1 1 1 -1  1   23 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  1   24 o 3  246.79  25.85  1810.59   360.81   1766.24  510.61   1854.82   509.93   238.88  38.55  245.43  37.37  -6.54   53.69  
1 1 1 -1  1   25 o 18 357.46  38.34  3946.57   774.56   4154.52  1095.78  3738.91   1095.02  353.80  55.80  332.27  59.60  21.53   81.64  
1 1 1 -1  1   26 o 7  163.76  17.63  793.70    163.10   801.07   232.04   786.50    229.29   161.83  25.85  160.35  25.78  1.48    36.51  
1 1 1 -1  1   27 o 10 87.88   12.77  229.14    62.55    284.43   93.43    184.24    84.20    96.97   17.42  77.47   19.06  19.50   25.83  
1 1 1 -1  1   28 o 11 107.36  14.16  343.10    85.14    300.51   128.55   376.38    113.64   97.80   23.24  111.25  18.44  -13.45  29.67  
1 1 1 -1  1   29 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  1   30 o 7  73.93   18.42  171.42    77.88    0.00     0.00     171.42    77.88    ?       ?      73.93   18.42  0.00    18.42  
1 1 1 -1  1   31 o 15 93.27   15.72  267.44    81.19    370.43   126.49   195.29    105.87   107.61  21.23  77.71   22.47  29.90   30.91  
1 1 1 -1  1   32 o 2  151.25  19.23  721.19    163.18   644.46   233.20   794.81    228.42   133.75  30.98  152.67  27.05  -18.92  41.13  
1 1 1 -1  2   1  o 12 553.03  58.70  9319.86   1835.09  9030.85  2595.21  9608.87   2595.22  525.47  89.22  544.71  85.83  -19.25  123.80 
1 1 1 -1  2   2  o 9  569.64  60.70  9923.61   1954.51  9867.93  2764.10  9979.29   2764.09  548.28  91.01  551.89  90.37  -3.61   128.25 
1 1 1 -1  2   3  o 11 584.10  98.11  11396.11  3173.31  0.00     0.00     11396.11  3173.31  ?       ?      584.10  98.11  0.00    98.11  
1 1 1 -1  2   4  o 15 558.13  54.81  9428.33   1733.50  7708.30  2451.50  11148.48  2451.58  482.54  91.85  595.93  73.20  -113.39 117.45 
1 1 1 -1  2   5  o 1  160.61  23.75  762.50    212.38   762.50   212.38   0.00      0.00     160.61  23.75  ?       ?      0.00    23.75  
1 1 1 -1  2   6  o 7  369.42  56.88  4192.88   1167.54  4192.88  1167.54  0.00      0.00     369.42  56.88  ?       ?      0.00    56.88  
1 1 1 -1  2   7  o 19 455.52  72.24  6557.70   1826.04  6557.70  1826.04  0.00      0.00     455.52  72.24  ?       ?      0.00    72.24  
1 1 1 -1  2   8  o 10 223.53  22.77  1460.63   288.16   1505.01  407.52   1416.24   407.53   224.89  32.51  217.75  33.69  7.14    46.82  
1 1 1 -1  2   9  o 3  222.21  22.62  1444.40   284.58   1462.26  402.46   1426.54   402.46   221.40  32.64  218.51  33.12  2.89    46.50  
1 1 1 -1  2   10 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  2   11 o 15 194.27  19.80  1104.29   217.73   1180.79  307.91   1027.79   307.92   199.24  27.67  185.06  30.01  14.18   40.82  
1 1 1 -1  2   12 o 16 319.88  50.40  3213.05   895.00   3213.05  895.00   0.00      0.00     319.88  50.40  ?       ?      0.00    50.40  
1 1 1 -1  2   13 o 18 252.30  26.10  1891.07   372.62   1918.92  526.95   1863.21   526.99   249.67  37.96  245.66  38.64  4.01    54.17  
1 1 1 -1  2   14 o 3  190.63  19.58  1071.00   211.27   1111.93  298.74   1030.04   298.83   191.79  27.96  184.03  29.27  7.77    40.47  
1 1 1 -1  2   15 o 11 160.30  16.47  754.69    149.37   757.33   211.12   752.05    211.37   158.65  23.92  158.05  24.05  0.60    33.93  
1 1 1 -1  2   16 o 2  112.61  17.19  377.23    107.59   0.00     0.00     377.23    107.59   ?       ?      112.61  17.19  0.00    17.19  
1 1 1 -1  2   17 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  2   18 o 8  311.04  32.42  2907.76   570.38   3336.81  806.87   2479.20   806.41   327.57  44.02  277.13  52.61  50.44   68.60  
1 1 1 -1  2   19 o 1  233.87  24.11  1611.02   319.08   1573.61  451.46   1648.36   451.03   227.75  35.70  233.53  34.70  -5.79   49.78  
1 1 1 -1  2   20 o 7  265.69  27.35  2084.74   411.17   2161.39  581.69   2008.20   581.27   266.83  39.14  256.41  40.86  10.42   56.58  
1 1 1 -1  2   21 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  2   22 o 11 231.93  36.01  1651.66   463.87   1651.66  463.87   0.00      0.00     231.93  36.01  ?       ?      0.00    36.01  
1 1 1 -1  2   23 o 17 376.97  40.63  4406.66   865.34   4620.48  1224.13  4193.09   1223.41  371.43  59.41  350.39  63.14  21.04   86.70  
1 1 1 -1  2   24 o 16 238.23  24.87  1685.94   335.16   1781.97  474.95   1590.68   473.02   241.05  35.38  226.54  37.70  14.51   51.70  
1 1 1 -1  2   25 o 15 329.74  35.09  3328.77   654.01   3508.96  925.39   3148.95   924.44   328.13  50.76  308.02  54.26  20.11   74.31  
1 1 1 -1  2   26 o 8  369.85  42.02  4422.47   876.36   4321.16  1239.75  4523.66   1238.98  339.88  65.92  350.32  63.96  -10.44  91.85  
1 1 1 -1  2   27 o 3  156.40  26.51  761.09    229.53   761.09   229.53   0.00      0.00     156.40  26.51  ?       ?      0.00    26.51  
1 1 1 -1  2   28 o 15 138.30  24.72  599.11    189.07   599.11   189.07   0.00      0.00     138.30  24.72  ?       ?      0.00    24.72  
1 1 1 -1  2   29 o 10 131.33  16.32  520.03    120.39   450.40   176.49   580.62    164.63   117.63  26.74  136.51  21.74  -18.88  34.46  
1 1 1 -1  2   30 o 1  166.91  29.01  926.24    267.91   0.00     0.00     926.24    267.91   ?       ?      166.91  29.01  0.00    29.01  
1 1 1 -1  2   31 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  2   32 o 3  112.05  15.83  388.29    99.00    455.19   160.58   347.27    125.74   115.92  24.87  102.60  22.01  13.33   33.21  
1 1 1 -1  2   33 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  3   1  o 14 371.14  57.11  4228.33   1177.73  4228.33  1177.73  0.00      0.00     371.14  57.11  ?       ?      0.00    57.11  
1 1 1 -1  3   2  o 17 398.56  41.25  4722.91   930.22   4834.99  1315.54  4610.84   1315.51  396.16  59.70  385.94  61.43  10.21   85.66  
1 1 1 -1  3   3  o 17 153.92  15.67  689.60    136.56   622.27   193.05   757.02    193.20   144.71  24.08  160.43  21.52  -15.72  32.30  
1 1 1 -1  3   4  o 13 462.50  39.27  6327.40   1032.67  6219.68  1788.68  6381.27   1264.75  443.33  72.81  460.95  48.52  -17.62  87.50  
1 1 1 -1  3   5  o 1  165.00  12.33  787.61    115.97   670.03   200.73   846.52    142.08   150.28  24.08  170.83  14.63  -20.55  28.18  
1 1 1 -1  3   6  o 5  286.11  29.24  2404.85   473.54   2532.11  669.69   2277.60   669.68   290.48  41.33  274.43  43.99  16.05   60.36  
1 1 1 -1  3   7  o 8  596.97  64.13  10996.17  2163.25  10874.83 3059.28  11117.50  3059.30  569.70  97.02  577.23  95.67  -7.54   136.25 
1 1 1 -1  3   8  o 1  218.82  22.25  1399.87   275.61   1393.99  389.76   1405.74   389.79   216.19  32.40  217.15  32.25  -0.97   45.71  
1 1 1 -1  3   9  o 14 196.90  29.35  1154.41   321.63   1154.41  321.63   0.00      0.00     196.90  29.35  ?       ?      0.00    29.35  
1 1 1 -1  3   10 o 8  352.00  55.00  3860.40   1075.13  0.00     0.00     3860.40   1075.13  ?       ?      352.00  55.00  0.00    55.00  
1 1 1 -1  3   11 o 4  280.59  28.93  2331.46   459.29   2337.64  649.53   2325.28   649.55   276.32  42.29  275.52  42.43  0.80    59.90  
1 1 1 -1  3   12 o 9  99.57   10.13  288.45    57.11    265.08   80.66    311.94    80.88    94.55   15.39  102.99  14.04  -8.44   20.83  
1 1 1 -1  3   13 o 14 243.56  25.23  1762.28   347.64   1824.71  491.62   1699.84   491.66   243.71  36.24  234.40  37.83  9.31    52.39  
1 1 1 -1  3   14 o 18 166.60  17.06  815.25    160.86   757.10   227.43   873.47    227.57   158.13  25.95  170.73  23.87  -12.60  35.26  
1 1 1 -1  3   15 o 10 191.90  19.80  1088.32   214.97   1024.70  303.89   1152.05   304.15   182.83  29.99  194.84  28.00  -12.00  41.03  
1 1 1 -1  3   16 o 16 121.88  18.45  442.76    125.03   0.00     0.00     442.76    125.03   ?       ?      121.88  18.45  0.00    18.45  
1 1 1 -1  3   17 o 12 210.88  32.48  1361.62   380.58   0.00     0.00     1361.62   380.58   ?       ?      210.88  32.48  0.00    32.48  
1 1 1 -1  3   18 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  3   19 o 13 158.03  16.35  729.74    146.17   752.49   206.75   707.01    206.67   159.10  23.33  153.92  24.19  5.17    33.60  
1 1 1 -1  3   20 o 13 465.69  50.18  6697.43   1320.43  6603.19  1867.37  6791.68   1867.38  443.37  76.11  450.87  74.76  -7.51   106.69 
1 1 1 -1  3   21 o 3  286.83  29.85  2449.07   484.27   2401.46  685.11   2496.60   684.60   278.23  44.38  284.28  43.32  -6.04   62.02  
1 1 1 -1  3   22 o 12 181.35  27.99  994.15    282.05   994.15   282.05   0.00      0.00     181.35  27.99  ?       ?      0.00    27.99  
1 1 1 -1  3   23 o 2  195.62  30.59  1167.99   332.25   1167.99  332.25   0.00      0.00     195.62  30.59  ?       ?      0.00    30.59  
1 1 1 -1  3   24 o 17 175.69  18.44  908.03    183.24   1010.36  262.08   810.15    256.31   183.50  25.57  163.13  28.40  20.37   38.22  
1 1 1 -1  3   25 o 10 231.90  24.38  1604.45   319.72   1634.08  453.27   1575.11   451.05   229.39  35.57  224.86  36.17  4.53    50.73  
1 1 1 -1  3   26 o 17 191.30  20.76  1093.66   224.29   1011.67  318.53   1174.27   315.86   179.15  32.15  194.77  29.14  -15.62  43.40  
1 1 1 -1  3   27 o 3  169.28  28.19  899.97    264.32   899.97   264.32   0.00      0.00     169.28  28.19  ?       ?      0.00    28.19  
1 1 1 -1  3   28 f 0  103.30  14.39  319.03    83.02    268.22   122.77   361.84    112.70   92.16   23.22  108.77  18.72  -16.61  29.83  
1 1 1 -1  3   29 o 8  179.51  20.60  992.15    208.48   889.64   297.23   1091.42   292.48   161.66  33.14  182.85  28.82  -21.19  43.92  
1 1 1 -1  3   30 o 2  83.88   16.67  218.27    77.45    241.83   125.38   203.72    98.49    86.02   24.32  79.73   21.17  6.29    32.24  
1 1 1 -1  3   31 o 9  125.38  17.30  486.63    121.24   401.90   181.49   554.90    162.92   107.32  28.84  130.99  22.47  -23.67  36.57  
1 1 1 -1  3   32 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  3   33 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  4   1  o 14 90.83   14.08  243.06    71.04    243.06   71.04    0.00      0.00     90.83   14.08  ?       ?      0.00    14.08  
1 1 1 -1  4   2  o 3  423.02  43.96  5339.02   1051.90  5173.18  1487.60  5504.86   1487.62  407.10  65.90  421.37  63.47  -14.27  91.50  
1 1 1 -1  4   3  o 18 727.80  80.68  16865.67  3314.32  16954.44 4687.25  16776.92  4687.06  688.10  123.18 683.51  124.02 4.59    174.80 
1 1 1 -1  4   4  o 9  666.71  54.67  13428.32  2073.90  14394.08 3592.20  12945.48  2539.97  656.42  98.35  644.70  69.74  11.72   120.57 
1 1 1 -1  4   5  o 8  567.96  38.21  9511.60   1238.60  9596.96  1751.65  9426.24   1751.65  562.72  54.92  557.36  55.48  5.37    78.07  
1 1 1 -1  4   6  o 10 176.85  17.93  911.49    179.52   890.75   253.88   932.23    253.89   173.30  26.35  177.51  25.66  -4.21   36.78  
1 1 1 -1  4   7  f 0  485.86  51.28  7150.60   1408.60  7474.95  1992.07  6826.27   1992.05  483.88  74.07  459.38  78.35  24.50   107.81 
1 1 1 -1  4   8  o 13 399.41  41.59  4774.25   939.68   4692.02  1328.90  4856.48   1328.91  386.73  61.95  394.24  60.66  -7.50   86.70  
1 1 1 -1  4   9  x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  4   10 o 16 127.73  13.00  475.03    94.00    482.57   132.91   467.49    132.96   127.80  18.67  125.68  19.02  2.12    26.65  
1 1 1 -1  4   11 o 5  167.55  17.12  821.07    162.32   840.30   229.53   801.83    229.59   167.93  24.53  163.79  25.23  4.13    35.19  
1 1 1 -1  4   12 o 3  123.24  12.65  443.06    88.20    467.83   124.73   418.29    124.74   125.73  17.78  118.51  18.98  7.22    26.00  
1 1 1 -1  4   13 o 12 166.37  17.00  812.49    160.12   802.28   226.38   822.72    226.51   163.27  24.94  165.48  24.59  -2.21   35.03  
1 1 1 -1  4   14 o 13 278.42  29.30  2340.16   461.32   2358.86  652.38   2321.45   652.43   272.12  43.20  269.65  43.64  2.46    61.41  
1 1 1 -1  4   15 o 2  168.00  17.27  830.66    164.21   840.10   232.18   821.22    232.29   166.79  25.02  164.75  25.37  2.03    35.63  
1 1 1 -1  4   16 o 4  311.21  33.15  2956.73   583.16   2998.49  824.75   2914.98   824.66   303.29  49.04  298.35  49.91  4.94    69.97  
1 1 1 -1  4   17 o 17 248.51  38.89  1922.74   536.60   0.00     0.00     1922.74   536.60   ?       ?      248.51  38.89  0.00    38.89  
1 1 1 -1  4   18 o 1  334.89  54.06  3601.74   1003.97  0.00     0.00     3601.74   1003.97  ?       ?      334.89  54.06  0.00    54.06  
1 1 1 -1  4   19 o 4  38.83   13.23  39.97     35.34    0.00     0.00     39.97     35.34    ?       ?      38.83   13.23  0.00    13.23  
1 1 1 -1  4   20 o 17 318.67  33.21  3033.03   598.70   2940.71  846.68   3125.35   846.69   306.60  49.81  317.14  48.01  -10.55  69.18  
1 1 1 -1  4   21 o 5  322.25  51.56  3303.65   921.70   3303.65  921.70   0.00      0.00     322.25  51.56  ?       ?      0.00    51.56  
1 1 1 -1  4   22 o 2  164.19  25.45  812.65    232.10   812.65   232.10   0.00      0.00     164.19  25.45  ?       ?      0.00    25.45  
1 1 1 -1  4   23 o 10 50.79   17.60  67.86     62.56    67.86    62.56    0.00      0.00     50.79   17.60  ?       ?      0.00    17.60  
1 1 1 -1  4   24 o 17 156.05  25.17  735.08    217.78   735.08   217.78   0.00      0.00     156.05  25.17  ?       ?      0.00    25.17  
1 1 1 -1  4   25 o 17 82.64   19.15  207.67    89.09    0.00     0.00     207.67    89.09    ?       ?      82.64   19.15  0.00    19.15  
1 1 1 -1  4   26 f 0  119.77  14.00  423.35    94.45    463.56   138.20   388.11    129.38   123.72  20.15  112.81  20.74  10.91   28.92  
1 1 1 -1  4   27 o 10 89.02   12.85  235.64    63.78    203.30   98.32    259.14    83.82    80.94   20.99  92.54   16.38  -11.60  26.62  
1 1 1 -1  4   28 o 4  118.14  14.44  416.39    95.87    369.70   142.65   454.85    129.46   108.01  23.66  121.92  19.13  -13.91  30.43  
1 1 1 -1  4   29 f 0  202.72  36.33  1442.27   407.22   0.00     0.00     1442.27   407.22   ?       ?      202.72  36.33  0.00    36.33  
1 1 1 -1  4   30 o 11 43.18   16.28  43.43     54.99    7.88     91.72    63.38     68.70    45.74   19.59  49.73   18.30  -3.99   26.81  
1 1 1 -1  4   31 o 12 95.10   15.26  278.88    80.49    289.82   122.67   270.60    106.67   93.38   23.03  91.19   20.83  2.19    31.06  
1 1 1 -1  4   32 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  4   33 o 3  54.47   19.70  87.47     79.12    0.00     0.00     87.47     79.12    ?       ?      54.47   19.70  0.00    19.70  
1 1 1 -1  5   1  o 19 472.85  75.33  7095.08   1976.35  7095.08  1976.35  0.00      0.00     472.85  75.33  ?       ?      0.00    75.33  
1 1 1 -1  5   2  o 12 322.51  49.08  3157.65   880.06   3157.65  880.06   0.00      0.00     322.51  49.08  ?       ?      0.00    49.08  
1 1 1 -1  5   3  o 6  151.67  16.25  670.51    139.32   588.37   197.69   751.56    196.37   140.35  25.47  159.74  22.00  -19.39  33.66  
1 1 1 -1  5   4  o 14 326.17  24.35  3099.90   452.59   3540.88  784.11   2879.59   554.24   344.50  40.42  312.76  31.29  31.74   51.11  
1 1 1 -1  5   5  o 15 496.24  34.45  7244.58   975.22   7315.59  1379.17  7173.56   1379.18  492.45  49.46  487.34  50.01  5.11    70.33  
1 1 1 -1  5   6  o 3  210.11  18.79  1285.24   224.28   1476.40  388.29   1189.54   274.74   222.78  31.22  201.08  24.29  21.69   39.56  
1 1 1 -1  5   7  o 15 224.08  22.85  1470.81   289.88   1476.63  409.95   1464.99   409.95   222.13  33.16  221.20  33.32  0.94    47.01  
1 1 1 -1  5   8  o 14 245.11  37.04  1812.54   505.01   1812.54  505.01   0.00      0.00     245.11  37.04  ?       ?      0.00    37.04  
1 1 1 -1  5   9  o 12 427.51  70.59  6003.47   1671.92  0.00     0.00     6003.47   1671.92  ?       ?      427.51  70.59  0.00    70.59  
1 1 1 -1  5   10 o 6  175.36  17.88  900.12    177.46   896.70   250.95   903.54    250.98   173.19  26.05  173.89  25.93  -0.70   36.76  
1 1 1 -1  5   11 o 5  240.77  24.82  1718.32   338.09   1693.32  478.09   1743.32   478.16   234.75  36.67  238.52  36.05  -3.76   51.42  
1 1 1 -1  5   12 o 19 178.89  18.32  940.93    185.45   935.25   262.23   946.61    262.31   176.03  26.79  177.17  26.61  -1.14   37.76  
1 1 1 -1  5   13 o 10 190.88  19.52  1075.26   210.83   1029.47  298.08   1121.08   298.24   183.67  29.25  192.35  27.82  -8.67   40.37  
1 1 1 -1  5   14 o 10 281.75  29.54  2403.76   470.77   2290.42  665.70   2517.13   665.83   266.16  45.18  280.92  42.62  -14.76  62.11  
1 1 1 -1  5   15 o 18 269.39  28.15  2189.33   428.98   2095.64  606.59   2283.07   606.74   255.75  42.83  268.49  40.64  -12.73  59.04  
1 1 1 -1  5   16 o 2  194.05  20.04  1112.37   220.05   1111.02  311.44   1113.71   310.95   190.96  29.35  191.23  29.25  -0.27   41.44  
1 1 1 -1  5   17 o 14 201.07  30.75  1228.30   343.65   0.00     0.00     1228.30   343.65   ?       ?      201.07  30.75  0.00    30.75  
1 1 1 -1  5   18 o 17 215.71  32.89  1409.22   394.38   0.00     0.00     1409.22   394.38   ?       ?      215.71  32.89  0.00    32.89  
1 1 1 -1  5   19 o 1  335.08  53.08  3540.04   987.07   0.00     0.00     3540.04   987.07   ?       ?      335.08  53.08  0.00    53.08  
1 1 1 -1  5   20 o 6  358.18  37.91  3876.79   767.71   4194.55  1085.93  3559.30   1085.47  364.16  53.54  331.67  59.18  32.50   79.81  
1 1 1 -1  5   21 o 4  567.91  67.60  10961.58  2160.61  11287.25 3055.64  10635.94  3055.50  523.22  105.38 501.13  109.30 22.09   151.83 
1 1 1 -1  5   22 o 15 125.74  20.24  473.62    141.13   0.00     0.00     473.62    141.13   ?       ?      125.74  20.24  0.00    20.24  
1 1 1 -1  5   23 o 2  187.97  29.53  1077.76   308.15   1077.76  308.15   0.00      0.00     187.97  29.53  ?       ?      0.00    29.53  
1 1 1 -1  5   24 o 10 237.01  37.70  1753.90   495.82   1753.90  495.82   0.00      0.00     237.01  37.70  ?       ?      0.00    37.70  
1 1 1 -1  5   25 o 4  399.26  82.44  6550.23   1826.89  6550.23  1826.89  0.00      0.00     399.26  82.44  ?       ?      0.00    82.44  
1 1 1 -1  5   26 o 3  227.60  24.55  1578.98   315.66   1608.99  447.73   1549.32   445.09   222.54  36.30  217.89  36.90  4.65    51.76  
1 1 1 -1  5   27 o 4  228.68  39.78  1780.39   503.30   1780.39  503.30   0.00      0.00     228.68  39.78  ?       ?      0.00    39.78  
1 1 1 -1  5   28 o 2  52.29   16.05  81.63     52.80    35.87    78.41    119.58    71.42    47.17   18.95  62.53   18.56  -15.35  26.52  
1 1 1 -1  5   29 o 12 75.92   15.82  178.30    66.71    113.79   96.29    237.83    92.51    62.64   21.82  86.85   19.08  -24.21  28.99  
1 1 1 -1  5   30 o 14 41.57   15.85  38.79     52.48    23.78    90.57    46.38     64.39    47.36   19.83  45.56   17.51  1.81    26.46  
1 1 1 -1  5   31 o 2  119.01  25.01  480.58    165.43   480.58   165.43   0.00      0.00     119.01  25.01  ?       ?      0.00    25.01  
1 1 1 -1  5   32 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  6   1  o 2  891.70  109.25 27795.75  5475.52  27381.97 7743.55  28209.54  7743.56  779.07  177.16 797.02  174.12 -17.95  248.41 
1 1 1 -1  6   2  o 2  1417.99 161.73 84682.91  12929.89 89439.98 22395.38 82304.41  15835.75 822.04  323.50 1202.61 237.81 -380.58 401.50 
1 1 1 -1  6   3  o 14 791.18  185.95 29813.25  8301.74  0.00     0.00     29813.25  8301.74  ?       ?      791.18  185.95 0.00    185.95 
1 1 1 -1  6   4  o 8  598.68  106.91 12709.62  3539.32  0.00     0.00     12709.62  3539.32  ?       ?      598.68  106.91 0.00    106.91 
1 1 1 -1  6   5  o 12 258.78  23.83  1960.31   350.02   2354.63  495.61   1567.92   494.40   282.02  31.13  227.19  39.33  54.83   50.16  
1 1 1 -1  6   6  o 17 246.41  22.84  1777.46   319.43   2132.24  452.36   1424.61   451.12   268.36  29.87  216.56  37.65  51.79   48.06  
1 1 1 -1  6   7  o 9  456.69  76.57  6952.89   1936.38  0.00     0.00     6952.89   1936.38  ?       ?      456.69  76.57  0.00    76.57  
1 1 1 -1  6   8  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  6   9  x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  6   10 o 13 216.65  33.14  1431.50   399.09   0.00     0.00     1431.50   399.09   ?       ?      216.65  33.14  0.00    33.14  
1 1 1 -1  6   11 o 18 259.70  40.88  2115.01   589.38   0.00     0.00     2115.01   589.38   ?       ?      259.70  40.88  0.00    40.88  
1 1 1 -1  6   12 o 18 122.19  18.34  444.67    124.69   0.00     0.00     444.67    124.69   ?       ?      122.19  18.34  0.00    18.34  
1 1 1 -1  6   13 o 16 112.23  16.92  374.72    105.60   0.00     0.00     374.72    105.60   ?       ?      112.23  16.92  0.00    16.92  
1 1 1 -1  6   14 o 16 228.02  35.75  1622.92   452.57   0.00     0.00     1622.92   452.57   ?       ?      228.02  35.75  0.00    35.75  
1 1 1 -1  6   15 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  6   16 o 16 57.09   12.33  97.77     39.23    0.00     0.00     97.77     39.23    ?       ?      57.09   12.33  0.00    12.33  
1 1 1 -1  6   17 o 12 201.61  30.71  1229.61   344.24   0.00     0.00     1229.61   344.24   ?       ?      201.61  30.71  0.00    30.71  
1 1 1 -1  6   18 o 13 390.65  64.36  4998.84   1392.99  0.00     0.00     4998.84   1392.99  ?       ?      390.65  64.36  0.00    64.36  
1 1 1 -1  6   19 o 18 277.29  28.92  2283.48   453.66   2377.46  641.81   2189.64   641.34   278.34  41.43  266.06  43.49  12.28   60.06  
1 1 1 -1  6   20 o 13 155.24  16.26  705.37    142.73   708.95   202.33   701.83    201.37   154.02  23.64  153.23  23.65  0.79    33.44  
1 1 1 -1  6   21 o 6  474.22  54.33  7363.64   1452.35  7421.26  2053.94  7306.02   2053.94  441.14  84.18  436.51  85.02  4.63    119.64 
1 1 1 -1  6   22 o 13 148.60  23.99  667.29    197.65   667.29   197.65   0.00      0.00     148.60  23.99  ?       ?      0.00    23.99  
1 1 1 -1  6   23 o 1  52.16   20.10  53.35     84.99    53.35    84.99    0.00      0.00     52.16   20.10  ?       ?      0.00    20.10  
1 1 1 -1  6   24 o 5  90.52   21.88  250.47    112.41   250.47   112.41   0.00      0.00     90.52   21.88  ?       ?      0.00    21.88  
1 1 1 -1  6   25 o 1  260.35  43.84  2253.55   631.94   0.00     0.00     2253.55   631.94   ?       ?      260.35  43.84  0.00    43.84  
1 1 1 -1  6   26 o 16 252.83  27.77  1991.68   396.44   1914.64  561.72   2068.13   559.58   235.65  43.11  247.13  40.87  -11.48  59.41  
1 1 1 -1  6   27 o 18 162.39  18.11  795.09    165.95   813.68   236.88   777.16    232.57   160.05  26.72  156.25  26.90  3.80    37.92  
1 1 1 -1  6   28 o 8  97.12   14.45  284.83    78.12    322.27   116.81   254.54    105.07   101.07  20.83  89.62   20.82  11.45   29.45  
1 1 1 -1  6   29 o 16 203.36  23.60  1324.18   270.35   1190.95  384.81   1454.03   379.90   178.04  38.75  203.00  33.79  -24.96  51.41  
1 1 1 -1  6   30 o 18 109.61  15.58  369.69    95.30    358.55   142.80   378.63    127.96   103.24  24.47  107.95  21.40  -4.71   32.51  
1 1 1 -1  6   31 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  6   32 o 2  33.82   15.56  -39.72    69.42    -44.87   114.85   -36.75    87.13    43.96   20.14  38.70   17.66  5.26    26.79  
1 1 1 -1  7   1  o 11 569.03  103.76 11720.71  3264.73  0.00     0.00     11720.71  3264.73  ?       ?      569.03  103.76 0.00    103.76 
1 1 1 -1  7   2  o 18 595.92  112.66 13330.73  3712.95  0.00     0.00     13330.73  3712.95  ?       ?      595.92  112.66 0.00    112.66 
1 1 1 -1  7   3  o 12 244.38  37.17  1806.86   505.09   0.00     0.00     1806.86   505.09   ?       ?      244.38  37.17  0.00    37.17  
1 1 1 -1  7   4  o 10 421.28  69.30  5805.32   1617.69  0.00     0.00     5805.32   1617.69  ?       ?      421.28  69.30  0.00    69.30  
1 1 1 -1  7   5  o 10 500.15  34.19  7438.65   975.74   7510.80  1379.93  7366.50   1379.88  493.52  49.37  488.34  49.92  5.18    70.21  
1 1 1 -1  7   6  o 11 409.01  35.66  5016.53   828.84   5026.39  1015.20  4996.82   1435.35  404.76  44.42  388.81  66.71  15.95   80.14  
1 1 1 -1  7   7  o 1  455.69  81.40  7365.25   2051.25  7365.25  2051.25  0.00      0.00     455.69  81.40  ?       ?      0.00    81.40  
1 1 1 -1  7   8  o 6  78.67   12.07  182.69    52.76    0.00     0.00     182.69    52.76    ?       ?      78.67   12.07  0.00    12.07  
1 1 1 -1  7   9  o 5  112.68  8.31   367.46    53.38    286.95   90.61    410.25    66.06    98.10   16.69  118.92  9.76   -20.82  19.33  
1 1 1 -1  7   10 o 7  202.72  31.11  1256.47   350.47   1256.47  350.47   0.00      0.00     202.72  31.11  ?       ?      0.00    31.11  
1 1 1 -1  7   11 o 10 103.61  10.75  313.20    63.01    345.65   89.06    280.68    89.15    108.19  14.72  96.91   16.62  11.28   22.20  
1 1 1 -1  7   12 o 17 141.68  14.54  588.47    116.57   590.01   164.79   586.92    164.91   140.29  21.12  139.89  21.20  0.40    29.92  
1 1 1 -1  7   13 o 19 256.73  26.80  1982.35   389.19   1914.37  550.35   2050.35   550.45   245.41  40.47  255.09  38.81  -9.68   56.08  
1 1 1 -1  7   14 o 12 190.62  19.56  1073.07   211.03   1040.89  298.37   1105.29   298.52   184.65  29.11  190.76  28.10  -6.11   40.46  
1 1 1 -1  7   15 o 10 94.05   10.85  258.53    57.49    322.91   80.97    193.06    81.65    104.75  13.80  79.88   18.21  24.87   22.85  
1 1 1 -1  7   16 o 1  355.89  37.65  3858.78   757.53   3773.60  1071.24  3943.98   1071.37  340.00  56.89  348.81  55.35  -8.81   79.38  
1 1 1 -1  7   17 o 3  288.01  29.72  2469.23   484.31   2387.97  684.72   2550.58   685.12   277.25  44.53  287.49  42.82  -10.25  61.77  
1 1 1 -1  7   18 o 12 79.17   10.18  183.42    45.19    181.71   64.49    185.06    63.34    78.03   14.94  78.82   14.53  -0.80   20.84  
1 1 1 -1  7   19 o 17 425.11  45.89  5593.65   1102.28  5594.14  1558.83  5593.16   1558.89  407.63  69.08  407.59  69.09  0.05    97.70  
1 1 1 -1  7   20 o 2  209.88  21.87  1302.87   259.68   1320.81  367.42   1284.96   367.07   208.07  31.77  204.99  32.26  3.08    45.27  
1 1 1 -1  7   21 o 6  152.59  24.09  703.19    204.00   703.19   204.00   0.00      0.00     152.59  24.09  ?       ?      0.00    24.09  
1 1 1 -1  7   22 o 1  93.42   19.09  264.00    98.94    264.00   98.94    0.00      0.00     93.42   19.09  ?       ?      0.00    19.09  
1 1 1 -1  7   23 o 3  208.65  33.20  1345.51   384.39   1345.51  384.39   0.00      0.00     208.65  33.20  ?       ?      0.00    33.20  
1 1 1 -1  7   24 o 11 345.16  63.60  4346.21   1213.73  4346.21  1213.73  0.00      0.00     345.16  63.60  ?       ?      0.00    63.60  
1 1 1 -1  7   25 o 16 61.04   15.52  113.36    54.49    104.34   80.29    121.05    74.18    60.38   19.94  63.46   18.93  -3.08   27.50  
1 1 1 -1  7   26 o 13 59.72   15.74  108.96    54.72    82.13    82.85    129.72    72.87    56.14   20.18  65.12   18.58  -8.99   27.43  
1 1 1 -1  7   27 o 6  155.22  17.82  729.86    155.87   798.44   223.72   665.15    217.30   158.39  25.47  143.20  27.43  15.19   37.43  
1 1 1 -1  7   28 o 15 39.68   16.19  20.92     58.30    10.27    94.60    27.44     74.03    46.78   19.96  44.57   18.23  2.21    27.03  
1 1 1 -1  7   29 f 0  220.44  26.17  1609.70   324.76   1534.49  461.91   1683.22   456.71   195.48  42.39  209.15  39.48  -13.67  57.93  
1 1 1 -1  7   30 o 18 121.14  16.77  457.75    113.50   506.68   171.44   419.56    151.45   121.80  25.35  111.20  24.40  10.60   35.18  
1 1 1 -1  7   31 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  7   32 o 18 43.37   18.67  13.80     84.17    0.00     0.00     13.80     84.17    ?       ?      43.37   18.67  0.00    18.67  
1 1 1 -1  8   1  o 9  244.63  16.67  1741.31   232.72   2216.88  404.45   1505.93   284.54   273.70  26.05  226.19  22.20  47.52   34.23  
1 1 1 -1  8   2  o 10 383.51  32.43  4397.98   707.37   4313.64  1225.65  4440.11   866.19   362.48  61.07  381.37  40.17  -18.90  73.10  
1 1 1 -1  8   3  o 19 136.91  9.61   542.39    75.05    616.62   131.28   506.36    91.47    145.07  16.03  131.93  12.22  13.14   20.16  
1 1 1 -1  8   4  o 18 301.18  33.88  2740.14   575.56   2411.50  814.56   3067.82   813.36   272.34  54.01  312.27  46.81  -39.93  71.47  
1 1 1 -1  8   5  o 6  119.59  10.15  415.01    69.01    398.74   97.43    431.39    97.75    116.45  14.92  121.31  14.31  -4.85   20.67  
1 1 1 -1  8   6  o 7  156.89  23.63  737.23    206.19   737.23   206.19   0.00      0.00     156.89  23.63  ?       ?      0.00    23.63  
1 1 1 -1  8   7  x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  8   8  o 3  519.85  61.57  9165.35   1801.67  9134.31  2547.46  9196.41   2548.44  468.45  97.89  470.68  97.53  -2.23   138.18 
1 1 1 -1  8   9  o 8  106.12  11.66  329.25    69.86    334.88   94.12    322.35    104.24   106.22  15.93  103.69  18.17  2.53    24.16  
1 1 1 -1  8   10 o 11 263.84  42.29  2220.21   618.89   2220.21  618.89   0.00      0.00     263.84  42.29  ?       ?      0.00    42.29  
1 1 1 -1  8   11 o 17 191.76  24.94  1105.97   268.06   1520.14  377.59   685.13    380.62   223.13  30.26  145.71  42.74  77.42   52.36  
1 1 1 -1  8   12 o 19 62.54   10.25  115.76    35.51    115.76   35.51    0.00      0.00     62.54   10.25  ?       ?      0.00    10.25  
1 1 1 -1  8   13 o 5  340.75  57.87  3917.82   1091.51  3917.82  1091.51  0.00      0.00     340.75  57.87  ?       ?      0.00    57.87  
1 1 1 -1  8   14 o 18 232.42  24.32  1604.95   319.75   1709.81  452.36   1500.24   452.03   236.20  34.37  219.84  37.14  16.36   50.60  
1 1 1 -1  8   15 f 0  328.72  34.49  3262.28   641.16   3192.53  906.62   3332.08   906.87   315.90  51.79  323.66  50.45  -7.77   72.30  
1 1 1 -1  8   16 o 14 289.04  45.13  2596.45   724.38   2596.45  724.38   0.00      0.00     289.04  45.13  ?       ?      0.00    45.13  
1 1 1 -1  8   17 o 6  254.67  39.18  1984.53   554.52   1984.53  554.52   0.00      0.00     254.67  39.18  ?       ?      0.00    39.18  
1 1 1 -1  8   18 o 11 167.47  25.56  839.65    237.95   839.65   237.95   0.00      0.00     167.47  25.56  ?       ?      0.00    25.56  
1 1 1 -1  8   19 o 10 160.45  24.75  773.90    220.68   773.90   220.68   0.00      0.00     160.45  24.75  ?       ?      0.00    24.75  
1 1 1 -1  8   20 o 2  254.15  40.63  2045.92   572.80   2045.92  572.80   0.00      0.00     254.15  40.63  ?       ?      0.00    40.63  
1 1 1 -1  8   21 o 12 96.05   19.10  278.97    101.63   278.97   101.63   0.00      0.00     96.05   19.10  ?       ?      0.00    19.10  
1 1 1 -1  8   22 o 9  242.68  38.87  1853.69   523.22   1853.69  523.22   0.00      0.00     242.68  38.87  ?       ?      0.00    38.87  
1 1 1 -1  8   23 o 6  98.45   13.22  285.87    72.81    258.34   108.27   308.60    98.37    91.94   20.98  101.41  17.53  -9.47   27.34  
1 1 1 -1  8   24 o 3  179.48  19.60  963.50    198.67   1029.31  282.89   899.46    279.07   182.00  27.97  169.03  29.85  12.96   40.91  
1 1 1 -1  8   25 o 12 207.69  22.74  1319.12   266.75   1358.89  377.95   1279.64   376.55   204.03  33.42  197.11  34.54  6.93    48.06  
1 1 1 -1  8   26 o 13 55.65   16.48  93.61     56.36    76.23    80.31    110.47    79.12    54.49   19.83  61.08   19.77  -6.58   28.00  
1 1 1 -1  8   27 o 14 91.19   14.75  252.72    74.58    182.83   104.04   326.60    106.97   75.84   22.37  102.35  18.90  -26.52  29.29  
1 1 1 -1  8   28 o 18 74.60   16.05  173.78    66.71    123.65   95.98    220.65    92.80    63.92   21.81  82.94   19.77  -19.01  29.44  
1 1 1 -1  8   29 o 9  74.37   16.81  175.40    70.07    164.31   104.59   184.43    94.39    71.05   22.71  74.98   21.06  -3.93   30.97  
1 1 1 -1  8   30 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  8   31 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  9   1  o 18 523.29  64.23  9265.04   1888.97  0.00     0.00     9265.04   1888.97  ?       ?      523.29  64.23  0.00    64.23  
1 1 1 -1  9   2  o 19 165.85  16.01  805.16    150.54   619.05   262.86   895.99    183.64   141.01  33.05  174.47  18.62  -33.46  37.94  
1 1 1 -1  9   3  o 2  231.56  28.65  1614.61   372.72   1136.92  528.12   2088.61   526.08   186.29  48.81  260.49  36.15  -74.20  60.74  
1 1 1 -1  9   4  o 19 220.92  23.92  1451.70   298.48   1356.36  423.88   1545.46   420.39   208.68  36.72  224.37  33.68  -15.69  49.83  
1 1 1 -1  9   5  o 7  105.35  10.07  322.94    60.17    292.25   108.93   336.41    72.18    98.30   19.98  107.26  11.92  -8.96   23.27  
1 1 1 -1  9   6  o 12 123.47  18.64  454.29    127.99   454.29   127.99   0.00      0.00     123.47  18.64  ?       ?      0.00    18.64  
1 1 1 -1  9   7  o 1  315.83  34.83  3062.33   620.97   0.00     0.00     3062.33   620.97   ?       ?      315.83  34.83  0.00    34.83  
1 1 1 -1  9   8  o 19 311.37  28.93  2920.00   511.14   3443.16  884.78   2657.94   626.21   325.24  48.90  291.93  38.29  33.31   62.11  
1 1 1 -1  9   9  o 16 195.13  20.16  1126.38   222.63   1132.83  314.74   1119.91   314.94   192.60  29.40  191.40  29.62  1.21    41.73  
1 1 1 -1  9   10 o 2  133.72  10.84  519.53    82.53    478.24   139.18   541.92    102.49   126.44  19.83  136.19  13.28  -9.75   23.86  
1 1 1 -1  9   11 o 5  87.01   9.32   220.66    45.84    225.32   65.04    216.06    64.62    87.25   13.41  85.36   13.65  1.89    19.14  
1 1 1 -1  9   12 o 18 226.99  21.30  1519.76   274.33   1883.11  473.62   1336.31   336.54   248.09  34.16  210.43  28.60  37.66   44.55  
1 1 1 -1  9   13 o 7  175.30  18.04  901.84    178.94   923.84   252.94   879.80    253.18   175.48  25.89  170.94  26.67  4.54    37.17  
1 1 1 -1  9   14 o 14 107.96  12.24  340.41    74.49    377.06   106.72   305.58    104.03   112.87  17.00  101.07  18.62  11.80   25.21  
1 1 1 -1  9   15 o 11 228.53  35.00  1585.13   444.62   1585.13  444.62   0.00      0.00     228.53  35.00  ?       ?      0.00    35.00  
1 1 1 -1  9   16 o 18 211.95  32.32  1357.05   380.78   1357.05  380.78   0.00      0.00     211.95  32.32  ?       ?      0.00    32.32  
1 1 1 -1  9   17 o 5  232.61  35.80  1652.20   462.73   1652.20  462.73   0.00      0.00     232.61  35.80  ?       ?      0.00    35.80  
1 1 1 -1  9   18 f 0  352.25  37.62  3809.93   748.88   3739.02  1058.85  3880.90   1059.30  335.62  56.99  343.05  55.70  -7.43   79.69  
1 1 1 -1  9   19 o 13 124.23  20.17  463.06    138.89   0.00     0.00     463.06    138.89   ?       ?      124.23  20.17  0.00    20.17  
1 1 1 -1  9   20 o 2  77.01   13.74  176.96    58.50    162.21   79.88    194.03    85.91    73.12   18.90  79.89   19.01  -6.77   26.80  
1 1 1 -1  9   21 o 19 254.97  26.84  1953.60   387.04   1913.83  547.90   1993.22   546.80   245.82  40.22  251.56  39.14  -5.74   56.12  
1 1 1 -1  9   22 o 9  192.69  20.28  1101.95   221.01   1040.84  312.93   1162.76   312.17   183.40  30.81  194.92  28.76  -11.52  42.15  
1 1 1 -1  9   23 o 4  118.88  14.33  417.73    95.81    406.57   136.21   428.65    134.79   115.34  21.36  118.76  20.51  -3.42   29.61  
1 1 1 -1  9   24 o 9  134.47  15.37  538.03    116.53   512.81   165.24   562.98    164.36   128.45  23.27  135.27  21.91  -6.82   31.96  
1 1 1 -1  9   25 o 17 183.75  20.06  1027.69   208.16   1001.75  294.58   1053.57   294.18   175.32  30.37  180.54  29.39  -5.22   42.26  
1 1 1 -1  9   26 o 19 50.06   15.55  74.69     49.36    23.82    77.46    109.46    64.04    44.96   18.54  59.71   17.53  -14.75  25.52  
1 1 1 -1  9   27 o 16 158.41  18.26  774.97    163.03   753.75   230.58   796.18    230.54   149.63  27.87  154.58  26.96  -4.96   38.77  
1 1 1 -1  9   28 o 1  81.64   16.38  209.29    74.08    233.11   105.85   186.42    103.71   84.05   21.77  75.29   22.37  8.77    31.21  
1 1 1 -1  9   29 o 2  115.51  16.13  416.48    104.03   346.04   145.89   489.35    148.38   99.45   25.45  121.40  22.11  -21.95  33.71  
1 1 1 -1  9   30 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  9   31 o 4  53.70   18.88  90.53     72.14    89.59    104.37   91.40     99.82    56.29   22.10  56.13   21.74  0.16    31.00  
1 1 1 -1  10  1  o 7  385.31  38.86  4569.80   847.75   5020.10  1200.62  4122.07   1197.18  391.63  54.91  348.60  62.10  43.03   82.90  
1 1 1 -1  10  2  o 15 162.16  14.42  767.41    132.80   629.38   230.43   836.06    162.51   143.12  29.04  168.79  17.00  -25.68  33.65  
1 1 1 -1  10  3  o 11 284.52  30.75  2445.00   494.34   0.00     0.00     2445.00   494.34   ?       ?      284.52  30.75  0.00    30.75  
1 1 1 -1  10  4  o 7  352.67  29.73  3735.07   596.33   3596.61  1033.84  3804.10   730.02   327.96  56.98  351.99  36.67  -24.03  67.76  
1 1 1 -1  10  5  o 16 438.50  40.49  5966.19   1007.74  5103.16  1746.13  6397.20   1233.98  361.48  85.49  446.75  48.91  -85.27  98.50  
1 1 1 -1  10  6  x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  10  7  o 3  304.83  22.88  2743.50   397.42   2689.04  562.03   2797.95   562.03   297.13  33.53  303.54  32.77  -6.40   46.89  
1 1 1 -1  10  8  o 9  560.20  68.18  10885.85  2147.64  11019.88 3037.16  10751.81  3037.29  502.54  108.46 493.29  110.06 9.26    154.52 
1 1 1 -1  10  9  o 18 159.91  12.74  743.48    115.96   675.04   197.51   779.47    143.25   149.92  23.74  163.28  15.47  -13.36  28.33  
1 1 1 -1  10  10 o 17 236.20  19.14  1634.12   257.26   1602.83  443.37   1650.00   315.87   228.79  34.86  236.14  23.62  -7.35   42.10  
1 1 1 -1  10  11 o 13 325.83  34.39  3202.95   633.52   3276.24  895.88   3129.64   895.98   321.22  50.23  312.98  51.67  8.24    72.06  
1 1 1 -1  10  12 f 0  106.33  10.10  328.45    60.92    350.20   98.09    314.79    77.72    108.86  16.19  103.59  13.38  5.27    21.00  
1 1 1 -1  10  13 o 2  207.00  18.35  1251.52   215.86   1305.51  358.94   1220.93   270.17   208.29  30.96  203.30  23.59  5.00    38.92  
1 1 1 -1  10  14 o 7  203.41  18.18  1208.21   210.00   1279.12  345.58   1166.69   264.43   206.43  30.04  198.67  23.65  7.76    38.23  
1 1 1 -1  10  15 o 13 232.20  24.16  1591.74   317.41   1629.57  449.82   1554.22   447.96   231.64  34.91  225.82  35.74  5.81    49.96  
1 1 1 -1  10  16 o 8  176.83  19.23  920.00    192.03   1109.65  273.06   734.42    270.11   192.84  25.27  154.58  31.51  38.26   40.39  
1 1 1 -1  10  17 o 12 218.60  23.03  1419.02   284.69   1469.96  403.52   1368.54   401.72   218.81  33.16  210.46  34.44  8.35    47.81  
1 1 1 -1  10  18 o 11 64.57   13.61  125.31    48.84    63.61    67.67    192.39    70.56    50.70   18.24  79.97   15.93  -29.27  24.21  
1 1 1 -1  10  19 o 5  97.29   13.87  279.78    75.26    303.04   105.23   255.42    107.68   100.23  18.98  91.52   20.95  8.71    28.27  
1 1 1 -1  10  20 o 3  313.02  34.06  3009.29   602.17   3145.76  852.09   2873.14   851.11   309.46  49.64  293.42  52.45  16.05   72.22  
1 1 1 -1  10  21 o 8  193.17  20.28  1107.79   221.52   1035.20  313.45   1180.22   313.11   182.75  30.98  196.39  28.61  -13.64  42.17  
1 1 1 -1  10  22 o 1  144.01  16.10  614.31    130.80   569.85   182.36   661.41    187.71   136.05  24.24  147.29  22.95  -11.24  33.38  
1 1 1 -1  10  23 o 19 100.83  13.00  301.48    73.52    213.86   104.54   387.23    103.42   82.83   21.72  113.55  16.33  -30.72  27.18  
1 1 1 -1  10  24 o 8  93.42   14.45  262.45    74.98    317.13   105.67   207.00    106.41   101.47  18.83  81.11   22.21  20.36   29.12  
1 1 1 -1  10  25 o 14 42.46   16.18  39.34     54.71    75.89    77.05    2.17      77.69    53.72   19.44  41.99   18.01  11.73   26.50  
1 1 1 -1  10  26 o 15 153.54  18.08  726.53    156.28   761.48   220.09   690.98    221.95   151.88  26.19  143.22  28.00  8.66    38.34  
1 1 1 -1  10  27 o 15 55.50   17.22  95.14     60.56    91.38    85.13    99.00     86.19    56.78   20.45  58.28   20.62  -1.50   29.04  
1 1 1 -1  10  28 o 13 68.96   16.46  151.78    64.25    158.47   94.64    146.05    87.52    69.40   21.52  66.94   20.69  2.46    29.85  
1 1 1 -1  10  29 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  10  30 o 14 50.44   21.06  47.85     101.69   0.00     0.00     47.85     101.69   ?       ?      50.44   21.06  0.00    21.06  
1 1 1 -1  11  1  o 3  234.10  22.68  1612.74   300.92   0.00     0.00     1612.74   300.92   ?       ?      234.10  22.68  0.00    22.68  
1 1 1 -1  11  2  o 6  260.59  25.16  2006.86   371.65   1265.45  642.36   2379.93   455.66   197.12  54.79  282.91  28.44  -85.79  61.74  
1 1 1 -1  11  3  o 1  131.84  11.59  505.02    86.86    818.40   139.10   304.76    111.20   167.64  14.60  100.66  19.95  66.97   24.72  
1 1 1 -1  11  4  o 17 84.12   11.85  208.04    55.62    138.42   103.58   236.25    65.94    69.85   22.62  89.51   13.23  -19.66  26.21  
1 1 1 -1  11  5  o 14 198.48  31.37  1193.78   345.59   1193.78  345.59   0.00      0.00     198.48  31.37  ?       ?      0.00    31.37  
1 1 1 -1  11  6  o 13 359.23  58.78  4198.80   1170.27  0.00     0.00     4198.80   1170.27  ?       ?      359.23  58.78  0.00    58.78  
1 1 1 -1  11  7  o 2  263.97  23.13  2049.11   347.00   1651.99  599.65   2249.04   425.47   228.26  47.32  275.40  27.27  -47.14  54.61  
1 1 1 -1  11  8  o 15 200.89  16.84  1176.41   192.48   1149.18  268.66   1205.11   275.89   196.93  24.28  201.72  24.31  -4.79   34.36  
1 1 1 -1  11  9  o 14 218.05  23.51  1401.64   289.62   1764.31  410.19   1041.10   408.99   243.09  30.03  183.01  40.04  60.08   50.05  
1 1 1 -1  11  10 o 17 209.64  17.48  1280.81   208.42   1211.33  357.25   1316.66   256.61   200.26  32.16  211.79  21.40  -11.53  38.63  
1 1 1 -1  11  11 o 19 298.83  25.45  2626.54   432.46   2681.46  745.93   2598.73   530.76   294.52  45.59  295.26  31.81  -0.75   55.59  
1 1 1 -1  11  12 o 7  319.75  28.68  3025.13   520.84   3465.00  897.49   2801.76   639.56   333.89  48.22  304.46  37.38  29.43   61.01  
1 1 1 -1  11  13 o 16 193.65  20.97  1103.00   229.38   1294.81  328.14   919.70    320.78   208.14  28.19  173.39  33.44  34.75   43.73  
1 1 1 -1  11  14 o 11 85.29   11.89  213.82    56.63    189.37   89.66    230.04    73.04    79.15   19.79  87.98   15.00  -8.83   24.83  
1 1 1 -1  11  15 o 2  185.36  19.88  1013.71   208.20   1098.85  296.22   930.58    292.69   190.71  27.88  174.42  30.33  16.29   41.20  
1 1 1 -1  11  16 o 8  288.57  24.94  2481.08   409.16   2370.28  687.69   2541.81   509.08   270.85  45.86  289.22  31.15  -18.37  55.44  
1 1 1 -1  11  17 o 14 159.62  18.54  754.08    166.76   943.37   240.00   577.40    231.87   177.06  24.25  136.05  30.45  41.01   38.92  
1 1 1 -1  11  18 o 11 48.39   17.02  60.17     58.67    157.99   103.24   13.50     71.31    73.12   22.45  42.64   17.71  30.49   28.59  
1 1 1 -1  11  19 o 1  248.67  27.76  1866.77   389.60   2154.17  552.78   1583.06   549.21   262.19  37.82  220.34  44.94  41.85   58.74  
1 1 1 -1  11  20 o 7  95.84   14.53  272.89    77.43    266.67   108.43   279.37    110.61   93.40   20.76  95.64   20.75  -2.24   29.35  
1 1 1 -1  11  21 o 14 257.01  28.09  2037.54   407.65   2074.16  575.68   2000.71   577.35   249.62  41.64  244.21  42.74  5.41    59.67  
1 1 1 -1  11  22 o 15 130.74  15.89  510.49    116.79   571.64   164.93   449.00    165.40   136.28  21.82  119.26  24.96  17.01   33.15  
1 1 1 -1  11  23 o 13 87.60   14.83  232.05    71.90    218.30   95.53    250.02    109.19   83.51   20.16  89.07   21.58  -5.56   29.53  
1 1 1 -1  11  24 o 10 82.69   15.31  209.14    69.98    164.73   90.95    273.59    109.56   72.37   20.79  92.87   21.04  -20.50  29.58  
1 1 1 -1  11  25 o 17 42.18   16.18  38.77     54.90    19.48    73.17    63.63     83.06    43.04   17.91  52.06   19.92  -9.01   26.79  
1 1 1 -1  11  26 o 4  66.86   16.64  141.49    63.62    66.20    85.96    232.67    94.60    52.53   20.22  84.79   19.80  -32.26  28.30  
1 1 1 -1  11  27 o 10 109.41  16.27  374.24    99.08    434.00   137.27   309.24    143.17   114.63  21.65  93.91   25.78  20.72   33.67  
1 1 1 -1  11  28 o 11 42.96   17.15  37.04     63.77    -4.99    84.25    93.43     97.59    41.48   18.26  57.30   21.67  -15.82  28.33  
1 1 1 -1  11  29 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  11  30 o 11 70.59   18.29  170.25    74.71    175.09   109.86   166.09    101.89   69.23   23.34  67.90   22.47  1.33    32.39  
1 1 1 -1  12  1  o 4  355.24  56.41  3945.07   1112.02  0.00     0.00     3945.07   1112.02  ?       ?      355.24  56.41  0.00    56.41  
1 1 1 -1  12  2  o 15 296.26  47.03  2698.23   773.16   0.00     0.00     2698.23   773.16   ?       ?      296.26  47.03  0.00    47.03  
1 1 1 -1  12  3  x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  12  4  o 9  689.58  80.30  15829.21  3119.50  0.00     0.00     15829.21  3119.50  ?       ?      689.58  80.30  0.00    80.30  
1 1 1 -1  12  5  x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  12  6  o 4  384.57  35.21  4405.54   768.75   0.00     0.00     4405.54   768.75   ?       ?      384.57  35.21  0.00    35.21  
1 1 1 -1  12  7  o 8  303.27  21.34  2682.39   369.09   2484.62  519.77   2883.54   524.20   289.00  31.86  312.28  29.59  -23.29  43.48  
1 1 1 -1  12  8  o 6  297.06  46.03  2721.68   759.59   0.00     0.00     2721.68   759.59   ?       ?      297.06  46.03  0.00    46.03  
1 1 1 -1  12  9  o 15 297.85  46.27  2743.72   765.53   0.00     0.00     2743.72   765.53   ?       ?      297.85  46.27  0.00    46.27  
1 1 1 -1  12  10 o 10 125.28  19.18  465.43    133.59   0.00     0.00     465.43    133.59   ?       ?      125.28  19.18  0.00    19.18  
1 1 1 -1  12  11 o 7  411.39  69.76  5700.85   1588.68  0.00     0.00     5700.85   1588.68  ?       ?      411.39  69.76  0.00    69.76  
1 1 1 -1  12  12 o 16 183.50  28.26  1016.46   288.11   0.00     0.00     1016.46   288.11   ?       ?      183.50  28.26  0.00    28.26  
1 1 1 -1  12  13 o 13 85.61   16.70  220.00    79.11    0.00     0.00     220.00    79.11    ?       ?      85.61   16.70  0.00    16.70  
1 1 1 -1  12  14 o 14 239.25  48.75  1881.62   646.76   0.00     0.00     1881.62   646.76   ?       ?      239.25  48.75  0.00    48.75  
1 1 1 -1  12  15 o 17 87.27   17.27  229.42    83.44    335.85   137.22   166.98    105.11   104.74  23.41  74.90   22.58  29.84   32.53  
1 1 1 -1  12  16 o 18 102.64  16.28  313.60    92.75    339.94   148.79   296.86    118.61   105.17  25.01  98.73   21.53  6.44    33.01  
1 1 1 -1  12  17 o 5  200.24  21.62  1190.59   244.59   1489.59  372.77   964.56    324.11   221.04  30.16  175.97  33.30  45.07   44.93  
1 1 1 -1  12  18 o 4  267.72  28.38  2170.49   429.60   2107.78  608.82   2232.68   606.28   255.62  43.02  264.31  41.31  -8.69   59.64  
1 1 1 -1  12  19 o 14 395.77  48.12  5269.44   1070.85  5817.50  1514.62  4721.68   1514.19  385.56  71.05  332.83  80.20  52.73   107.14 
1 1 1 -1  12  20 o 10 224.09  24.56  1535.49   310.83   1569.20  438.88   1501.57   440.28   219.24  36.13  213.58  37.26  5.66    51.90  
1 1 1 -1  12  21 o 4  239.76  27.37  1806.09   370.00   1952.78  522.78   1658.86   523.74   239.08  39.47  216.12  43.72  22.96   58.90  
1 1 1 -1  12  22 o 4  179.13  20.53  982.56    207.31   1061.05  291.40   902.12    295.01   180.93  29.04  164.29  32.43  16.64   43.53  
1 1 1 -1  12  23 o 11 108.07  15.20  353.58    91.69    388.75   130.95   319.75    128.43   110.87  21.35  99.69   22.92  11.18   31.32  
1 1 1 -1  12  24 o 16 79.28   16.10  195.59    70.77    248.97   99.65    141.26    100.52   88.13   20.14  67.47   22.31  20.66   30.06  
1 1 1 -1  12  25 o 7  62.22   18.63  122.64    71.75    165.86   94.51    63.86     110.21   71.39   21.39  55.76   22.45  15.63   31.00  
1 1 1 -1  12  26 o 13 200.04  24.56  1348.16   276.09   1364.17  390.36   1332.13   390.54   183.21  38.35  180.12  38.91  3.09    54.63  
1 1 1 -1  12  27 o 4  46.36   20.12  10.77     99.24    0.00     0.00     10.77     99.24    ?       ?      46.36   20.12  0.00    20.12  
1 1 1 -1  12  28 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  12  29 o 5  56.99   22.71  95.32     111.65   0.00     0.00     95.32     111.65   ?       ?      56.99   22.71  0.00    22.71  
1 1 1 -1  13  1  o 11 183.17  16.66  977.44    173.25   1264.44  388.94   906.40    193.51   204.38  34.37  175.83  19.50  28.55   39.51  
1 1 1 -1  13  2  o 6  151.63  17.45  673.49    149.10   320.05   373.93   740.31    162.59   114.93  42.62  158.94  18.14  -44.02  46.32  
1 1 1 -1  13  3  o 1  251.66  20.84  1849.95   298.32   2105.23  594.17   1763.92   344.94   262.66  40.72  244.78  24.89  17.88   47.73  
1 1 1 -1  13  4  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  13  5  o 17 154.58  36.12  737.40    314.68   0.00     0.00     737.40    314.68   ?       ?      154.58  36.12  0.00    36.12  
1 1 1 -1  13  6  x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  13  7  o 9  173.13  37.67  930.85    363.74   0.00     0.00     930.85    363.74   ?       ?      173.13  37.67  0.00    37.67  
1 1 1 -1  13  8  o 13 396.86  68.98  5348.19   1514.52  0.00     0.00     5348.19   1514.52  ?       ?      396.86  68.98  0.00    68.98  
1 1 1 -1  13  9  o 16 98.23   12.17  282.71    67.15    306.84   94.11    257.68    95.84    101.56  16.72  92.53   18.69  9.04    25.08  
1 1 1 -1  13  10 o 9  77.99   12.37  179.94    53.55    183.15   72.20    176.01    79.82    77.98   16.64  76.26   18.44  1.71    24.83  
1 1 1 -1  13  11 o 16 27.09   12.63  -45.60    48.19    -112.50  60.50    70.57     79.72    25.66   12.53  54.21   19.75  -28.55  23.39  
1 1 1 -1  13  12 o 16 234.03  21.44  1619.15   284.80   1786.83  452.20   1508.89   366.67   241.15  33.57  223.05  29.35  18.10   44.59  
1 1 1 -1  13  13 o 13 212.80  23.20  1347.57   278.80   1767.30  434.51   1053.84   363.49   240.40  32.30  183.39  35.81  57.01   48.23  
1 1 1 -1  13  14 o 19 65.84   18.48  129.95    72.70    127.16   142.93   130.93    84.44    72.14   26.42  66.68   20.27  5.46    33.30  
1 1 1 -1  13  15 o 18 335.27  39.18  3503.55   739.89   4318.88  1050.54  2701.08   1042.23  362.51  51.97  273.83  66.89  88.68   84.70  
1 1 1 -1  13  16 o 18 98.90   22.40  299.29    124.21   0.00     0.00     299.29    124.21   ?       ?      98.90   22.40  0.00    22.40  
1 1 1 -1  13  17 o 17 303.24  53.20  3182.84   892.38   0.00     0.00     3182.84   892.38   ?       ?      303.24  53.20  0.00    53.20  
1 1 1 -1  13  18 o 4  258.55  44.83  2275.94   641.28   0.00     0.00     2275.94   641.28   ?       ?      258.55  44.83  0.00    44.83  
1 1 1 -1  13  19 o 2  180.75  30.27  1046.38   302.94   0.00     0.00     1046.38   302.94   ?       ?      180.75  30.27  0.00    30.27  
1 1 1 -1  13  20 o 13 208.26  36.09  1462.63   415.82   0.00     0.00     1462.63   415.82   ?       ?      208.26  36.09  0.00    36.09  
1 1 1 -1  13  21 o 8  118.26  23.44  444.92    153.54   0.00     0.00     444.92    153.54   ?       ?      118.26  23.44  0.00    23.44  
1 1 1 -1  13  22 o 9  242.75  52.38  2514.29   708.45   0.00     0.00     2514.29   708.45   ?       ?      242.75  52.38  0.00    52.38  
1 1 1 -1  13  23 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  13  24 o 10 76.14   22.90  192.46    108.18   0.00     0.00     192.46    108.18   ?       ?      76.14   22.90  0.00    22.90  
1 1 1 -1  13  25 o 13 83.73   23.01  239.58    114.03   0.00     0.00     239.58    114.03   ?       ?      83.73   23.01  0.00    23.01  
1 1 1 -1  13  26 o 6  114.78  27.51  486.25    178.92   0.00     0.00     486.25    178.92   ?       ?      114.78  27.51  0.00    27.51  
1 1 1 -1  13  27 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  13  28 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  14  1  o 8  238.21  26.05  1685.08   350.40   1284.96  688.77   1824.80   407.01   197.65  57.35  246.96  29.28  -49.31  64.39  
1 1 1 -1  14  2  o 17 543.52  48.79  9246.58   1506.20  8889.65  2632.34  9420.32   1836.56  476.24  99.50  536.95  60.64  -60.71  116.52 
1 1 1 -1  14  3  o 10 435.83  37.93  5773.00   939.43   5940.16  1665.93  5695.06   1137.56  413.81  72.78  426.49  47.25  -12.68  86.78  
1 1 1 -1  14  4  x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  14  5  o 5  100.76  18.00  303.63    100.28   -1288.05 655.47   341.78    101.48   80.52   39.69  107.24  17.05  -26.73  43.20  
1 1 1 -1  14  6  o 13 330.68  54.57  3571.16   999.75   0.00     0.00     3571.16   999.75   ?       ?      330.68  54.57  0.00    54.57  
1 1 1 -1  14  7  o 13 245.47  22.29  1778.46   310.71   1603.79  706.43   1820.36   345.97   218.66  56.03  247.62  24.67  -28.96  61.22  
1 1 1 -1  14  8  o 13 112.37  23.84  384.39    149.02   865.26   563.46   348.23    154.52   163.97  52.74  106.63  25.57  57.35   58.61  
1 1 1 -1  14  9  o 5  78.61   35.23  -115.93   328.57   58.30    503.38   -245.28   433.71   107.05  45.87  85.45   39.15  21.60   60.31  
1 1 1 -1  14  10 o 12 158.77  23.54  755.23    208.07   784.16   228.20   612.59    506.69   161.29  25.49  143.10  50.05  18.19   56.17  
1 1 1 -1  14  11 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  14  12 o 9  599.53  29.54  10747.50  1013.55  3455.82  1354.14  20036.25  1528.37  302.78  77.57  815.38  32.72  -512.60 84.19  
1 1 1 -1  14  13 o 16 279.98  46.00  2528.35   713.67   2528.35  713.67   0.00      0.00     279.98  46.00  ?       ?      0.00    46.00  
1 1 1 -1  14  14 o 4  177.50  26.29  957.74    259.79   856.59   277.44   1677.88   740.28   166.25  30.18  217.42  58.17  -51.16  65.54  
1 1 1 -1  14  15 o 17 214.94  35.10  1467.00   418.17   1762.64  480.68   546.98    847.97   234.89  36.86  145.96  60.88  88.93   71.17  
1 1 1 -1  14  16 o 13 57.99   22.27  71.48     104.11   71.48    104.11   0.00      0.00     57.99   22.27  ?       ?      0.00    22.27  
1 1 1 -1  14  17 o 3  240.54  25.56  1786.22   347.55   1989.91  546.33   1647.75   450.44   241.93  40.79  223.31  36.39  18.62   54.66  
1 1 1 -1  14  18 o 2  138.29  17.73  576.97    137.54   706.49   194.88   448.42    194.14   150.82  23.25  117.27  29.00  33.55   37.17  
1 1 1 -1  14  19 o 4  136.79  17.26  566.15    132.51   628.59   186.82   502.94    187.97   141.16  23.91  124.41  27.09  16.74   36.13  
1 1 1 -1  14  20 o 17 75.13   17.09  175.71    72.03    179.97   92.78    169.24    114.27   75.37   20.78  73.69   23.75  1.68    31.56  
1 1 1 -1  14  21 o 4  229.51  37.50  1930.24   477.03   2148.13  596.54   1543.79   794.44   228.60  47.03  160.67  61.56  67.93   77.47  
1 1 1 -1  14  22 o 17 244.44  30.03  2073.05   412.51   2018.10  578.31   2129.98   588.59   213.86  48.26  220.79  47.82  -6.93   67.94  
1 1 1 -1  14  23 o 4  37.93   16.47  -1.89     66.65    -15.06   77.59    35.22     130.24   39.13   17.36  55.08   23.46  -15.95  29.18  
1 1 1 -1  14  24 o 5  46.02   18.13  46.37     70.38    41.54    82.06    59.83     136.91   47.36   19.26  57.95   24.33  -10.59  31.03  
1 1 1 -1  14  25 o 4  113.57  17.96  418.36    113.18   406.28   143.06   438.56    185.02   107.34  23.84  106.31  29.35  1.03    37.81  
1 1 1 -1  14  26 o 9  68.38   20.09  162.04    84.02    177.48   99.15    122.66    158.30   70.62   22.05  64.19   26.49  6.43    34.47  
1 1 1 -1  14  27 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  15  1  o 5  553.52  35.31  9178.90   1116.04  15308.44 1687.98  4418.30   1487.59  709.79  41.61  357.09  74.96  352.70  85.73  
1 1 1 -1  15  2  o 10 751.82  26.33  16612.70  1134.42  22303.06 1687.63  11922.05  1532.23  864.54  34.07  624.55  43.00  239.98  54.86  
1 1 1 -1  15  3  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  15  4  o 9  491.01  30.17  7164.24   846.26   0.00     0.00     7164.24   846.26   ?       ?      491.01  30.17  0.00    30.17  
1 1 1 -1  15  5  o 2  669.59  54.53  14318.70  2078.09  0.00     0.00     14318.70  2078.09  ?       ?      669.59  54.53  0.00    54.53  
1 1 1 -1  15  6  o 2  291.86  23.99  2513.88   398.37   0.00     0.00     2513.88   398.37   ?       ?      291.86  23.99  0.00    23.99  
1 1 1 -1  15  7  o 2  79.78   26.15  181.32    138.19   514.55   884.85   172.99    139.91   154.78  63.12  78.64   26.33  76.14   68.40  
1 1 1 -1  15  8  o 16 ?       ?      -2001.77  466.62   -1210.23 767.22   -2466.43  587.83   91.73   44.74  ?       ?      0.00    44.74  
1 1 1 -1  15  9  o 18 82.42   37.97  -260.76   415.57   -195.79  673.54   -300.70   528.06   110.36  49.87  93.16   42.87  17.21   65.76  
1 1 1 -1  15  10 o 17 343.67  36.49  3655.37   708.98   3402.16  1000.70  3910.55   1004.61  315.70  57.33  342.96  52.71  -27.26  77.88  
1 1 1 -1  15  11 o 17 377.74  35.56  4431.08   762.01   4689.19  1296.50  4294.87   941.86   359.39  65.24  362.71  46.29  -3.32   79.99  
1 1 1 -1  15  12 o 17 289.91  32.01  2605.57   523.81   2699.22  739.66   2511.35   741.90   283.74  47.06  271.56  49.41  12.18   68.23  
1 1 1 -1  15  13 o 9  141.14  16.18  590.83    128.76   533.11   181.47   649.36    182.72   131.14  25.02  146.00  22.52  -14.85  33.66  
1 1 1 -1  15  14 o 2  73.60   17.88  166.20    74.77    216.82   98.37    96.95     115.05   83.69   20.61  63.33   23.61  20.36   31.34  
1 1 1 -1  15  15 o 12 113.12  16.40  384.59    103.42   354.86   133.56   429.13    163.46   106.64  22.52  116.56  25.17  -9.92   33.77  
1 1 1 -1  15  16 o 17 156.99  25.12  773.50    218.73   760.25   230.54   892.96    692.18   154.66  26.95  148.80  57.35  5.86    63.36  
1 1 1 -1  15  17 o 6  130.59  17.47  517.18    127.70   598.93   172.38   417.73    190.13   138.45  22.46  112.34  29.21  26.12   36.85  
1 1 1 -1  15  18 o 8  64.04   21.67  121.10    94.75    109.72   95.97    560.27    596.05   62.11   21.78  122.36  51.04  -60.25  55.49  
1 1 1 -1  15  19 o 4  97.26   22.18  305.90    121.09   305.90   121.09   0.00      0.00     97.26   22.18  ?       ?      0.00    22.18  
1 1 1 -1  15  20 o 1  192.10  37.57  1391.62   399.47   1391.62  399.47   0.00      0.00     192.10  37.57  ?       ?      0.00    37.57  
1 1 1 -1  15  21 o 12 81.68   21.99  221.36    105.39   225.59   106.73   56.17     667.38   82.41   22.11  94.05   44.81  -11.64  49.96  
1 1 1 -1  15  22 o 15 79.42   21.33  211.02    99.29    216.88   100.28   -79.47    706.48   80.50   21.35  88.62   43.16  -8.12   48.15  
1 1 1 -1  15  23 o 15 173.58  34.50  1202.58   331.67   1281.72  364.28   818.92    802.10   174.85  37.42  105.15  49.81  69.70   62.30  
1 1 1 -1  15  24 o 2  52.40   20.17  75.21     85.52    75.21    85.52    0.00      0.00     52.40   20.17  ?       ?      0.00    20.17  
1 1 1 -1  15  25 o 18 128.18  27.99  642.99    200.18   642.99   200.18   0.00      0.00     128.18  27.99  ?       ?      0.00    27.99  
1 1 1 -1  16  1  o 9  215.09  27.34  1398.92   330.00   0.00     0.00     1398.92   330.00   ?       ?      215.09  27.34  0.00    27.34  
1 1 1 -1  16  2  o 4  245.41  33.93  1860.56   465.21   1577.36  870.44   1973.80   550.41   208.43  65.37  249.78  39.71  -41.36  76.49  
1 1 1 -1  16  3  x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  16  4  o 14 153.11  24.72  711.22    209.90   251.68   845.66   741.39    216.68   137.40  59.17  156.31  24.99  -18.91  64.23  
1 1 1 -1  16  5  o 15 284.53  39.42  2565.27   626.67   2306.63  1166.69  2670.15   742.94   239.85  75.75  284.98  47.05  -45.14  89.17  
1 1 1 -1  16  6  o 5  115.69  20.40  404.61    130.50   -77.01   839.88   416.53    132.11   123.86  55.85  117.43  20.33  6.43    59.44  
1 1 1 -1  16  7  o 13 66.18   22.15  123.32    99.01    -24.47   697.03   126.36    100.02   115.58  51.59  66.83   22.26  48.75   56.19  
1 1 1 -1  16  8  o 4  221.05  29.70  1510.49   367.38   1910.93  793.66   1401.28   414.45   226.50  60.07  209.56  35.73  16.94   69.89  
1 1 1 -1  16  9  o 9  354.50  72.49  5102.11   1425.38  0.00     0.00     5102.11   1425.38  ?       ?      354.50  72.49  0.00    72.49  
1 1 1 -1  16  10 o 3  117.81  14.82  411.68    98.00    371.07   135.24   456.58    142.21   109.66  22.25  122.34  21.01  -12.68  30.60  
1 1 1 -1  16  11 o 18 349.44  40.85  4063.70   804.09   4070.99  1135.86  4056.38   1138.44  320.38  64.00  319.31  64.33  1.07    90.74  
1 1 1 -1  16  12 o 2  273.71  29.88  2360.00   461.84   2876.24  764.58   2063.43   579.50   283.44  48.75  245.03  42.75  38.42   64.84  
1 1 1 -1  16  13 o 15 146.59  17.64  645.97    145.49   684.80   198.48   600.87    213.90   148.24  24.15  136.80  28.18  11.44   37.11  
1 1 1 -1  16  14 o 12 78.79   16.67  190.72    73.04    233.81   92.40    118.94    119.26   86.77   19.07  66.58   24.17  20.19   30.79  
1 1 1 -1  16  15 o 13 78.54   17.21  190.99    75.44    154.08   92.10    266.23    131.51   70.45   21.11  90.90   24.61  -20.45  32.42  
1 1 1 -1  16  16 o 12 75.59   18.20  179.19    78.04    221.15   95.70    95.95     134.80   83.51   20.19  64.47   25.18  19.05   32.27  
1 1 1 -1  16  17 o 3  127.76  16.87  500.16    120.69   466.64   159.18   545.50    185.11   119.65  24.01  128.36  26.01  -8.71   35.40  
1 1 1 -1  16  18 o 5  49.90   18.77  61.49     73.07    83.24    85.53    2.77      140.54   55.61   20.43  54.33   23.75  1.28    31.33  
1 1 1 -1  16  19 o 19 173.36  20.58  957.30    200.78   996.58   283.88   917.98    284.02   167.59  30.63  159.08  32.21  8.51    44.45  
1 1 1 -1  16  20 o 1  81.34   18.62  214.35    85.06    292.75   106.20   74.04     142.07   94.57   20.18  60.70   25.08  33.87   32.19  
1 1 1 -1  16  21 o 15 81.37   18.87  217.56    86.44    251.20   106.00   150.77    149.36   86.14   21.50  69.54   26.68  16.60   34.27  
1 1 1 -1  16  22 o 4  79.48   19.12  211.51    86.15    269.79   108.17   110.47    142.44   88.48   21.51  63.10   25.48  25.37   33.34  
1 1 1 -1  16  23 o 16 82.66   19.10  232.28    88.79    196.94   111.14   294.63    147.63   73.69   23.39  87.05   26.86  -13.36  35.62  
1 1 1 -1  16  24 o 14 63.86   20.03  141.95    81.69    168.77   93.85    58.10     165.93   68.68   21.46  58.07   25.58  10.61   33.39  
1 1 1 -1  17  1  o 9  185.95  45.62  1181.87   483.22   0.00     0.00     1181.87   483.22   ?       ?      185.95  45.62  0.00    45.62  
1 1 1 -1  17  2  x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  17  3  o 1  182.88  48.61  1173.30   518.97   0.00     0.00     1173.30   518.97   ?       ?      182.88  48.61  0.00    48.61  
1 1 1 -1  17  4  o 13 142.41  21.43  615.05    169.79   895.79   815.40   602.32    173.59   159.19  62.00  140.62  22.24  18.56   65.87  
1 1 1 -1  17  5  o 1  197.11  25.51  1190.87   281.94   792.30   908.93   1233.30   296.57   154.65  63.62  200.18  26.45  -45.53  68.91  
1 1 1 -1  17  6  o 6  256.28  30.88  2061.96   445.19   1864.73  1026.60  2107.64   494.06   204.78  71.27  256.59  34.41  -51.80  79.14  
1 1 1 -1  17  7  o 9  138.26  23.53  589.92    180.04   389.28   731.11   602.87    185.76   129.55  55.39  139.59  24.05  -10.04  60.39  
1 1 1 -1  17  8  o 7  108.19  22.09  363.32    132.53   82.50    691.28   374.03    135.03   114.07  51.12  109.78  22.19  4.30    55.73  
1 1 1 -1  17  9  o 10 126.31  23.07  496.37    161.14   0.00     0.00     496.37    161.14   ?       ?      126.31  23.07  0.00    23.07  
1 1 1 -1  17  10 o 15 60.16   22.55  87.47     105.26   0.00     0.00     87.47     105.26   ?       ?      60.16   22.55  0.00    22.55  
1 1 1 -1  17  11 f 0  100.08  24.15  319.95    137.16   0.00     0.00     319.95    137.16   ?       ?      100.08  24.15  0.00    24.15  
1 1 1 -1  17  12 o 17 268.45  38.55  2518.46   577.01   0.00     0.00     2518.46   577.01   ?       ?      268.45  38.55  0.00    38.55  
1 1 1 -1  17  13 o 6  130.64  15.84  515.55    116.37   482.06   159.92   553.24    169.65   122.76  23.55  131.87  23.26  -9.11   33.10  
1 1 1 -1  17  14 f 0  88.40   16.19  240.85    79.13    265.16   99.18    198.27    131.25   91.65   19.45  78.77   25.46  12.88   32.04  
1 1 1 -1  17  15 o 7  152.93  19.49  728.69    167.21   846.13   228.76   593.95    245.03   160.62  25.67  128.76  33.00  31.86   41.81  
1 1 1 -1  17  16 f 0  77.92   17.78  192.43    77.79    200.42   91.81    172.09    146.48   78.77   20.21  74.51   26.83  4.26    33.58  
1 1 1 -1  17  17 o 10 50.53   19.48  60.26     79.87    60.26    79.87    0.00      0.00     50.53   19.48  ?       ?      0.00    19.48  
1 1 1 -1  17  18 o 19 39.21   16.67  9.30      65.58    1.12     73.82    39.91     142.85   40.14   17.39  57.29   24.49  -17.15  30.03  
1 1 1 -1  17  19 o 11 49.97   18.55  67.75     70.83    95.89    80.67    -26.86    147.94   56.41   19.95  51.64   23.35  4.77    30.71  
1 1 1 -1  17  20 o 13 181.02  24.41  1141.71   247.18   1203.53  337.91   1070.56   362.51   169.85  35.79  150.84  40.86  19.01   54.32  
1 1 1 -1  17  21 o 9  110.78  18.12  403.94    111.24   398.52   140.68   412.98    181.71   105.22  23.84  101.24  29.48  3.98    37.92  
1 1 1 -1  17  22 o 3  108.18  18.51  391.54    110.81   345.53   138.26   474.16    185.28   95.87   24.90  107.88  29.21  -12.01  38.38  
1 1 1 -1  18  1  o 16 64.84   19.83  126.66    80.64    544.59   785.50   122.21    81.07    135.16  57.59  63.93   19.94  71.23   60.94  
1 1 1 -1  18  2  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  18  3  o 12 204.21  27.55  1314.01   314.75   520.90   1006.41  1400.00   331.37   138.30  61.85  210.49  28.13  -72.19  67.94  
1 1 1 -1  18  4  o 6  97.98   19.56  296.58    106.18   0.00     0.00     296.58    106.18   ?       ?      97.98   19.56  0.00    19.56  
1 1 1 -1  18  5  o 19 78.07   37.38  -443.38   477.48   0.00     0.00     -443.38   477.48   ?       ?      78.07   37.38  0.00    37.38  
1 1 1 -1  18  6  x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  18  7  x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  18  8  o 19 76.33   36.47  -373.12   448.72   15.76    773.43   -570.42   550.91   109.54  50.93  79.79   38.69  29.75   63.96  
1 1 1 -1  18  9  o 19 160.91  28.56  849.09    254.18   0.00     0.00     849.09    254.18   ?       ?      160.91  28.56  0.00    28.56  
1 1 1 -1  18  10 o 4  103.56  23.75  346.73    138.20   0.00     0.00     346.73    138.20   ?       ?      103.56  23.75  0.00    23.75  
1 1 1 -1  18  11 o 19 71.00   22.53  157.70    103.10   0.00     0.00     157.70    103.10   ?       ?      71.00   22.53  0.00    22.53  
1 1 1 -1  18  12 o 5  137.98  16.16  579.57    125.60   572.23   174.31   587.49    181.13   132.99  23.70  134.36  24.38  -1.38   34.00  
1 1 1 -1  18  13 o 9  78.41   25.30  200.59    129.58   0.00     0.00     200.59    129.58   ?       ?      78.41   25.30  0.00    25.30  
1 1 1 -1  18  14 o 16 193.92  40.10  1480.43   431.67   0.00     0.00     1480.43   431.67   ?       ?      193.92  40.10  0.00    40.10  
1 1 1 -1  18  15 o 7  60.28   23.83  87.53     122.08   0.00     0.00     87.53     122.08   ?       ?      60.28   23.83  0.00    23.83  
1 1 1 -1  18  16 o 1  51.57   23.15  -21.16    142.38   0.00     0.00     -21.16    142.38   ?       ?      51.57   23.15  0.00    23.15  
1 1 1 -1  18  17 o 9  117.73  30.44  528.67    207.26   0.00     0.00     528.67    207.26   ?       ?      117.73  30.44  0.00    30.44  
1 1 1 -1  18  18 o 12 140.08  35.48  833.29    285.61   0.00     0.00     833.29    285.61   ?       ?      140.08  35.48  0.00    35.48  
1 1 1 -1  18  19 o 6  57.74   25.32  44.42     160.71   0.00     0.00     44.42     160.71   ?       ?      57.74   25.32  0.00    25.32  
1 1 1 -1  19  1  x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  19  2  o 7  109.72  19.55  372.93    118.64   0.00     0.00     372.93    118.64   ?       ?      109.72  19.55  0.00    19.55  
1 1 1 -1  19  3  o 12 138.07  22.04  596.24    168.82   0.00     0.00     596.24    168.82   ?       ?      138.07  22.04  0.00    22.04  
1 1 1 -1  19  4  o 6  159.30  27.00  821.55    238.14   183.04   1187.48  848.31    243.08   124.27  59.36  161.85  27.12  -37.58  65.26  
1 1 1 -1  19  5  o 3  156.10  25.99  785.96    224.75   0.00     0.00     785.96    224.75   ?       ?      156.10  25.99  0.00    25.99  
1 1 1 -1  19  6  o 9  91.61   22.94  270.73    120.39   696.87   1004.79  264.53    121.26   130.27  59.65  90.47   23.23  39.80   64.02  
1 1 1 -1  19  7  o 11 216.97  32.62  1610.81   393.70   0.00     0.00     1610.81   393.70   ?       ?      216.97  32.62  0.00    32.62  
1 1 1 -1  19  8  o 12 105.77  22.77  361.79    134.18   0.00     0.00     361.79    134.18   ?       ?      105.77  22.77  0.00    22.77  
1 1 1 -1  19  9  o 16 138.82  24.98  631.79    191.72   0.00     0.00     631.79    191.72   ?       ?      138.82  24.98  0.00    24.98  
1 1 1 -1  19  10 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  19  11 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  19  12 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  19  13 o 4  116.16  52.93  910.25    778.75   0.00     0.00     910.25    778.75   ?       ?      116.16  52.93  0.00    52.93  
1 1 1 -1  19  14 o 12 90.59   43.75  112.70    687.72   0.00     0.00     112.70    687.72   ?       ?      90.59   43.75  0.00    43.75  
1 1 1 -1  19  15 o 5  51.08   17.51  78.89     61.88    64.97    70.67    124.64    128.12   49.24   18.48  64.39   24.71  -15.16  30.85  
1 1 1 -1  19  16 o 6  36.72   15.82  4.31      60.49    -5.84    67.00    49.09     140.70   37.03   16.29  56.48   24.23  -19.45  29.19  
1 1 1 -1  20  1  x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 -1  20  2  o 5  51.62   19.13  67.66     75.29    -263.16  1360.60  68.68     75.41    113.04  55.99  51.83   19.16  61.21   59.18  
1 1 1 -1  20  3  o 18 57.42   19.88  95.32     79.84    0.00     0.00     95.32     79.84    ?       ?      57.42   19.88  0.00    19.88  
1 1 1 -1  20  4  o 12 62.96   20.08  122.60    81.84    649.08   1359.70  120.68    81.99    122.26  59.62  62.57   20.12  59.68   62.92  
1 1 1 -1  20  5  o 10 123.04  22.15  488.49    150.68   375.08   1414.88  489.79    151.54   116.89  57.75  123.14  22.26  -6.26   61.89  
1 1 1 -1  20  6  o 6  131.18  24.16  567.25    175.26   -48.34   1314.43  578.39    176.84   108.87  54.11  132.51  24.14  -23.65  59.25  
1 1 1 -1  20  7  o 8  71.96   23.13  167.51    108.39   1598.16  1287.84  157.30    108.78   131.27  62.45  70.17   23.21  61.10   66.63  
1 1 1 -1  20  8  o 5  106.62  24.06  382.30    143.78   0.00     0.00     382.30    143.78   ?       ?      106.62  24.06  0.00    24.06  
1 1 1 -1  20  9  o 11 83.79   22.40  235.01    109.80   671.89   1028.67  229.97    110.43   110.84  53.53  82.82   22.60  28.02   58.11  
1 1 1 -1  20  10 o 1  120.98  26.74  512.75    180.77   0.00     0.00     512.75    180.77   ?       ?      120.98  26.74  0.00    26.74  
1 1 1 0   -20 1  f 0  49.60   18.67  58.33     72.33    58.33    72.33    0.00      0.00     49.60   18.67  ?       ?      0.00    18.67  
1 1 1 0   -19 1  o 8  45.41   17.79  39.10     67.51    42.38    67.62    -980.30   1191.98  46.03   17.87  109.38  53.84  -63.35  56.73  
1 1 1 0   -19 2  o 12 170.24  25.04  911.82    237.41   911.82   237.41   0.00      0.00     170.24  25.04  ?       ?      0.00    25.04  
1 1 1 0   -19 3  o 3  130.73  23.01  535.81    166.42   517.17   168.48   1281.54   1065.78  128.03  23.80  159.25  67.44  -31.22  71.51  
1 1 1 0   -19 4  o 17 124.78  21.68  485.08    149.67   494.31   151.15   18.71     1074.45  125.98  21.68  122.28  57.84  3.70    61.77  
1 1 1 0   -19 5  o 2  400.43  56.70  6528.30   1267.06  5896.65  1656.02  7420.22   1967.85  307.23  88.87  322.47  97.81  -15.24  132.15 
1 1 1 0   -19 6  o 14 44.51   17.45  37.46     64.95    33.99    65.08    916.32    1035.90  43.92   17.39  145.17  63.94  -101.25 66.27  
1 1 1 0   -19 7  o 11 126.76  20.37  496.21    143.19   482.86   144.48   1231.47   1072.31  124.78  20.91  156.09  66.92  -31.31  70.11  
1 1 1 0   -18 1  o 11 411.56  36.97  5541.99   864.06   5506.05  1002.20  5646.08   1705.46  399.76  44.42  326.00  88.76  73.76   99.26  
1 1 1 0   -18 2  o 15 182.34  23.68  1020.42   242.05   1020.42  242.05   0.00      0.00     182.34  23.68  ?       ?      0.00    23.68  
1 1 1 0   -18 3  o 15 114.47  20.33  401.55    128.70   409.22   130.16   65.93     861.02   115.57  20.36  122.14  55.66  -6.57   59.27  
1 1 1 0   -18 4  o 9  360.62  34.05  4183.12   696.47   4011.77  800.97   4714.27   1410.20  344.73  41.29  317.23  77.99  27.50   88.25  
1 1 1 0   -18 5  o 5  110.81  19.22  374.69    117.81   370.48   118.89   603.15    875.20   110.07  19.53  141.01  60.45  -30.94  63.53  
1 1 1 0   -18 6  o 10 115.39  19.26  405.94    123.09   393.28   124.45   978.46    837.08   113.34  19.85  156.70  62.27  -43.36  65.35  
1 1 1 0   -18 7  o 4  229.15  28.50  1652.83   366.81   1322.47  395.07   3717.05   987.55   199.78  35.76  308.99  57.80  -109.21 67.97  
1 1 1 0   -18 8  o 8  124.19  21.52  476.13    147.88   479.21   150.04   371.86    873.32   124.49  21.79  130.33  57.99  -5.83   61.95  
1 1 1 0   -18 9  o 17 41.61   17.18  17.47     66.57    18.76    66.76    -209.05   883.36   41.86   17.24  112.62  53.02  -70.75  55.75  
1 1 1 0   -18 10 o 4  79.23   18.15  194.09    80.80    194.09   80.80    0.00      0.00     79.23   18.15  ?       ?      0.00    18.15  
1 1 1 0   -17 1  o 5  189.39  25.69  1093.97   272.09   1167.88  286.70   423.93    863.28   195.55  26.20  141.17  60.27  54.39   65.72  
1 1 1 0   -17 2  o 7  118.32  20.16  423.96    132.04   393.63   134.27   1313.94   727.34   113.57  21.38  187.50  59.88  -73.93  63.58  
1 1 1 0   -17 3  o 18 201.58  25.94  1240.56   293.23   1300.50  314.55   842.80    810.29   205.82  27.29  158.07  61.73  47.75   67.50  
1 1 1 0   -17 4  o 3  501.30  47.18  8459.46   1341.82  8514.71  1622.48  8339.91   2386.87  482.53  59.85  393.32  104.10 89.21   120.08 
1 1 1 0   -17 5  o 18 354.00  28.97  3852.68   583.56   3648.38  676.39   4447.54   1154.15  339.14  35.26  346.25  60.25  -7.10   69.81  
1 1 1 0   -17 6  o 7  124.43  19.01  466.76    131.47   471.31   133.91   345.36    691.90   124.96  19.29  128.07  54.29  -3.12   57.62  
1 1 1 0   -17 7  o 16 63.88   19.15  122.27    75.73    117.70   76.20    490.34    683.86   62.91   19.28  134.33  55.22  -71.42  58.49  
1 1 1 0   -17 8  o 1  64.85   26.25  65.67     151.68   65.67    151.68   0.00      0.00     64.85   26.25  ?       ?      0.00    26.25  
1 1 1 0   -17 9  o 18 95.10   16.84  273.37    88.55    271.46   89.21    401.54    730.12   94.70   17.03  130.76  55.61  -36.06  58.16  
1 1 1 0   -17 10 o 17 50.75   18.29  65.04     68.11    65.76    68.40    -19.91    741.73   50.94   18.33  114.29  51.92  -63.35  55.06  
1 1 1 0   -17 11 o 19 70.91   18.41  154.55    75.58    154.54   75.92    155.75    805.56   70.91   18.47  122.71  55.07  -51.80  58.08  
1 1 1 0   -17 12 o 12 120.36  20.66  444.80    137.62   444.70   139.52   448.48    836.69   120.23  20.98  132.99  58.05  -12.75  61.73  
1 1 1 0   -17 13 o 12 87.66   19.39  237.91    94.98    227.10   95.55    1121.41   864.14   85.51   19.85  160.99  63.49  -75.48  66.52  
1 1 1 0   -16 1  o 7  240.83  49.42  1919.24   660.28   1919.24  660.28   0.00      0.00     240.83  49.42  ?       ?      0.00    49.42  
1 1 1 0   -16 2  o 9  257.46  50.31  2201.77   716.92   2201.77  716.92   0.00      0.00     257.46  50.31  ?       ?      0.00    50.31  
1 1 1 0   -16 3  o 15 103.70  40.75  231.79    354.96   231.79   354.96   0.00      0.00     103.70  40.75  ?       ?      0.00    40.75  
1 1 1 0   -16 4  o 8  330.36  61.39  3821.88   1121.44  3821.88  1121.44  0.00      0.00     330.36  61.39  ?       ?      0.00    61.39  
1 1 1 0   -16 5  o 11 67.70   19.58  137.32    80.41    130.49   81.22    474.52    570.83   66.29   19.82  133.91  51.95  -67.63  55.60  
1 1 1 0   -16 6  o 3  273.73  27.56  2263.88   427.13   2302.98  489.97   2140.10   871.80   273.93  31.75  242.97  62.23  30.95   69.86  
1 1 1 0   -16 7  o 12 173.98  18.56  896.32    182.50   916.83   191.10   683.76    615.20   175.78  19.25  147.84  54.70  27.94   57.99  
1 1 1 0   -16 8  o 11 252.09  38.04  2026.88   533.39   1654.47  617.97   3114.93   1056.27  219.42  50.16  288.27  65.34  -68.86  82.37  
1 1 1 0   -16 9  f 0  57.17   18.87  92.28     71.88    82.38    72.43    744.84    588.05   55.15   18.94  149.45  53.75  -94.29  56.99  
1 1 1 0   -16 10 o 2  124.26  18.17  462.84    125.76   435.67   128.45   1092.24   618.21   120.18  19.27  173.47  55.18  -53.29  58.45  
1 1 1 0   -16 11 o 9  135.75  18.61  552.35    141.21   522.17   144.82   1133.90   635.72   131.57  19.79  175.26  55.98  -43.69  59.38  
1 1 1 0   -16 12 o 11 308.22  40.43  3122.25   698.13   3081.55  911.64   3179.97   1085.61  289.34  56.91  279.78  68.22  9.56    88.84  
1 1 1 0   -16 13 o 7  259.66  40.73  2243.71   587.24   2647.25  732.77   1519.30   981.80   275.35  48.11  187.63  69.16  87.72   84.24  
1 1 1 0   -16 14 o 15 197.52  64.11  1644.72   831.47   0.00     0.00     1644.72   831.47   ?       ?      197.52  64.11  0.00    64.11  
1 1 1 0   -16 15 o 4  209.65  66.59  1959.56   900.51   0.00     0.00     1959.56   900.51   ?       ?      209.65  66.59  0.00    66.59  
1 1 1 0   -16 16 o 8  107.59  50.48  -248.10   788.92   0.00     0.00     -248.10   788.92   ?       ?      107.59  50.48  0.00    50.48  
1 1 1 0   -15 1  o 11 401.34  84.34  5739.25   1881.23  10028.97 2595.02  987.73    2731.13  528.58  88.66  232.36  103.02 296.21  135.92 
1 1 1 0   -15 2  o 17 557.19  52.32  9731.00   1653.93  10509.65 2009.46  8095.64   2912.16  569.32  62.51  441.22  114.12 128.10  130.12 
1 1 1 0   -15 3  o 4  247.04  26.67  1811.65   372.20   1914.25  418.13   1420.06   816.86   253.17  29.31  206.85  63.07  46.33   69.55  
1 1 1 0   -15 4  o 18 453.84  38.86  6264.05   1002.75  6358.68  1208.81  6055.25   1795.59  451.29  47.36  413.26  78.56  38.03   91.73  
1 1 1 0   -15 5  o 12 80.25   34.19  18.86     276.75   -49.61   317.53   235.24    564.46   81.16   35.59  122.16  50.19  -41.01  61.52  
1 1 1 0   -15 6  o 12 112.71  39.34  358.31    312.91   358.31   312.91   0.00      0.00     112.71  39.34  ?       ?      0.00    39.34  
1 1 1 0   -15 7  x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   -15 8  o 11 231.10  40.63  1690.45   519.38   1690.45  519.38   0.00      0.00     231.10  40.63  ?       ?      0.00    40.63  
1 1 1 0   -15 9  o 18 401.51  32.90  4906.19   751.70   4964.25  900.89   4773.15   1363.82  398.69  39.90  365.51  67.48  33.18   78.39  
1 1 1 0   -15 10 f 0  40.77   17.02  10.23     66.38    8.38     66.88    132.97    544.86   40.63   17.03  112.88  48.03  -72.25  50.96  
1 1 1 0   -15 11 o 17 128.12  34.30  521.83    257.26   694.47   287.58   -169.85   575.64   147.68  34.54  101.25  45.89  46.43   57.44  
1 1 1 0   -15 12 o 12 293.64  38.51  2747.88   633.49   2998.36  837.76   2413.40   968.08   296.49  51.06  251.12  66.22  45.37   83.62  
1 1 1 0   -15 13 o 6  79.91   33.14  80.23     249.38   -8.79    276.26   472.06    579.60   76.75   33.43  131.28  51.92  -54.52  61.76  
1 1 1 0   -15 14 o 4  300.96  43.25  3002.72   725.80   3671.76  968.48   2145.52   1096.24  321.52  54.41  222.64  73.69  98.88   91.60  
1 1 1 0   -15 15 o 17 209.33  35.55  1413.95   411.90   1694.59  492.75   762.92    750.49   226.97  39.24  150.45  59.22  76.52   71.03  
1 1 1 0   -15 16 o 2  79.69   32.40  109.87    232.30   76.64    248.78   336.09    649.09   78.79   32.93  124.12  52.60  -45.33  62.05  
1 1 1 0   -15 17 o 11 150.42  57.89  846.93    704.56   0.00     0.00     846.93    704.56   ?       ?      150.42  57.89  0.00    57.89  
1 1 1 0   -15 18 o 18 116.99  51.25  233.47    657.22   0.00     0.00     233.47    657.22   ?       ?      116.99  51.25  0.00    51.25  
1 1 1 0   -14 1  o 14 636.39  55.19  12810.54  1996.28  12888.09 2436.53  12652.17  3481.79  622.25  69.39  559.59  112.29 62.66   132.00 
1 1 1 0   -14 2  o 11 604.69  55.42  11534.22  1902.52  11827.64 2322.74  10936.05  3316.39  598.30  68.88  519.37  114.33 78.93   133.48 
1 1 1 0   -14 3  o 10 266.95  32.16  2132.79   482.98   2137.88  602.15   2123.63   808.73   264.01  41.06  256.45  56.47  7.56    69.82  
1 1 1 0   -14 4  o 7  426.15  46.69  5570.91   1123.45  5506.64  1541.31  5643.76   1640.98  409.83  67.89  411.90  72.02  -2.07   98.97  
1 1 1 0   -14 5  o 14 204.29  59.48  1344.36   739.64   4012.76  964.64   -2462.67  1152.21  360.76  47.75  103.41  51.27  257.35  70.07  
1 1 1 0   -14 6  o 19 462.23  47.55  6550.79   1243.72  4609.52  1721.80  8668.83   1798.49  362.88  84.27  522.05  61.17  -159.17 104.13 
1 1 1 0   -14 7  o 13 466.29  56.28  6856.50   1476.08  7454.87  2050.34  6212.71   2126.74  467.29  79.26  414.36  91.82  52.94   121.30 
1 1 1 0   -14 8  o 14 604.02  47.69  11275.13  1640.25  10965.24 1998.36  11914.98  2871.48  583.27  60.56  573.00  90.28  10.27   108.71 
1 1 1 0   -14 9  o 10 590.81  74.14  12075.76  2459.27  12954.00 3466.68  11186.02  3489.31  555.54  112.56 496.71  123.02 58.83   166.74 
1 1 1 0   -14 10 o 16 201.60  40.25  1280.18   449.44   1280.18  449.44   0.00      0.00     201.60  40.25  ?       ?      0.00    40.25  
1 1 1 0   -14 11 o 6  227.04  41.32  1631.30   518.77   1631.30  518.77   0.00      0.00     227.04  41.32  ?       ?      0.00    41.32  
1 1 1 0   -14 12 o 14 75.04   30.68  72.74     209.77   139.57   232.63   -218.04   485.26   84.23   33.02  91.77   41.81  -7.54   53.28  
1 1 1 0   -14 13 o 2  283.68  36.42  2505.57   579.37   2799.83  776.00   2134.94   870.91   292.32  47.90  244.25  62.01  48.07   78.36  
1 1 1 0   -14 14 o 2  451.62  52.32  6869.66   1331.43  6281.56  1853.87  7496.14   1913.41  386.85  85.73  433.32  79.86  -46.48  117.17 
1 1 1 0   -14 15 o 3  103.56  33.56  327.92    227.92   325.97   253.20   336.22    523.35   104.36  35.43  120.83  48.81  -16.47  60.31  
1 1 1 0   -14 16 o 10 94.89   32.72  262.96    216.25   286.48   239.63   159.76    501.93   98.93   34.43  108.63  46.15  -9.70   57.58  
1 1 1 0   -14 17 o 16 78.53   30.71  131.49    200.80   140.44   215.96   74.31     545.58   81.11   31.81  106.81  46.75  -25.70  56.54  
1 1 1 0   -14 18 o 15 192.71  35.59  1210.24   379.20   1210.24  379.20   0.00      0.00     192.71  35.59  ?       ?      0.00    35.59  
1 1 1 0   -14 19 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   -14 20 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   -13 1  o 11 643.84  72.31  13523.63  2626.39  13231.69 3705.10  13818.50  3723.53  588.94  113.71 605.38  111.24 -16.44  159.07 
1 1 1 0   -13 2  o 1  992.32  92.51  34537.77  5209.35  34059.41 6378.72  35495.77  9026.85  925.54  123.10 765.00  202.43 160.54  236.93 
1 1 1 0   -13 3  o 6  540.27  41.08  8795.87   1264.63  8494.07  1544.45  9409.93   2203.01  523.47  52.09  532.28  74.10  -8.81   90.58  
1 1 1 0   -13 4  o 15 367.30  36.31  4047.95   755.63   4047.95  755.63   0.00      0.00     367.30  36.31  ?       ?      0.00    36.31  
1 1 1 0   -13 5  o 2  136.18  23.60  555.56    177.84   777.29   198.18   -361.38   403.01   162.06  21.86  77.84   36.38  84.22   42.44  
1 1 1 0   -13 6  o 19 145.24  20.23  623.84    164.14   483.90   179.03   1361.44   411.03   126.51  25.53  211.62  35.06  -85.11  43.37  
1 1 1 0   -13 7  o 17 555.31  56.57  9678.00   1778.27  8766.19  2495.47  10618.71  2534.70  497.20  90.77  557.96  81.54  -60.76  122.02 
1 1 1 0   -13 8  o 4  404.17  70.49  5363.17   1576.14  0.00     0.00     5363.17   1576.14  ?       ?      404.17  70.49  0.00    70.49  
1 1 1 0   -13 9  o 11 564.62  106.99 11827.45  3341.04  0.00     0.00     11827.45  3341.04  ?       ?      564.62  106.99 0.00    106.99 
1 1 1 0   -13 10 o 11 112.75  46.97  126.10    503.89   0.00     0.00     126.10    503.89   ?       ?      112.75  46.97  0.00    46.97  
1 1 1 0   -13 11 o 16 130.90  32.12  526.62    239.54   637.43   280.17   225.49    461.86   143.72  34.41  114.53  46.00  29.18   57.45  
1 1 1 0   -13 12 o 10 106.69  32.44  342.23    216.31   417.26   245.71   83.72     456.09   116.91  34.35  104.70  44.22  12.21   55.99  
1 1 1 0   -13 13 o 16 335.37  57.64  3737.32   1069.65  3737.32  1069.65  0.00      0.00     335.37  57.64  ?       ?      0.00    57.64  
1 1 1 0   -13 14 o 7  516.17  133.68 14301.03  3992.29  14301.03 3992.29  0.00      0.00     516.17  133.68 ?       ?      0.00    133.68 
1 1 1 0   -13 15 o 7  98.43   33.78  276.21    230.37   276.21   230.37   0.00      0.00     98.43   33.78  ?       ?      0.00    33.78  
1 1 1 0   -13 16 o 5  85.07   31.30  183.67    200.99   167.26   218.72   272.75    509.57   85.03   32.37  117.40  47.89  -32.37  57.81  
1 1 1 0   -13 17 f 0  54.59   24.62  -72.63    163.32   -85.34   172.02   43.58     520.12   55.33   25.08  104.86  45.77  -49.54  52.19  
1 1 1 0   -13 18 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   -13 19 o 8  221.74  59.49  1884.18   772.88   0.00     0.00     1884.18   772.88   ?       ?      221.74  59.49  0.00    59.49  
1 1 1 0   -13 20 o 3  351.61  44.81  4223.16   883.91   4213.95  1190.63  4234.48   1319.34  322.41  66.54  309.48  75.05  12.93   100.29 
1 1 1 0   -13 21 f 0  213.75  32.34  1474.00   384.45   1455.94  444.50   1527.62   765.94   207.69  38.70  189.94  61.52  17.75   72.69  
1 1 1 0   -13 22 o 3  140.38  29.36  637.78    229.01   625.28   244.26   728.61    658.37   137.86  31.55  140.47  55.41  -2.61   63.76  
1 1 1 0   -12 1  o 11 615.99  53.49  11580.43  1872.83  11732.52 2291.76  11274.66  3249.45  610.47  66.47  564.78  104.06 45.69   123.47 
1 1 1 0   -12 2  o 7  100.44  14.72  296.89    82.37    279.19   87.11    446.20    253.02   97.10   16.20  121.69  34.59  -24.60  38.20  
1 1 1 0   -12 3  o 6  290.10  33.28  2496.39   544.27   2969.42  662.62   1515.43   954.22   315.48  37.31  219.15  68.41  96.33   77.92  
1 1 1 0   -12 4  o 19 117.07  14.37  400.79    94.56    344.67   102.13   738.15    250.40   107.99  17.04  156.75  28.89  -48.76  33.54  
1 1 1 0   -12 5  o 12 314.49  20.96  2875.72   376.23   2772.41  453.59   3103.49   673.54   307.71  25.92  322.55  37.05  -14.84  45.21  
1 1 1 0   -12 6  o 4  118.27  18.59  414.04    122.06   413.78   133.37   415.41    302.85   117.89  20.45  119.73  38.68  -1.84   43.75  
1 1 1 0   -12 7  o 10 400.77  44.32  4876.23   1002.72  5532.53  1410.13  4204.96   1426.12  417.94  60.54  356.53  72.16  61.41   94.19  
1 1 1 0   -12 8  o 5  223.00  26.61  1473.02   333.96   1507.47  454.84   1432.73   491.91   222.61  36.88  215.48  41.27  7.13    55.35  
1 1 1 0   -12 9  o 4  316.29  35.61  3003.09   635.41   3283.16  882.34   2701.38   915.80   325.01  48.80  290.31  56.99  34.70   75.02  
1 1 1 0   -12 10 o 2  228.34  29.15  1552.14   373.46   1255.02  487.07   1975.99   581.74   200.76  43.52  254.03  41.31  -53.28  60.00  
1 1 1 0   -12 11 o 19 106.38  43.70  136.29    427.80   0.00     0.00     136.29    427.80   ?       ?      106.38  43.70  0.00    43.70  
1 1 1 0   -12 12 o 18 571.62  108.41 12150.60  3427.22  0.00     0.00     12150.60  3427.22  ?       ?      571.62  108.41 0.00    108.41 
1 1 1 0   -12 13 o 7  80.75   32.54  93.47     231.85   93.47    231.85   0.00      0.00     80.75   32.54  ?       ?      0.00    32.54  
1 1 1 0   -12 14 o 8  195.36  28.59  1147.17   311.14   837.37   375.24   1828.84   556.62   163.30  40.28  242.66  41.44  -79.36  57.79  
1 1 1 0   -12 15 o 6  234.15  29.97  1654.41   393.66   1571.48  501.02   1788.19   636.37   223.82  40.48  235.01  48.77  -11.19  63.38  
1 1 1 0   -12 16 o 11 160.86  32.45  802.87    289.29   802.87   289.29   0.00      0.00     160.86  32.45  ?       ?      0.00    32.45  
1 1 1 0   -12 17 o 16 268.47  45.05  2328.33   669.73   2328.33  669.73   0.00      0.00     268.47  45.05  ?       ?      0.00    45.05  
1 1 1 0   -12 18 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   -12 19 o 6  256.25  32.61  2049.15   468.93   2212.30  608.55   1810.68   735.73   259.76  42.26  222.95  57.21  36.81   71.12  
1 1 1 0   -12 20 o 18 210.66  29.68  1381.03   349.02   1457.04  421.53   1215.30   622.43   212.95  35.75  181.84  54.97  31.11   65.57  
1 1 1 0   -12 21 o 17 314.48  36.90  3198.75   653.50   2882.65  866.44   3615.83   995.28   279.23  56.00  311.30  57.82  -32.06  80.50  
1 1 1 0   -12 22 o 2  233.60  31.95  1743.93   417.18   1787.58  513.05   1658.76   716.72   229.99  40.33  203.87  58.31  26.12   70.89  
1 1 1 0   -12 23 o 12 211.06  30.09  1426.16   354.31   1406.89  423.01   1471.46   648.60   204.09  37.49  190.86  55.73  13.23   67.17  
1 1 1 0   -11 1  x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   -11 2  o 17 232.48  37.30  1642.95   480.97   1642.95  480.97   0.00      0.00     232.48  37.30  ?       ?      0.00    37.30  
1 1 1 0   -11 3  o 18 250.89  39.60  1913.05   551.44   1913.05  551.44   0.00      0.00     250.89  39.60  ?       ?      0.00    39.60  
1 1 1 0   -11 4  o 11 687.06  74.26  15230.82  2882.33  15230.82 2882.33  0.00      0.00     687.06  74.26  ?       ?      0.00    74.26  
1 1 1 0   -11 5  o 2  267.96  28.89  2117.17   437.45   1329.98  530.53   3789.02   773.16   207.33  45.80  356.40  38.39  -149.07 59.76  
1 1 1 0   -11 6  o 5  482.94  47.94  7030.59   1311.60  4587.64  1849.61  9501.56   1860.19  368.30  88.57  555.51  59.24  -187.21 106.56 
1 1 1 0   -11 7  o 8  611.38  67.11  11687.18  2316.77  11975.42 3274.33  11398.20  3278.48  591.48  99.99  573.71  103.35 17.77   143.80 
1 1 1 0   -11 8  o 13 78.02   25.17  171.86    128.26   124.08   159.29   259.98    216.31   74.58   27.79  97.25   32.75  -22.67  42.95  
1 1 1 0   -11 9  o 8  291.30  31.48  2511.40   518.11   2616.65  722.97   2400.27   742.89   293.27  44.32  279.29  48.07  13.98   65.38  
1 1 1 0   -11 10 o 19 95.97   25.91  277.53    146.08   236.31   180.33   356.18    249.11   91.37   29.87  110.46  35.02  -19.09  46.03  
1 1 1 0   -11 11 o 18 267.25  43.05  2194.45   638.08   2194.45  638.08   0.00      0.00     267.25  43.05  ?       ?      0.00    43.05  
1 1 1 0   -11 12 o 19 529.38  59.49  8864.31   1776.62  9144.80  2501.92  8579.01   2523.27  511.29  88.44  490.27  93.06  21.02   128.38 
1 1 1 0   -11 13 o 16 54.52   25.72  -231.65   209.88   -179.03  244.99   -376.80   406.90   63.44   29.20  77.99   36.48  -14.55  46.73  
1 1 1 0   -11 14 o 2  575.51  108.96 12311.72  3468.02  0.00     0.00     12311.72  3468.02  ?       ?      575.51  108.96 0.00    108.96 
1 1 1 0   -11 15 o 16 102.76  43.07  83.63     427.65   0.00     0.00     83.63     427.65   ?       ?      102.76  43.07  0.00    43.07  
1 1 1 0   -11 16 o 2  351.97  61.95  4098.23   1206.06  0.00     0.00     4098.23   1206.06  ?       ?      351.97  61.95  0.00    61.95  
1 1 1 0   -11 17 o 5  53.62   23.41  -23.70    136.13   -23.70   136.13   0.00      0.00     53.62   23.41  ?       ?      0.00    23.41  
1 1 1 0   -11 18 o 9  369.38  68.91  4864.68   1407.58  0.00     0.00     4864.68   1407.58  ?       ?      369.38  68.91  0.00    68.91  
1 1 1 0   -11 19 o 17 268.05  45.09  2335.62   669.18   2335.62  669.18   0.00      0.00     268.05  45.09  ?       ?      0.00    45.09  
1 1 1 0   -11 20 o 14 85.95   26.98  221.87    148.24   221.87   148.24   0.00      0.00     85.95   26.98  ?       ?      0.00    26.98  
1 1 1 0   -11 21 o 17 177.61  32.06  998.28    314.86   998.28   314.86   0.00      0.00     177.61  32.06  ?       ?      0.00    32.06  
1 1 1 0   -11 22 o 18 204.20  27.13  1288.63   310.22   1397.03  394.30   1112.51   502.57   208.71  34.08  176.90  48.19  31.81   59.03  
1 1 1 0   -11 23 o 8  316.56  36.43  3265.68   649.97   2980.40  886.25   3597.72   956.13   279.67  57.13  309.69  55.83  -30.02  79.89  
1 1 1 0   -11 24 o 8  171.93  25.07  922.02    240.19   792.49   292.58   1189.76   420.65   154.25  33.96  184.80  40.75  -30.55  53.05  
1 1 1 0   -10 1  o 14 92.28   12.83  250.63    66.15    340.53   86.27    122.39    103.04   107.57  14.33  66.85   22.60  40.72   26.76  
1 1 1 0   -10 2  o 14 157.17  13.55  719.09    121.10   469.06   162.03   1035.48   182.26   124.63  23.51  188.17  17.06  -63.55  29.05  
1 1 1 0   -10 3  o 9  101.07  11.90  298.67    67.72    340.51   81.36    204.32    122.17   107.76  13.44  82.73   24.20  25.03   27.68  
1 1 1 0   -10 4  o 1  91.45   11.27  244.63    57.92    241.72   62.65    261.75    152.06   90.72   12.35  93.33   26.91  -2.61   29.61  
1 1 1 0   -10 5  o 4  21.97   8.39   9.44      14.71    9.44     14.71    0.00      0.00     21.97   8.39   ?       ?      0.00    8.39   
1 1 1 0   -10 6  o 11 316.29  49.78  3110.97   873.97   3110.97  873.97   0.00      0.00     316.29  49.78  ?       ?      0.00    49.78  
1 1 1 0   -10 7  o 16 367.97  58.32  4250.70   1190.91  4250.70  1190.91  0.00      0.00     367.97  58.32  ?       ?      0.00    58.32  
1 1 1 0   -10 8  f 0  779.13  92.39  20384.84  4052.10  21513.88 5730.09  19255.44  5730.98  736.26  140.70 680.63  150.66 55.63   206.14 
1 1 1 0   -10 9  o 8  469.45  50.33  6668.83   1335.30  7122.88  1886.19  6212.66   1890.60  473.60  71.61  437.91  78.07  35.69   105.94 
1 1 1 0   -10 10 o 6  312.77  48.49  2981.54   842.39   2981.54  842.39   0.00      0.00     312.77  48.49  ?       ?      0.00    48.49  
1 1 1 0   -10 11 o 14 117.29  22.11  411.28    143.42   478.68   179.51   292.34    238.47   126.14  25.66  102.65  34.38  23.50   42.90  
1 1 1 0   -10 12 o 6  185.23  22.70  1010.47   236.32   951.22   313.69   1088.23   359.35   177.49  31.96  189.54  34.29  -12.05  46.87  
1 1 1 0   -10 13 o 13 47.88   21.83  -83.87    132.57   -23.45   153.61   -260.14   262.40   57.46   24.98  62.14   29.14  -4.68   38.38  
1 1 1 0   -10 14 f 0  508.86  55.49  8101.04   1594.88  7876.49  2245.88  8329.49   2265.24  476.90  85.16  492.68  83.04  -15.79  118.95 
1 1 1 0   -10 15 o 12 586.55  65.49  10977.39  2167.65  10892.75 3054.93  11063.21  3076.23  549.74  100.50 554.25  100.38 -4.51   142.04 
1 1 1 0   -10 16 o 3  637.73  75.02  13373.42  2693.93  14162.86 3801.31  12576.89  3818.32  612.26  112.29 564.08  121.51 48.18   165.45 
1 1 1 0   -10 17 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   -10 18 o 2  272.30  47.41  2359.99   714.20   0.00     0.00     2359.99   714.20   ?       ?      272.30  47.41  0.00    47.41  
1 1 1 0   -10 19 o 5  182.42  23.44  993.71    239.81   865.14   303.07   1209.05   392.22   167.02  32.78  196.90  36.03  -29.88  48.71  
1 1 1 0   -10 20 o 17 64.37   24.13  94.06     120.49   97.43    133.24   78.93     282.19   66.69   25.29  84.66   35.20  -17.97  43.34  
1 1 1 0   -10 21 o 11 288.89  32.74  2582.80   533.41   2600.20  735.19   2563.47   775.12   279.37  47.54  274.52  51.06  4.85    69.77  
1 1 1 0   -10 22 o 12 150.27  27.92  703.98    231.97   703.98   231.97   0.00      0.00     150.27  27.92  ?       ?      0.00    27.92  
1 1 1 0   -10 23 o 5  208.07  36.02  1404.43   414.70   1404.43  414.70   0.00      0.00     208.07  36.02  ?       ?      0.00    36.02  
1 1 1 0   -10 24 o 13 217.42  25.86  1459.25   316.43   1387.48  411.70   1562.83   494.60   205.36  36.25  213.95  41.77  -8.59   55.30  
1 1 1 0   -10 25 o 16 106.93  21.14  354.99    125.15   356.10   135.66   348.65    324.34   106.51  22.87  106.60  39.67  -0.09   45.79  
1 1 1 0   -10 26 o 19 110.38  21.62  380.82    132.10   371.12   143.16   436.42    342.72   108.14  23.71  113.87  41.03  -5.73   47.39  
1 1 1 0   -9  1  o 6  49.46   8.79   72.53     24.03    71.98    26.02    75.72     62.67    49.15   9.57   52.61   17.63  -3.46   20.05  
1 1 1 0   -9  2  o 7  42.62   9.74   54.43     23.32    56.99    24.84    35.36     67.80    43.60   10.12  45.43   17.82  -1.82   20.49  
1 1 1 0   -9  3  o 1  327.78  29.20  3210.69   543.65   2415.80  766.57   4015.01   771.11   273.25  50.74  362.34  37.62  -89.09  63.16  
1 1 1 0   -9  4  o 14 171.94  27.14  891.98    258.97   0.00     0.00     891.98    258.97   ?       ?      171.94  27.14  0.00    27.14  
1 1 1 0   -9  5  o 18 127.77  21.77  489.59    153.95   0.00     0.00     489.59    153.95   ?       ?      127.77  21.77  0.00    21.77  
1 1 1 0   -9  6  f 0  545.38  64.13  9852.58   1969.60  11245.52 2785.69  8460.15   2785.18  547.89  91.81  450.74  108.87 97.15   142.42 
1 1 1 0   -9  7  f 0  373.22  39.94  4243.45   842.36   4330.28  1189.85  4156.21   1192.71  365.54  58.69  356.84  60.38  8.70    84.20  
1 1 1 0   -9  8  o 17 630.26  143.39 18200.82  5070.78  18200.82 5070.78  0.00      0.00     630.26  143.39 ?       ?      0.00    143.39 
1 1 1 0   -9  9  o 7  62.21   23.26  85.08     111.78   85.08    111.78   0.00      0.00     62.21   23.26  ?       ?      0.00    23.26  
1 1 1 0   -9  10 o 19 58.66   23.28  53.07     116.95   53.07    116.95   0.00      0.00     58.66   23.28  ?       ?      0.00    23.28  
1 1 1 0   -9  11 f 0  681.68  128.42 17374.35  4841.20  17374.35 4841.20  0.00      0.00     681.68  128.42 ?       ?      0.00    128.42 
1 1 1 0   -9  12 o 3  79.16   22.71  185.60    108.58   173.01   130.49   213.94    195.77   78.41   25.39  89.94   31.13  -11.53  40.17  
1 1 1 0   -9  13 o 6  785.60  92.74  20733.51  4101.90  21068.29 5799.90  20398.47  5802.03  722.62  144.86 706.14  147.88 16.48   207.01 
1 1 1 0   -9  14 o 16 57.25   20.19  83.11     82.55    91.33    96.09    59.96     161.25   60.79   21.75  67.19   27.11  -6.41   34.76  
1 1 1 0   -9  15 o 7  520.60  57.19  8525.93   1681.12  8467.18  2374.15  8585.01   2380.79  492.33  87.19  496.27  86.72  -3.94   122.98 
1 1 1 0   -9  16 o 17 365.15  58.82  4243.59   1191.07  4243.59  1191.07  0.00      0.00     365.15  58.82  ?       ?      0.00    58.82  
1 1 1 0   -9  17 o 8  562.10  104.23 11569.57  3239.36  0.00     0.00     11569.57  3239.36  ?       ?      562.10  104.23 0.00    104.23 
1 1 1 0   -9  18 o 12 640.44  73.75  13575.37  2661.93  13287.71 3760.32  13864.32  3768.77  579.94  116.99 596.71  114.18 -16.77  163.47 
1 1 1 0   -9  19 o 3  95.62   23.69  278.01    129.38   262.88   150.12   321.71    255.08   93.36   26.68  106.05  35.56  -12.69  44.45  
1 1 1 0   -9  20 o 3  429.91  82.59  6983.65   1964.29  0.00     0.00     6983.65   1964.29  ?       ?      429.91  82.59  0.00    82.59  
1 1 1 0   -9  21 o 15 295.58  51.68  2901.76   845.08   0.00     0.00     2901.76   845.08   ?       ?      295.58  51.68  0.00    51.68  
1 1 1 0   -9  22 o 7  86.21   22.46  228.02    112.23   197.00   125.73   349.71    249.04   81.01   24.75  107.26  35.10  -26.26  42.95  
1 1 1 0   -9  23 o 2  61.24   21.87  97.37     97.12    88.74    106.14   141.76    240.80   61.10   22.70  84.12   33.41  -23.03  40.39  
1 1 1 0   -9  24 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   -9  25 o 6  48.51   19.96  26.28     89.51    26.28    89.51    0.00      0.00     48.51   19.96  ?       ?      0.00    19.96  
1 1 1 0   -9  26 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   -9  27 o 18 136.15  40.28  667.92    336.95   0.00     0.00     667.92    336.95   ?       ?      136.15  40.28  0.00    40.28  
1 1 1 0   -8  1  o 14 526.57  38.78  8383.60   1164.01  7595.41  1425.33  9961.87   2016.93  491.99  51.21  550.36  65.10  -58.37  82.83  
1 1 1 0   -8  2  o 10 132.56  13.18  512.21    98.99    582.55   120.63   367.13    173.23   141.14  15.12  109.63  27.56  31.51   31.44  
1 1 1 0   -8  3  o 9  228.23  23.05  1537.15   297.90   852.25   419.60   2233.21   423.01   164.04  43.75  274.20  27.23  -110.16 51.54  
1 1 1 0   -8  4  o 7  56.06   12.42  94.25     38.93    2.96     45.51    343.03    75.13    33.16   13.98  108.34  12.30  -75.19  18.62  
1 1 1 0   -8  5  f 0  498.23  55.74  8004.22   1566.93  7174.81  2215.67  8834.09   2216.29  433.32  91.92  496.36  80.54  -63.04  122.21 
1 1 1 0   -8  6  o 14 60.70   18.37  107.89    69.45    0.00     0.00     107.89    69.45    ?       ?      60.70   18.37  0.00    18.37  
1 1 1 0   -8  7  x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   -8  8  f 0  144.30  24.08  625.72    192.43   0.00     0.00     625.72    192.43   ?       ?      144.30  24.08  0.00    24.08  
1 1 1 0   -8  9  o 7  540.69  62.82  9570.57   1913.70  10613.48 2706.54  8527.91   2706.21  536.13  91.20  462.89  104.34 73.24   138.58 
1 1 1 0   -8  10 o 17 74.23   17.42  165.89    72.94    173.05   107.08   159.70    99.62    76.53   22.73  73.61   21.93  2.92    31.58  
1 1 1 0   -8  11 o 2  55.87   22.09  50.03     104.92   0.00     0.00     50.03     104.92   ?       ?      55.87   22.09  0.00    22.09  
1 1 1 0   -8  12 o 18 216.68  33.82  1408.15   406.91   1408.15  406.91   0.00      0.00     216.68  33.82  ?       ?      0.00    33.82  
1 1 1 0   -8  13 o 2  678.34  126.92 17089.32  4760.76  17089.32 4760.76  0.00      0.00     678.34  126.92 ?       ?      0.00    126.92 
1 1 1 0   -8  14 o 6  323.55  49.84  3198.79   896.02   3198.79  896.02   0.00      0.00     323.55  49.84  ?       ?      0.00    49.84  
1 1 1 0   -8  15 o 13 561.80  60.27  9825.42   1913.31  9279.74  2704.09  10372.51  2707.57  518.49  94.32  554.61  87.98  -36.12  128.98 
1 1 1 0   -8  16 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   -8  17 o 19 126.73  20.21  477.29    142.08   330.64   176.63   746.14    239.16   104.49  28.61  157.47  27.45  -52.98  39.65  
1 1 1 0   -8  18 o 10 162.06  22.10  776.56    200.29   945.92   254.12   498.82    325.43   178.37  25.55  129.06  39.89  49.31   47.37  
1 1 1 0   -8  19 o 4  896.76  126.27 32588.72  6320.69  30814.81 8936.20  34364.71  8941.42  669.54  209.39 741.18  203.82 -71.64  292.21 
1 1 1 0   -8  20 o 6  219.17  35.09  1466.62   426.55   1466.62  426.55   0.00      0.00     219.17  35.09  ?       ?      0.00    35.09  
1 1 1 0   -8  21 o 16 149.52  20.47  664.92    171.07   641.59   209.98   710.97    295.02   145.31  26.13  150.63  34.82  -5.32   43.53  
1 1 1 0   -8  22 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   -8  23 o 9  410.53  90.03  7356.64   2063.33  0.00     0.00     7356.64   2063.33  ?       ?      410.53  90.03  0.00    90.03  
1 1 1 0   -8  24 f 0  92.24   33.08  238.09    222.51   0.00     0.00     238.09    222.51   ?       ?      92.24   33.08  0.00    33.08  
1 1 1 0   -8  25 o 18 58.45   19.87  95.11     79.63    103.19   85.53    42.58     218.09   60.70   20.59  72.14   30.53  -11.44  36.82  
1 1 1 0   -8  26 o 15 271.23  30.75  2335.58   470.33   2195.72  649.35   2489.93   682.17   247.71  47.39  265.05  46.53  -17.34  66.41  
1 1 1 0   -8  27 f 0  53.95   21.75  47.06     103.65   47.06    103.65   0.00      0.00     53.95   21.75  ?       ?      0.00    21.75  
1 1 1 0   -8  28 o 18 80.44   24.03  204.72    119.46   204.72   119.46   0.00      0.00     80.44   24.03  ?       ?      0.00    24.03  
1 1 1 0   -7  1  o 14 728.09  84.47  17780.71  3465.18  17780.71 3465.18  0.00      0.00     728.09  84.47  ?       ?      0.00    84.47  
1 1 1 0   -7  2  o 10 184.90  14.48  992.09    152.47   972.25   186.20   1032.46   265.62   182.48  18.01  186.60  25.46  -4.12   31.19  
1 1 1 0   -7  3  o 1  265.81  26.32  2082.35   396.30   1.86     558.39   4193.85   562.54   111.37  48.02  378.17  26.07  -266.80 54.64  
1 1 1 0   -7  4  o 6  461.50  47.46  6546.57   1239.34  -3.04    1751.06  13120.59  1754.32  183.61  81.88  655.11  46.96  -471.50 94.39  
1 1 1 0   -7  5  o 1  416.08  44.61  5316.59   1048.83  5408.71  1483.09  5224.42   1483.45  404.90  66.08  396.69  67.56  8.20    94.51  
1 1 1 0   -7  6  o 2  501.18  55.86  8012.58   1579.96  8121.25  2234.17  7903.88   2234.64  475.80  84.91  467.60  86.43  8.20    121.16 
1 1 1 0   -7  7  o 5  56.66   12.22  96.18     38.56    64.84    47.68    155.44    65.56    47.90   15.34  71.85   16.27  -23.95  22.36  
1 1 1 0   -7  8  o 11 498.36  57.02  8056.68   1602.03  8800.32  2265.81  7313.31   2265.41  491.66  83.25  435.13  93.48  56.53   125.17 
1 1 1 0   -7  9  o 13 209.19  32.44  1332.68   376.92   0.00     0.00     1332.68   376.92   ?       ?      209.19  32.44  0.00    32.44  
1 1 1 0   -7  10 o 17 438.40  78.96  6865.06   1914.11  0.00     0.00     6865.06   1914.11  ?       ?      438.40  78.96  0.00    78.96  
1 1 1 0   -7  11 o 7  106.88  19.56  342.10    115.61   0.00     0.00     342.10    115.61   ?       ?      106.88  19.56  0.00    19.56  
1 1 1 0   -7  12 o 18 163.91  17.44  786.29    161.56   763.03   227.53   809.94    229.43   159.66  25.70  164.76  25.04  -5.10   35.88  
1 1 1 0   -7  13 o 7  257.06  27.09  1948.30   393.70   2108.94  555.75   1786.49   557.80   264.47  37.67  241.72  41.70  22.75   56.20  
1 1 1 0   -7  14 o 13 924.18  115.72 30799.17  6005.25  29133.46 8492.08  32465.36  8493.32  762.53  193.66 832.27  182.78 -69.74  266.29 
1 1 1 0   -7  15 o 11 432.40  68.88  5922.46   1652.47  5922.46  1652.47  0.00      0.00     432.40  68.88  ?       ?      0.00    68.88  
1 1 1 0   -7  16 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   -7  17 o 15 777.13  96.27  21407.31  4203.09  21085.18 5943.07  21729.65  5945.07  671.71  156.96 687.64  154.39 -15.93  220.17 
1 1 1 0   -7  18 o 5  759.85  94.89  20874.57  4049.27  19501.11 5725.03  22249.48  5728.04  619.14  159.95 689.03  149.15 -69.89  218.70 
1 1 1 0   -7  19 f 0  361.25  38.24  3927.33   781.07   3857.87  1095.87  3999.04   1113.52  348.85  56.66  355.41  56.46  -6.56   79.99  
1 1 1 0   -7  20 o 7  230.74  25.66  1572.80   334.18   1449.84  447.25   1728.20   502.81   218.12  37.04  238.24  38.04  -20.12  53.10  
1 1 1 0   -7  21 f 0  776.27  253.00 66014.26  12942.13 64816.84 18301.83 67211.97  18304.03 448.42  218.68 458.30  222.40 -9.88   311.90 
1 1 1 0   -7  22 o 4  363.47  63.02  4532.01   1267.34  4532.01  1267.34  0.00      0.00     363.47  63.02  ?       ?      0.00    63.02  
1 1 1 0   -7  23 o 9  73.26   19.34  162.76    82.51    138.76   93.66    245.93    174.36   68.79   21.43  91.18   29.34  -22.38  36.33  
1 1 1 0   -7  24 o 5  69.06   20.79  142.40    89.14    76.40    101.48   365.28    186.50   58.59   22.11  107.96  29.33  -49.37  36.73  
1 1 1 0   -7  25 o 4  81.54   30.29  170.26    189.03   0.00     0.00     170.26    189.03   ?       ?      81.54   30.29  0.00    30.29  
1 1 1 0   -7  26 o 12 73.64   29.68  97.27     193.06   0.00     0.00     97.27     193.06   ?       ?      73.64   29.68  0.00    29.68  
1 1 1 0   -7  27 o 16 123.05  19.51  462.19    133.20   493.04   161.69   397.03    234.98   125.72  23.26  109.80  33.89  15.92   41.11  
1 1 1 0   -7  28 o 3  74.26   21.58  172.00    97.45    152.83   110.25   240.49    208.36   71.21   23.36  89.21   32.01  -17.99  39.63  
1 1 1 0   -7  29 o 16 47.58   19.94  19.63     91.60    19.63    91.60    0.00      0.00     47.58   19.94  ?       ?      0.00    19.94  
1 1 1 0   -6  1  o 13 269.66  40.77  2190.57   611.45   2190.57  611.45   0.00      0.00     269.66  40.77  ?       ?      0.00    40.77  
1 1 1 0   -6  2  o 1  824.31  205.57 34813.51  9694.54  34813.51 9694.54  0.00      0.00     824.31  205.57 ?       ?      0.00    205.57 
1 1 1 0   -6  3  o 3  286.25  28.74  2410.83   465.90   2.64     657.40   4840.89   660.38   121.33  52.21  406.67  28.47  -285.34 59.47  
1 1 1 0   -6  4  o 18 300.42  30.60  2664.28   520.29   1204.41  734.82   4131.93   736.78   196.50  59.80  373.45  34.77  -176.96 69.17  
1 1 1 0   -6  5  o 4  443.25  46.96  5966.25   1176.83  6187.84  1664.19  5744.60   1664.40  438.89  68.27  420.51  71.51  18.39   98.86  
1 1 1 0   -6  6  o 19 422.28  69.27  5815.52   1621.15  0.00     0.00     5815.52   1621.15  ?       ?      422.28  69.27  0.00    69.27  
1 1 1 0   -6  7  o 4  130.22  13.80  494.74    101.56   436.56   141.32   556.88    146.04   120.86  21.14  137.31  19.04  -16.45  28.45  
1 1 1 0   -6  8  o 10 466.22  51.14  6816.79   1346.22  6976.23  1903.72  6657.31   1903.96  449.85  76.45  437.05  78.78  12.80   109.78 
1 1 1 0   -6  9  o 17 440.94  48.55  6099.02   1208.52  6362.69  1708.94  5835.25   1709.26  430.44  71.68  408.07  75.75  22.38   104.29 
1 1 1 0   -6  10 o 5  376.59  40.64  4364.59   864.68   4503.86  1222.55  4225.19   1223.12  369.13  59.73  355.41  62.21  13.72   86.25  
1 1 1 0   -6  11 o 11 589.46  71.52  11972.44  2370.65  12396.83 3352.57  11548.02  3352.63  540.33  111.77 512.55  116.58 27.78   161.51 
1 1 1 0   -6  12 o 9  354.18  58.38  4105.76   1145.59  0.00     0.00     4105.76   1145.59  ?       ?      354.18  58.38  0.00    58.38  
1 1 1 0   -6  13 o 7  124.05  20.02  458.10    137.69   0.00     0.00     458.10    137.69   ?       ?      124.05  20.02  0.00    20.02  
1 1 1 0   -6  14 o 19 450.26  75.64  6764.81   1885.98  0.00     0.00     6764.81   1885.98  ?       ?      450.26  75.64  0.00    75.64  
1 1 1 0   -6  15 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   -6  16 f 0  791.23  181.88 29038.06  8088.25  0.00     0.00     29038.06  8088.25  ?       ?      791.23  181.88 0.00    181.88 
1 1 1 0   -6  17 o 7  85.43   19.63  219.44    94.22    219.44   94.22    0.00      0.00     85.43   19.63  ?       ?      0.00    19.63  
1 1 1 0   -6  18 o 4  288.48  44.70  2556.30   716.37   2556.30  716.37   0.00      0.00     288.48  44.70  ?       ?      0.00    44.70  
1 1 1 0   -6  19 o 14 72.57   20.24  157.40    87.49    157.40   87.49    0.00      0.00     72.57   20.24  ?       ?      0.00    20.24  
1 1 1 0   -6  20 o 9  498.93  53.91  7780.21   1519.68  7269.68  2146.01  8293.72   2152.29  456.27  85.06  494.32  78.46  -38.04  115.72 
1 1 1 0   -6  21 o 13 505.23  54.99  8005.04   1569.20  7590.16  2214.25  8423.64   2224.14  465.25  86.07  495.65  80.96  -30.40  118.17 
1 1 1 0   -6  22 o 13 196.28  21.11  1135.57   234.13   1019.10  326.06   1259.55   336.40   182.65  32.28  204.43  29.52  -21.79  43.74  
1 1 1 0   -6  23 o 18 298.98  32.09  2718.06   542.15   2725.92  764.54   2710.11   768.93   290.28  47.52  289.09  48.02  1.19    67.56  
1 1 1 0   -6  24 o 11 44.78   17.85  30.70     69.01    34.89    86.15    23.18     115.28   49.40   19.86  54.01   22.48  -4.61   30.00  
1 1 1 0   -6  25 o 12 141.53  17.45  595.52    138.74   585.07   188.45   607.89    205.03   137.99  24.70  140.09  26.46  -2.10   36.20  
1 1 1 0   -6  26 o 13 316.92  35.71  3231.05   638.41   3111.55  900.30   3351.93   905.43   289.71  56.16  303.59  53.93  -13.88  77.86  
1 1 1 0   -6  27 o 10 114.34  27.53  418.71    178.53   0.00     0.00     418.71    178.53   ?       ?      114.34  27.53  0.00    27.53  
1 1 1 0   -6  28 o 16 53.97   23.54  -9.79     137.27   0.00     0.00     -9.79     137.27   ?       ?      53.97   23.54  0.00    23.54  
1 1 1 0   -6  29 o 6  199.64  23.11  1243.51   259.96   1206.12  358.22   1285.10   377.84   187.97  34.47  193.39  35.34  -5.42   49.36  
1 1 1 0   -5  1  o 13 753.25  58.86  17206.97  2525.09  16038.10 3092.51  19545.06  4373.82  714.10  76.64  764.60  102.21 -50.50  127.75 
1 1 1 0   -5  2  o 3  220.42  22.10  1418.49   275.90   0.68     388.97   2854.21   391.42   94.56   40.41  313.47  21.89  -218.91 45.96  
1 1 1 0   -5  3  o 15 179.79  18.36  942.23    186.82   0.90     262.72   1905.22   265.73   78.04   33.28  256.35  18.17  -178.31 37.92  
1 1 1 0   -5  4  o 7  419.50  65.86  5505.00   1533.78  5505.00  1533.78  0.00      0.00     419.50  65.86  ?       ?      0.00    65.86  
1 1 1 0   -5  5  o 18 101.37  15.63  303.04    88.02    303.04   88.02    0.00      0.00     101.37  15.63  ?       ?      0.00    15.63  
1 1 1 0   -5  6  o 10 250.05  37.74  1880.20   524.89   1880.20  524.89   0.00      0.00     250.05  37.74  ?       ?      0.00    37.74  
1 1 1 0   -5  7  o 19 236.59  24.35  1643.40   326.03   1716.43  460.91   1570.27   461.24   239.26  34.56  228.11  36.45  11.15   50.23  
1 1 1 0   -5  8  o 9  473.25  50.92  6903.14   1361.73  6984.18  1925.66  6822.09   1925.88  458.08  75.88  451.73  77.03  6.35    108.13 
1 1 1 0   -5  9  o 4  319.22  50.43  3203.64   893.48   3203.64  893.48   0.00      0.00     319.22  50.43  ?       ?      0.00    50.43  
1 1 1 0   -5  10 o 4  533.53  61.01  9268.85   1835.14  9673.04  2595.24  8864.64   2595.33  509.80  92.07  481.00  97.34  28.80   133.98 
1 1 1 0   -5  11 f 0  300.63  31.71  2716.54   539.05   2854.02  762.30   2579.05   762.36   301.46  45.46  284.74  48.37  16.72   66.38  
1 1 1 0   -5  12 o 5  434.39  78.97  6806.57   1896.84  0.00     0.00     6806.57   1896.84  ?       ?      434.39  78.97  0.00    78.97  
1 1 1 0   -5  13 o 2  396.56  43.02  4874.17   963.77   5012.58  1362.86  4735.71   1363.10  386.37  63.66  373.39  66.01  12.98   91.70  
1 1 1 0   -5  14 o 16 177.03  18.65  919.62    186.73   966.07   264.22   873.28    263.92   179.61  26.41  170.17  27.99  9.44    38.48  
1 1 1 0   -5  15 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   -5  16 f 0  361.20  56.68  4071.56   1136.52  0.00     0.00     4071.56   1136.52  ?       ?      361.20  56.68  0.00    56.68  
1 1 1 0   -5  17 o 1  358.18  55.75  3971.42   1109.13  0.00     0.00     3971.42   1109.13  ?       ?      358.18  55.75  0.00    55.75  
1 1 1 0   -5  18 o 2  128.26  14.47  480.15    104.66   487.01   147.18   473.13    148.85   128.12  20.72  126.12  21.32  1.99    29.73  
1 1 1 0   -5  19 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   -5  20 o 13 640.99  183.83 25544.64  7114.91  25544.64 7114.91  0.00      0.00     640.99  183.83 ?       ?      0.00    183.83 
1 1 1 0   -5  21 o 8  95.15   22.18  273.86    118.88   273.86   118.88   0.00      0.00     95.15   22.18  ?       ?      0.00    22.18  
1 1 1 0   -5  22 o 12 383.29  40.73  4463.77   882.44   4398.43  1246.49  4529.43   1249.44  368.45  61.07  374.62  60.13  -6.17   85.70  
1 1 1 0   -5  23 o 7  233.03  24.80  1612.81   326.71   1658.67  459.56   1565.95   464.57   232.42  35.57  225.02  37.27  7.41    51.52  
1 1 1 0   -5  24 o 7  77.28   16.74  180.47    72.12    216.67   92.59    124.63    114.99   84.40   19.50  68.32   23.85  16.08   30.81  
1 1 1 0   -5  25 o 4  158.58  18.02  745.46    161.13   676.28   222.08   822.34    234.13   148.07  27.13  164.16  25.68  -16.10  37.36  
1 1 1 0   -5  26 o 12 93.66   16.08  263.70    83.34    322.31   108.14   178.00    130.77   103.00  18.99  77.76   25.44  25.25   31.74  
1 1 1 0   -5  27 o 15 229.87  25.43  1627.07   330.02   1642.37  463.30   1611.32   470.21   222.58  37.60  219.56  38.72  3.02    53.97  
1 1 1 0   -5  28 o 13 63.93   18.31  124.86    70.60    138.48   86.76    98.15     121.48   67.50   20.55  63.99   24.18  3.51    31.73  
1 1 1 0   -5  29 o 17 72.64   25.69  151.61    133.72   0.00     0.00     151.61    133.72   ?       ?      72.64   25.69  0.00    25.69  
1 1 1 0   -5  30 o 9  60.86   24.70  66.44     134.64   0.00     0.00     66.44     134.64   ?       ?      60.86   24.70  0.00    24.70  
1 1 1 0   -4  1  o 16 845.32  338.11 89218.81  24843.03 0.00     0.00     89218.81  24843.03 ?       ?      845.32  338.11 0.00    338.11 
1 1 1 0   -4  2  o 18 552.77  90.85  9992.43   2782.97  0.00     0.00     9992.43   2782.97  ?       ?      552.77  90.85  0.00    90.85  
1 1 1 0   -4  3  o 3  756.58  346.36 121547.20 33844.77 0.00     0.00     121547.20 33844.77 ?       ?      756.58  346.36 0.00    346.36 
1 1 1 0   -4  4  o 7  706.46  77.55  15709.57  3093.52  15689.32 4374.87  15729.82  4374.92  669.97  118.06 671.05  117.87 -1.07   166.83 
1 1 1 0   -4  5  f 0  948.31  114.76 31066.43  6120.33  31527.52 8655.43  30605.32  8655.47  854.77  181.98 835.97  185.23 18.80   259.67 
1 1 1 0   -4  6  o 5  346.08  35.81  3543.09   701.18   3766.76  991.56   3319.37   991.67   352.04  50.51  328.62  54.47  23.42   74.29  
1 1 1 0   -4  7  o 7  680.48  127.34 17205.19  4791.44  17205.19 4791.44  0.00      0.00     680.48  127.34 ?       ?      0.00    127.34 
1 1 1 0   -4  8  o 5  646.81  121.96 15664.57  4362.53  15664.57 4362.53  0.00      0.00     646.81  121.96 ?       ?      0.00    121.96 
1 1 1 0   -4  9  o 6  240.25  36.42  1741.94   486.54   1741.94  486.54   0.00      0.00     240.25  36.42  ?       ?      0.00    36.42  
1 1 1 0   -4  10 o 15 383.35  40.49  4454.43   877.63   4430.70  1241.06  4478.17   1241.25  370.97  60.35  373.24  59.96  -2.27   85.07  
1 1 1 0   -4  11 o 3  286.85  29.88  2455.10   484.84   2485.93  685.56   2424.24   685.78   282.87  43.62  278.95  44.30  3.92    62.17  
1 1 1 0   -4  12 o 12 129.16  13.54  487.29    98.87    431.58   139.40   543.69    140.26   119.97  21.01  135.56  18.51  -15.59  27.99  
1 1 1 0   -4  13 o 4  241.18  25.02  1728.08   341.42   1697.97  482.64   1758.24   483.05   234.49  37.09  239.01  36.35  -4.52   51.93  
1 1 1 0   -4  14 o 7  544.94  128.41 14184.55  3950.80  14184.55 3950.80  0.00      0.00     544.94  128.41 ?       ?      0.00    128.41 
1 1 1 0   -4  15 o 18 136.60  21.26  556.10    161.26   0.00     0.00     556.10    161.26   ?       ?      136.60  21.26  0.00    21.26  
1 1 1 0   -4  16 o 13 421.90  70.36  5897.41   1644.02  0.00     0.00     5897.41   1644.02  ?       ?      421.90  70.36  0.00    70.36  
1 1 1 0   -4  17 o 10 516.31  88.29  9053.85   2522.87  0.00     0.00     9053.85   2522.87  ?       ?      516.31  88.29  0.00    88.29  
1 1 1 0   -4  18 o 11 291.98  44.71  2593.22   725.59   0.00     0.00     2593.22   725.59   ?       ?      291.98  44.71  0.00    44.71  
1 1 1 0   -4  19 o 7  737.18  261.33 49725.12  13847.46 0.00     0.00     49725.12  13847.46 ?       ?      737.18  261.33 0.00    261.33 
1 1 1 0   -4  20 o 6  68.60   13.95  140.69    53.05    112.57   74.46    169.69    75.61    62.25   19.05  75.07   17.81  -12.82  26.09  
1 1 1 0   -4  21 o 13 543.72  61.31  9582.30   1880.37  8802.69  2658.11  10363.24  2660.38  478.78  99.94  533.13  90.14  -54.35  134.59 
1 1 1 0   -4  22 o 6  222.53  34.46  1501.54   426.00   1501.54  426.00   0.00      0.00     222.53  34.46  ?       ?      0.00    34.46  
1 1 1 0   -4  23 o 1  348.71  56.70  3920.92   1096.00  3920.92  1096.00  0.00      0.00     348.71  56.70  ?       ?      0.00    56.70  
1 1 1 0   -4  24 o 14 172.63  19.41  880.34    189.05   844.40   257.31   922.48    278.66   166.58  27.89  173.94  28.92  -7.35   40.18  
1 1 1 0   -4  25 o 1  491.09  60.15  8444.80   1660.32  7951.22  2346.58  8939.61   2349.51  413.97  99.90  452.61  93.52  -38.63  136.84 
1 1 1 0   -4  26 o 4  424.22  50.52  6144.85   1206.22  5398.05  1703.29  6896.15   1708.41  346.89  85.97  414.31  74.57  -67.42  113.81 
1 1 1 0   -4  27 o 5  168.23  19.59  850.50    185.66   821.34   251.50   885.43    275.23   161.62  28.13  167.11  29.78  -5.49   40.97  
1 1 1 0   -4  28 o 15 118.51  17.80  425.11    117.33   402.74   146.33   465.39    196.36   113.37  23.27  119.85  28.88  -6.49   37.09  
1 1 1 0   -4  29 o 14 118.51  18.16  428.37    119.63   451.95   149.06   385.70    200.56   120.07  22.45  107.78  30.85  12.28   38.15  
1 1 1 0   -4  30 o 17 163.16  20.52  823.20    187.95   681.54   250.83   1004.57   283.81   141.53  31.67  174.44  29.39  -32.91  43.20  
1 1 1 0   -4  31 o 16 73.08   28.87  132.29    179.06   0.00     0.00     132.29    179.06   ?       ?      73.08   28.87  0.00    28.87  
1 1 1 0   -3  1  o 8  276.93  27.99  2248.61   438.89   -0.74    620.22   4504.84   621.16   118.46  50.84  392.99  27.71  -274.53 57.90  
1 1 1 0   -3  2  o 10 659.07  71.96  13539.41  2678.49  0.82     3787.51  27084.44  3788.41  266.08  119.41 935.00  71.11  -668.92 138.98 
1 1 1 0   -3  3  o 6  452.44  47.14  6125.60   1206.47  6292.65  1706.21  5958.55   1706.21  449.04  68.34  435.58  70.65  13.46   98.30  
1 1 1 0   -3  4  o 8  756.20  84.27  18265.05  3595.95  18155.60 5085.43  18374.51  5085.47  708.42  129.83 713.88  128.83 -5.46   182.90 
1 1 1 0   -3  5  o 14 611.22  103.55 12581.89  3503.96  0.00     0.00     12581.89  3503.96  ?       ?      611.22  103.55 0.00    103.55 
1 1 1 0   -3  6  o 17 863.51  190.06 32914.32  9165.40  0.00     0.00     32914.32  9165.40  ?       ?      863.51  190.06 0.00    190.06 
1 1 1 0   -3  7  o 12 479.08  50.22  6910.23   1360.57  6851.89  1924.11  6968.58   1924.16  464.59  74.67  469.04  73.90  -4.45   105.06 
1 1 1 0   -3  8  o 17 859.77  256.38 48863.30  13606.37 0.00     0.00     48863.30  13606.37 ?       ?      859.77  256.38 0.00    256.38 
1 1 1 0   -3  9  f 0  1117.78 198.05 62180.53  12243.37 62219.98 17314.73 62141.08  17314.76 761.76  288.46 760.82  288.38 0.94    407.88 
1 1 1 0   -3  10 o 14 268.20  40.91  2186.65   610.03   2186.65  610.03   0.00      0.00     268.20  40.91  ?       ?      0.00    40.91  
1 1 1 0   -3  11 o 5  469.11  81.78  7618.83   2122.29  7618.83  2122.29  0.00      0.00     469.11  81.78  ?       ?      0.00    81.78  
1 1 1 0   -3  12 o 18 258.44  26.78  1983.08   391.51   1979.25  553.55   1986.90   553.80   253.53  39.31  254.06  39.23  -0.53   55.54  
1 1 1 0   -3  13 o 18 267.52  27.86  2136.15   421.55   2093.48  596.01   2178.86   596.30   259.02  41.48  264.82  40.51  -5.80   57.98  
1 1 1 0   -3  14 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   -3  15 o 6  97.11   15.72  280.11    84.67    280.11   84.67    0.00      0.00     97.11   15.72  ?       ?      0.00    15.72  
1 1 1 0   -3  16 o 19 705.38  91.80  18440.99  3629.20  17785.35 5132.38  19096.69  5132.56  578.43  152.44 614.06  147.46 -35.63  212.09 
1 1 1 0   -3  17 o 17 104.46  11.81  318.34    69.56    293.52   96.73    344.92    100.12   99.27   17.62  107.98  16.69  -8.72   24.27  
1 1 1 0   -3  18 o 11 612.12  67.88  11914.55  2345.26  11625.73 3316.56  12203.42  3316.83  568.36  105.53 586.11  102.30 -17.75  146.98 
1 1 1 0   -3  19 f 0  702.86  80.28  16179.64  3181.32  15229.56 4498.90  17129.86  4499.22  624.14  129.80 675.66  120.41 -51.52  177.05 
1 1 1 0   -3  20 o 7  481.59  82.43  7882.21   2197.04  0.00     0.00     7882.21   2197.04  ?       ?      481.59  82.43  0.00    82.43  
1 1 1 0   -3  21 o 15 252.13  39.14  1951.25   548.15   0.00     0.00     1951.25   548.15   ?       ?      252.13  39.14  0.00    39.14  
1 1 1 0   -3  22 o 18 227.39  23.78  1527.10   305.88   1462.94  431.14   1592.13   434.03   218.82  35.54  229.00  34.05  -10.19  49.22  
1 1 1 0   -3  23 o 11 363.01  38.48  3994.41   789.63   3407.53  1113.28  4588.57   1120.17  321.58  62.56  381.08  52.61  -59.51  81.74  
1 1 1 0   -3  24 o 4  217.92  34.09  1453.52   412.50   1453.52  412.50   0.00      0.00     217.92  34.09  ?       ?      0.00    34.09  
1 1 1 0   -3  25 o 19 59.08   19.27  98.88     75.07    98.88    75.07    0.00      0.00     59.08   19.27  ?       ?      0.00    19.27  
1 1 1 0   -3  26 o 9  203.86  22.38  1245.97   257.63   1167.24  356.20   1332.32   373.06   192.37  33.47  206.26  32.59  -13.88  46.71  
1 1 1 0   -3  27 o 18 44.52   17.37  36.86     64.07    32.28    72.86    52.48     134.52   45.77   18.31  60.62   24.65  -14.85  30.71  
1 1 1 0   -3  28 o 11 290.31  33.32  2724.11   545.27   2426.28  767.17   3028.17   775.16   251.45  54.71  289.84  48.29  -38.39  72.97  
1 1 1 0   -3  29 o 10 187.11  22.08  1077.49   232.56   916.27   320.03   1257.90   338.53   164.38  34.99  196.34  31.07  -31.96  46.79  
1 1 1 0   -3  30 o 9  41.23   18.14  -15.62    83.21    -52.38   103.30   52.31     140.43   42.48   19.33  60.36   24.94  -17.89  31.55  
1 1 1 0   -3  31 o 19 50.47   21.12  27.39     102.51   27.39    102.51   0.00      0.00     50.47   21.12  ?       ?      0.00    21.12  
1 1 1 0   -2  1  o 12 174.32  17.72  885.18    174.90   0.95     246.98   1774.67   247.71   75.73   32.28  247.47  17.55  -171.74 36.74  
1 1 1 0   -2  2  o 12 121.21  12.45  427.10    85.41    -41.37   120.32   903.07    121.28   48.83   21.64  176.78  12.02  -127.95 24.75  
1 1 1 0   -2  3  o 7  103.95  10.60  313.88    62.39    314.37   88.14    313.38    88.33    103.37  15.32  103.19  15.38  0.18    21.71  
1 1 1 0   -2  4  o 10 226.08  23.00  1493.41   294.35   1489.94  416.24   1496.88   416.29   223.66  33.44  224.21  33.36  -0.55   47.24  
1 1 1 0   -2  5  o 18 99.29   10.23  286.41    57.49    302.47   81.23    270.30    81.37    101.51  14.34  95.69   15.33  5.81    20.99  
1 1 1 0   -2  6  f 0  919.25  109.17 28691.00  5648.47  30265.39 7988.17  27116.62  7988.12  862.29  167.41 796.31  179.10 65.98   245.16 
1 1 1 0   -2  7  o 1  598.62  100.87 12005.29  3343.31  0.00     0.00     12005.29  3343.31  ?       ?      598.62  100.87 0.00    100.87 
1 1 1 0   -2  8  o 16 837.13  185.91 31248.12  8701.40  0.00     0.00     31248.12  8701.40  ?       ?      837.13  185.91 0.00    185.91 
1 1 1 0   -2  9  o 9  664.15  122.19 16112.79  4487.11  0.00     0.00     16112.79  4487.11  ?       ?      664.15  122.19 0.00    122.19 
1 1 1 0   -2  10 o 14 106.48  11.14  329.79    67.11    335.93   94.67    323.58    95.15    106.76  15.93  104.66  16.37  2.10    22.85  
1 1 1 0   -2  11 o 11 325.32  33.76  3152.25   621.36   3103.75  878.67   3200.77   878.81   316.18  50.08  321.59  49.16  -5.42   70.17  
1 1 1 0   -2  12 o 3  247.51  37.99  1872.85   522.62   1872.85  522.62   0.00      0.00     247.51  37.99  ?       ?      0.00    37.99  
1 1 1 0   -2  13 o 9  248.36  38.48  1902.13   530.87   1902.13  530.87   0.00      0.00     248.36  38.48  ?       ?      0.00    38.48  
1 1 1 0   -2  14 o 4  147.61  22.49  651.97    184.58   0.00     0.00     651.97    184.58   ?       ?      147.61  22.49  0.00    22.49  
1 1 1 0   -2  15 o 16 477.33  54.20  7406.02   1458.88  7461.23  2063.15  7350.81   2063.18  446.03  83.65  441.63  84.46  4.40    118.87 
1 1 1 0   -2  16 f 0  169.66  25.90  865.67    244.30   0.00     0.00     865.67    244.30   ?       ?      169.66  25.90  0.00    25.90  
1 1 1 0   -2  17 f 0  707.38  90.89  18305.74  3605.77  17930.76 5099.29  18680.73  5099.37  593.85  149.66 614.26  146.65 -20.41  209.53 
1 1 1 0   -2  18 o 18 908.37  132.00 33929.57  6682.10  33597.64 9449.90  34261.50  9449.93  701.01  214.67 714.00  213.84 -12.99  303.00 
1 1 1 0   -2  19 o 18 288.09  29.72  2451.14   484.50   2342.36  685.03   2560.02   685.36   276.81  44.63  290.47  42.35  -13.66  61.52  
1 1 1 0   -2  20 o 18 51.64   12.59  79.90     37.00    75.38    46.04    88.12     62.17    50.70   14.86  55.57   17.48  -4.87   22.94  
1 1 1 0   -2  21 f 0  112.74  13.32  371.75    84.54    313.63   116.48   436.43    122.90   102.12  20.58  121.42  18.19  -19.30  27.47  
1 1 1 0   -2  22 o 19 407.51  70.18  5671.61   1582.49  0.00     0.00     5671.61   1582.49  ?       ?      407.51  70.18  0.00    70.18  
1 1 1 0   -2  23 o 19 618.53  174.73 23251.20  6476.47  0.00     0.00     23251.20  6476.47  ?       ?      618.53  174.73 0.00    174.73 
1 1 1 0   -2  24 o 2  326.08  34.66  3211.01   638.92   2934.39  902.62   3488.81   904.53   301.30  54.18  332.38  48.86  -31.08  72.96  
1 1 1 0   -2  25 o 6  50.51   20.81  24.48     97.44    0.00     0.00     24.48     97.44    ?       ?      50.51   20.81  0.00    20.81  
1 1 1 0   -2  26 o 5  264.25  44.16  2296.23   646.33   2296.23  646.33   0.00      0.00     264.25  44.16  ?       ?      0.00    44.16  
1 1 1 0   -2  27 o 8  47.15   19.28  26.18     82.80    26.18    82.80    0.00      0.00     47.15   19.28  ?       ?      0.00    19.28  
1 1 1 0   -2  28 o 7  330.32  39.10  3641.92   727.07   3334.83  1027.48  3949.92   1029.00  283.76  64.54  319.18  58.31  -35.43  86.98  
1 1 1 0   -2  29 o 15 92.62   24.91  274.17    135.29   0.00     0.00     274.17    135.29   ?       ?      92.62   24.91  0.00    24.91  
1 1 1 0   -2  30 o 12 143.32  18.27  626.50    146.94   577.61   205.96   677.18    209.70   132.60  27.94  144.92  26.17  -12.32  38.28  
1 1 1 0   -2  31 o 19 49.43   19.38  50.02     80.10    9.62     110.75   94.36     116.00   50.04   21.48  61.66   23.55  -11.61  31.87  
1 1 1 0   -2  32 o 9  90.06   19.82  259.88    99.69    287.87   137.29   228.66    144.99   92.56   25.18  82.86   26.76  9.70    36.74  
1 1 1 0   -1  1  o 15 4.52    1.87   0.14      0.79     0.14     0.79     0.00      0.00     4.52    1.87   ?       ?      0.00    1.87   
1 1 1 0   -1  2  f 0  828.67  94.77  22519.96  4427.37  21286.27 6261.24  23753.65  6261.27  737.22  152.96 794.00  142.61 -56.79  209.13 
1 1 1 0   -1  3  o 14 266.28  27.15  2078.14   409.20   2195.22  578.71   1961.06   578.69   271.12  38.24  255.28  40.87  15.84   55.97  
1 1 1 0   -1  4  o 8  137.79  13.97  552.14    108.96   537.73   154.06   566.55    154.13   134.95  20.53  138.69  19.93  -3.75   28.62  
1 1 1 0   -1  5  o 13 142.14  14.43  587.66    116.14   602.71   164.21   572.60    164.27   143.02  20.59  139.22  21.22  3.80    29.57  
1 1 1 0   -1  6  o 4  774.04  86.95  19286.36  3796.96  19386.91 5369.72  19185.81  5369.71  726.77  133.63 721.85  134.53 4.92    189.62 
1 1 1 0   -1  7  o 19 68.32   7.38   135.63    28.47    148.11   40.03    122.86    40.50    71.07   10.09  64.41   11.37  6.66    15.20  
1 1 1 0   -1  8  o 3  824.55  338.47 92106.38  25646.93 92106.38 25646.93 0.00      0.00     824.55  338.47 ?       ?      0.00    338.47 
1 1 1 0   -1  9  o 5  169.91  25.28  855.02    239.12   0.00     0.00     855.02    239.12   ?       ?      169.91  25.28  0.00    25.28  
1 1 1 0   -1  10 o 9  45.50   10.20  61.91     25.99    0.00     0.00     61.91     25.99    ?       ?      45.50   10.20  0.00    10.20  
1 1 1 0   -1  11 f 0  629.81  121.87 15249.93  4246.86  0.00     0.00     15249.93  4246.86  ?       ?      629.81  121.87 0.00    121.87 
1 1 1 0   -1  12 o 7  431.10  72.28  6194.17   1725.44  6194.17  1725.44  0.00      0.00     431.10  72.28  ?       ?      0.00    72.28  
1 1 1 0   -1  13 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   -1  14 o 2  256.11  40.05  2041.48   569.59   2041.48  569.59   0.00      0.00     256.11  40.05  ?       ?      0.00    40.05  
1 1 1 0   -1  15 o 6  380.67  66.61  5034.07   1402.71  5034.07  1402.71  0.00      0.00     380.67  66.61  ?       ?      0.00    66.61  
1 1 1 0   -1  16 o 8  40.09   11.91  46.99     29.42    46.99    29.42    0.00      0.00     40.09   11.91  ?       ?      0.00    11.91  
1 1 1 0   -1  17 o 16 390.47  66.82  5181.95   1444.09  5181.95  1444.09  0.00      0.00     390.47  66.82  ?       ?      0.00    66.82  
1 1 1 0   -1  18 o 17 70.58   9.51   145.96    37.57    163.93   52.64    127.30    53.64    74.35   12.79  65.11   14.70  9.24    19.49  
1 1 1 0   -1  19 o 14 408.49  66.08  5369.81   1496.74  0.00     0.00     5369.81   1496.74  ?       ?      408.49  66.08  0.00    66.08  
1 1 1 0   -1  20 o 18 370.84  38.79  4120.08   813.62   3978.48  1150.61  4261.68   1150.65  355.32  58.44  369.25  56.04  -13.93  80.97  
1 1 1 0   -1  21 o 10 207.82  21.48  1267.99   252.58   1236.53  357.01   1299.53   357.40   202.58  31.74  208.03  30.86  -5.46   44.27  
1 1 1 0   -1  22 o 19 218.28  22.72  1406.62   280.50   1393.40  397.26   1419.76   396.13   213.90  33.45  216.12  32.97  -2.22   46.97  
1 1 1 0   -1  23 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   -1  24 o 17 387.62  65.42  5030.24   1403.98  0.00     0.00     5030.24   1403.98  ?       ?      387.62  65.42  0.00    65.42  
1 1 1 0   -1  25 o 14 348.85  59.50  4108.34   1148.94  4108.34  1148.94  0.00      0.00     348.85  59.50  ?       ?      0.00    59.50  
1 1 1 0   -1  26 o 1  357.23  40.18  4067.35   809.70   3801.04  1145.97  4332.86   1144.22  322.08  64.23  350.23  59.01  -28.15  87.22  
1 1 1 0   -1  27 o 1  47.40   19.97  11.24     92.65    0.00     0.00     11.24     92.65    ?       ?      47.40   19.97  0.00    19.97  
1 1 1 0   -1  28 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   -1  29 o 12 130.90  25.27  544.54    183.00   544.54   183.00   0.00      0.00     130.90  25.27  ?       ?      0.00    25.27  
1 1 1 0   -1  30 o 7  44.00   17.87  27.62     70.50    60.82    98.82    -6.79     100.61   54.73   21.50  46.41   20.20  8.31    29.50  
1 1 1 0   -1  31 o 13 150.34  18.86  697.39    159.21   678.20   228.34   715.53    222.09   141.89  29.01  147.05  27.31  -5.16   39.85  
1 1 1 0   -1  32 f 0  336.51  66.56  6214.94   1240.19  5881.47  1754.52  6547.93   1753.28  208.49  87.30  230.28  90.55  -21.79  125.78 
1 1 1 0   0   1  o 5  4.23    2.12   -6.43     2.22     -6.43    2.22     0.00      0.00     4.23    2.12   ?       ?      0.00    2.12   
1 1 1 0   0   2  o 10 733.19  137.25 19983.98  5564.49  19983.98 5564.49  0.00      0.00     733.19  137.25 ?       ?      0.00    137.25 
1 1 1 0   0   3  o 13 484.61  77.45  7477.14   2082.07  7477.14  2082.07  0.00      0.00     484.61  77.45  ?       ?      0.00    77.45  
1 1 1 0   0   4  o 5  784.97  88.69  19932.64  3926.84  20866.33 5553.39  18998.96  5553.38  754.50  133.08 709.38  141.34 45.12   194.13 
1 1 1 0   0   5  o 15 139.32  14.11  564.50    111.32   544.94   157.41   584.07    157.45   135.80  20.86  140.84  20.04  -5.04   28.92  
1 1 1 0   0   6  o 17 215.98  21.95  1362.26   268.42   1357.81  379.60   1366.72   379.61   213.62  31.93  214.37  31.81  -0.74   45.07  
1 1 1 0   0   7  o 8  1022.45 129.75 37805.85  7444.22  38022.37 10527.71 37589.33  10527.71 884.97  210.34 876.79  211.60 8.18    298.36 
1 1 1 0   0   8  o 9  729.22  80.97  16926.47  3332.41  16736.23 4712.73  17116.71  4712.75  682.35  124.91 692.18  123.12 -9.83   175.39 
1 1 1 0   0   9  o 7  751.40  84.62  18221.54  3586.88  17618.49 5072.60  18824.60  5072.64  686.62  133.50 717.04  127.93 -30.42  184.90 
1 1 1 0   0   10 o 8  302.26  31.03  2694.48   530.87   2660.75  750.74   2728.21   750.79   295.89  45.67  299.92  44.99  -4.03   64.11  
1 1 1 0   0   11 o 18 577.63  103.68 11891.80  3311.71  0.00     0.00     11891.80  3311.71  ?       ?      577.63  103.68 0.00    103.68 
1 1 1 0   0   12 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   0   13 o 14 319.65  50.98  3244.13   904.08   0.00     0.00     3244.13   904.08   ?       ?      319.65  50.98  0.00    50.98  
1 1 1 0   0   14 o 12 390.61  42.27  4732.87   932.78   4501.55  1319.09  4964.23   1319.20  362.89  65.74  384.90  61.79  -22.02  90.22  
1 1 1 0   0   15 o 2  122.26  12.69  436.63    87.74    435.13   123.78   438.16    124.40   120.90  18.41  121.33  18.44  -0.42   26.06  
1 1 1 0   0   16 o 13 356.80  61.15  4332.91   1207.43  4332.91  1207.43  0.00      0.00     356.80  61.15  ?       ?      0.00    61.15  
1 1 1 0   0   17 o 7  33.89   11.23  31.43     25.47    31.43    25.47    0.00      0.00     33.89   11.23  ?       ?      0.00    11.23  
1 1 1 0   0   18 o 16 378.34  62.86  4726.49   1317.29  0.00     0.00     4726.49   1317.29  ?       ?      378.34  62.86  0.00    62.86  
1 1 1 0   0   19 o 19 199.15  20.61  1162.59   232.22   947.68   327.50   1379.91   329.32   176.47  33.55  215.62  27.21  -39.15  43.20  
1 1 1 0   0   20 o 4  669.71  142.17 19017.36  5296.61  0.00     0.00     19017.36  5296.61  ?       ?      669.71  142.17 0.00    142.17 
1 1 1 0   0   21 o 19 73.18   11.47  157.91    46.59    164.90   63.09    149.53    69.09    74.22   15.32  70.51   17.22  3.71    23.05  
1 1 1 0   0   22 o 3  87.91   16.69  231.23    81.17    231.23   81.17    0.00      0.00     87.91   16.69  ?       ?      0.00    16.69  
1 1 1 0   0   23 o 6  77.42   19.36  181.33    85.79    0.00     0.00     181.33    85.79    ?       ?      77.42   19.36  0.00    19.36  
1 1 1 0   0   24 o 4  587.63  182.82 24492.34  6821.86  0.00     0.00     24492.34  6821.86  ?       ?      587.63  182.82 0.00    182.82 
1 1 1 0   0   25 o 5  401.94  71.75  5715.44   1594.88  0.00     0.00     5715.44   1594.88  ?       ?      401.94  71.75  0.00    71.75  
1 1 1 0   0   26 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   0   27 o 18 79.78   22.23  195.43    105.62   195.43   105.62   0.00      0.00     79.78   22.23  ?       ?      0.00    22.23  
1 1 1 0   0   28 o 8  128.63  16.96  495.77    122.20   343.61   173.03   647.17    172.59   103.67  28.29  145.68  21.26  -42.01  35.39  
1 1 1 0   0   29 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   0   30 o 16 65.07   23.02  119.77    107.45   119.77   107.45   0.00      0.00     65.07   23.02  ?       ?      0.00    23.02  
1 1 1 0   0   31 o 19 54.46   19.34  81.79     75.90    80.95    111.46   82.53     103.64   59.13   22.95  58.29   22.26  0.84    31.97  
1 1 1 0   0   32 o 8  90.57   18.69  260.88    93.93    258.36   137.32   263.11    128.78   87.41   25.68  88.55   24.50  -1.14   35.49  
1 1 1 0   1   0  o 11 3.54    1.28   0.30      0.33     0.36     0.36     -0.06     0.85     3.79    1.33   4.41    1.89   -0.62   2.31   
1 1 1 0   1   1  f 0  539.99  88.45  9506.35   2647.04  9506.35  2647.04  0.00      0.00     539.99  88.45  ?       ?      0.00    88.45  
1 1 1 0   1   2  o 14 279.61  42.08  2350.61   654.57   2350.61  654.57   0.00      0.00     279.61  42.08  ?       ?      0.00    42.08  
1 1 1 0   1   3  o 8  151.60  22.40  678.68    189.06   678.68   189.06   0.00      0.00     151.60  22.40  ?       ?      0.00    22.40  
1 1 1 0   1   4  o 14 174.27  25.81  898.98    250.43   898.98   250.43   0.00      0.00     174.27  25.81  ?       ?      0.00    25.81  
1 1 1 0   1   5  o 16 122.12  12.36  433.39    85.43    426.96   120.81   439.84    120.83   120.36  18.04  122.25  17.73  -1.89   25.30  
1 1 1 0   1   6  o 4  1045.13 135.19 40229.41  7921.38  40055.28 11202.52 40403.54  11202.52 884.65  221.19 891.05  220.27 -6.41   312.16 
1 1 1 0   1   7  o 17 414.01  42.95  5108.29   1005.95  5092.37  1422.63  5124.21   1422.63  405.01  63.25  406.41  63.02  -1.40   89.29  
1 1 1 0   1   8  o 7  1052.33 137.62 41214.50  8114.81  40528.05 11476.07 41900.95  11476.08 874.23  226.77 899.21  223.33 -24.98  318.28 
1 1 1 0   1   9  o 19 746.99  84.13  18003.33  3544.90  18011.15 5013.24  17995.50  5013.25  698.16  129.86 697.76  129.94 0.40    183.71 
1 1 1 0   1   10 o 5  53.52   6.06   83.34     18.29    92.22    25.74    74.27     26.00    56.05   8.24   50.02   9.40   6.04    12.50  
1 1 1 0   1   11 o 5  606.86  112.24 13524.45  3766.22  13524.45 3766.22  0.00      0.00     606.86  112.24 ?       ?      0.00    112.24 
1 1 1 0   1   12 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   1   13 o 7  259.98  40.22  2083.38   580.87   0.00     0.00     2083.38   580.87   ?       ?      259.98  40.22  0.00    40.22  
1 1 1 0   1   14 f 0  154.81  23.37  717.43    201.22   0.00     0.00     717.43    201.22   ?       ?      154.81  23.37  0.00    23.37  
1 1 1 0   1   15 f 0  69.32   7.98   140.14    31.17    138.08   43.15    142.38    45.08    68.25   11.41  69.27   11.75  -1.02   16.38  
1 1 1 0   1   16 o 3  398.89  43.99  5022.36   990.69   4733.40  1400.98  5311.37   1401.11  364.13  69.56  391.30  64.63  -27.17  94.95  
1 1 1 0   1   17 o 3  159.94  24.27  768.63    215.87   768.63   215.87   0.00      0.00     159.94  24.27  ?       ?      0.00    24.27  
1 1 1 0   1   18 o 2  437.53  78.29  6798.99   1894.14  6798.99  1894.14  0.00      0.00     437.53  78.29  ?       ?      0.00    78.29  
1 1 1 0   1   19 o 7  445.02  47.83  6102.22   1202.79  6047.19  1701.02  6157.25   1700.98  425.56  72.21  430.15  71.39  -4.58   101.54 
1 1 1 0   1   20 o 7  380.44  40.09  4356.80   862.51   3995.73  1219.68  4717.97   1219.85  352.98  62.48  387.70  56.47  -34.73  84.21  
1 1 1 0   1   21 o 11 55.03   15.73  89.55     52.20    0.00     0.00     89.55     52.20    ?       ?      55.03   15.73  0.00    15.73  
1 1 1 0   1   22 o 10 52.41   16.02  79.70     52.64    0.00     0.00     79.70     52.64    ?       ?      52.41   16.02  0.00    16.02  
1 1 1 0   1   23 o 13 123.72  14.25  448.71    99.39    373.72   139.15   526.83    142.02   111.03  22.60  133.19  19.12  -22.16  29.60  
1 1 1 0   1   24 f 0  346.43  37.69  3666.47   737.54   3017.37  1042.78  4316.21   1043.29  298.58  62.83  367.69  50.78  -69.12  80.79  
1 1 1 0   1   25 o 9  235.99  25.41  1659.26   338.81   1372.83  479.15   1945.68   479.14   208.18  41.55  252.38  33.93  -44.20  53.64  
1 1 1 0   1   26 o 11 174.92  28.16  939.67    273.22   0.00     0.00     939.67    273.22   ?       ?      174.92  28.16  0.00    28.16  
1 1 1 0   1   27 o 4  41.48   17.87  -4.45     77.15    0.00     0.00     -4.45     77.15    ?       ?      41.48   17.87  0.00    17.87  
1 1 1 0   1   28 o 8  96.44   20.58  287.63    110.45   0.00     0.00     287.63    110.45   ?       ?      96.44   20.58  0.00    20.58  
1 1 1 0   1   29 o 19 332.86  42.59  3925.63   795.12   3429.69  1124.67  4421.22   1124.26  262.75  72.30  319.54  63.53  -56.79  96.24  
1 1 1 0   1   30 o 8  106.37  16.39  344.80    96.84    275.47   139.52   409.27    134.53   91.93   25.53  114.00  21.34  -22.08  33.28  
1 1 1 0   1   31 o 12 45.68   20.14  -15.53    103.08   -15.53   103.08   0.00      0.00     45.68   20.14  ?       ?      0.00    20.14  
1 1 1 0   1   32 o 16 88.42   25.62  265.53    137.53   265.53   137.53   0.00      0.00     88.42   25.62  ?       ?      0.00    25.62  
1 1 1 0   1   33 o 11 91.48   27.36  296.59    154.75   296.59   154.75   0.00      0.00     91.48   27.36  ?       ?      0.00    27.36  
1 1 1 0   2   0  o 7  355.68  23.73  3677.54   481.76   2892.00  681.31   4463.12   681.33   311.66  38.93  390.44  30.64  -78.78  49.54  
1 1 1 0   2   1  o 8  220.83  17.66  1415.17   222.03   1422.56  271.95   1400.41   384.53   220.80  21.74  217.05  31.80  3.74    38.52  
1 1 1 0   2   2  o 6  48.23   4.97   67.49     13.56    61.78    19.15    73.24     19.21    45.77   7.55   50.03   6.87   -4.26   10.21  
1 1 1 0   2   3  o 4  458.79  47.88  6311.88   1242.64  6235.41  1757.35  6388.34   1757.36  445.01  71.19  451.10  70.14  -6.08   99.94  
1 1 1 0   2   4  o 14 68.70   6.98   136.95    27.14    135.52   38.37    138.39    38.39    67.92   10.15  68.66   10.04  -0.75   14.28  
1 1 1 0   2   5  o 5  720.69  79.59  16492.60  3238.01  15564.47 4579.22  17420.74  4579.25  655.67  126.24 704.12  117.42 -48.46  172.41 
1 1 1 0   2   6  o 18 86.01   8.74   214.77    42.54    216.78   60.16    212.75    60.15    85.90   12.57  85.06   12.71  0.84    17.88  
1 1 1 0   2   7  o 8  590.23  63.27  10719.37  2110.35  10655.19 2984.48  10783.54  2984.49  565.93  95.24  569.95  94.53  -4.02   134.19 
1 1 1 0   2   8  o 15 164.39  16.68  787.00    155.22   798.28   219.51   775.71    219.52   164.35  23.97  161.89  24.38  2.46    34.19  
1 1 1 0   2   9  o 13 465.35  48.87  6527.79   1285.95  6647.46  1818.60  6408.13   1818.60  457.81  71.54  448.39  73.17  9.41    102.33 
1 1 1 0   2   10 o 4  256.55  26.23  1932.85   380.85   1936.41  538.58   1929.29   538.61   253.68  38.16  253.18  38.25  0.50    54.03  
1 1 1 0   2   11 o 10 604.82  113.30 13607.06  3789.18  13607.06 3789.18  0.00      0.00     604.82  113.30 ?       ?      0.00    113.30 
1 1 1 0   2   12 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   2   13 o 18 149.31  22.43  664.66    186.31   0.00     0.00     664.66    186.31   ?       ?      149.31  22.43  0.00    22.43  
1 1 1 0   2   14 f 0  144.38  21.77  622.74    174.80   0.00     0.00     622.74    174.80   ?       ?      144.38  21.77  0.00    21.77  
1 1 1 0   2   15 o 15 200.40  30.78  1227.38   342.75   0.00     0.00     1227.38   342.75   ?       ?      200.40  30.78  0.00    30.78  
1 1 1 0   2   16 o 7  136.47  14.10  545.28    108.91   486.35   153.85   604.47    154.18   127.03  21.89  142.61  19.33  -15.59  29.20  
1 1 1 0   2   17 o 17 76.76   8.59   171.80    37.22    171.51   52.16    172.10    53.13    76.08   12.37  76.18   12.59  -0.09   17.65  
1 1 1 0   2   18 o 13 422.85  75.14  6307.43   1757.23  6307.43  1757.23  0.00      0.00     422.85  75.14  ?       ?      0.00    75.14  
1 1 1 0   2   19 o 16 641.92  219.33 34857.91  9707.03  34857.91 9707.03  0.00      0.00     641.92  219.33 ?       ?      0.00    219.33 
1 1 1 0   2   20 o 19 439.66  47.05  5912.13   1169.01  5607.42  1653.31  6216.77   1653.16  411.58  72.63  437.16  68.09  -25.58  99.56  
1 1 1 0   2   21 o 3  71.49   10.82  150.45    43.02    176.84   65.48    130.42    57.05    76.90   15.37  65.89   15.37  11.02   21.73  
1 1 1 0   2   22 f 0  205.55  21.00  1243.98   244.31   1471.73  346.84   1019.67   344.20   221.81  27.85  182.09  34.18  39.72   44.09  
1 1 1 0   2   23 o 14 216.65  22.93  1391.80   280.81   1224.18  398.48   1557.17   395.80   198.34  36.34  226.35  31.30  -28.01  47.96  
1 1 1 0   2   24 o 1  399.12  43.74  4967.63   985.73   4720.74  1394.71  5214.04   1393.36  369.25  68.31  392.36  64.07  -23.11  93.66  
1 1 1 0   2   25 o 1  265.89  28.08  2119.63   422.14   2110.13  598.70   2129.03   595.31   258.98  41.68  260.41  41.19  -1.44   58.60  
1 1 1 0   2   26 o 18 370.54  42.19  4407.29   881.40   4039.23  1247.00  4774.73   1245.97  328.20  68.41  365.73  61.53  -37.53  92.01  
1 1 1 0   2   27 o 6  133.92  15.90  532.34    119.85   541.02   175.15   524.70    164.35   132.43  23.92  130.80  22.71  1.64    32.98  
1 1 1 0   2   28 o 6  247.27  43.63  2121.80   596.75   0.00     0.00     2121.80   596.75   ?       ?      247.27  43.63  0.00    43.63  
1 1 1 0   2   29 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   2   30 o 5  380.32  72.03  7477.16   1515.08  6628.64  2143.49  8324.35   2141.80  231.30  96.65  285.52  102.60 -54.22  140.96 
1 1 1 0   2   31 o 18 102.47  17.88  327.26    101.38   236.14   154.35   396.39    134.45   84.54   27.63  111.05  21.87  -26.51  35.24  
1 1 1 0   2   32 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   2   33 o 4  92.44   28.09  309.11    162.18   309.11   162.18   0.00      0.00     92.44   28.09  ?       ?      0.00    28.09  
1 1 1 0   3   0  o 5  92.23   19.78  254.94    101.58   286.07   143.64   223.80    143.66   97.57   25.40  87.51   26.40  10.06   36.64  
1 1 1 0   3   1  o 15 1308.57 132.21 62218.39  9795.40  60765.51 16966.07 62944.84  11996.88 906.90  289.16 1227.07 175.28 -320.16 338.14 
1 1 1 0   3   2  o 16 648.54  70.36  13090.77  2577.49  13045.20 3645.12  13136.34  3645.12  618.48  106.51 621.10  106.04 -2.62   150.29 
1 1 1 0   3   3  o 9  541.94  89.03  9601.28   2673.61  9601.28  2673.61  0.00      0.00     541.94  89.03  ?       ?      0.00    89.03  
1 1 1 0   3   4  o 9  103.10  10.45  308.76    60.99    319.23   86.25    298.29    86.26    104.25  14.83  100.61  15.43  3.64    21.40  
1 1 1 0   3   5  o 17 213.41  21.70  1330.09   262.18   1356.62  370.78   1303.57   370.78   213.67  31.14  209.20  31.88  4.47    44.57  
1 1 1 0   3   6  o 19 75.49   7.70   165.41    32.88    163.23   46.48    167.59    46.53    74.51   11.21  75.54   11.06  -1.03   15.75  
1 1 1 0   3   7  o 7  305.15  31.27  2741.07   540.00   2752.94  763.66   2729.21   763.68   301.77  45.50  300.36  45.73  1.40    64.51  
1 1 1 0   3   8  o 2  254.10  25.94  1892.48   373.11   1916.54  527.66   1868.41   527.67   252.96  37.47  249.55  38.03  3.41    53.39  
1 1 1 0   3   9  o 7  128.23  12.99  478.24    94.28    457.28   133.31   499.22    133.36   124.37  19.30  130.23  18.35  -5.87   26.63  
1 1 1 0   3   10 o 1  512.97  54.97  8092.10   1593.42  8085.78  2253.43  8098.41   2253.45  493.54  82.44  494.00  82.36  -0.45   116.53 
1 1 1 0   3   11 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   3   12 o 10 319.69  33.30  3059.20   602.15   2976.90  851.54   3141.52   851.59   307.81  49.90  317.19  48.29  -9.39   69.44  
1 1 1 0   3   13 o 10 142.69  21.39  606.78    169.82   0.00     0.00     606.78    169.82   ?       ?      142.69  21.39  0.00    21.39  
1 1 1 0   3   14 o 2  79.33   12.40  186.12    54.63    0.00     0.00     186.12    54.63    ?       ?      79.33   12.40  0.00    12.40  
1 1 1 0   3   15 o 15 205.03  31.62  1290.16   360.17   0.00     0.00     1290.16   360.17   ?       ?      205.03  31.62  0.00    31.62  
1 1 1 0   3   16 o 17 132.61  20.06  525.70    147.94   0.00     0.00     525.70    147.94   ?       ?      132.61  20.06  0.00    20.06  
1 1 1 0   3   17 o 19 484.67  56.02  7764.40   1530.03  7391.68  2163.74  8137.15   2163.84  430.78  90.38  460.19  85.04  -29.40  124.10 
1 1 1 0   3   18 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   3   19 o 6  94.35   15.94  264.39    83.28    264.39   83.28    0.00      0.00     94.35   15.94  ?       ?      0.00    15.94  
1 1 1 0   3   20 o 5  527.42  95.46  9993.57   2783.90  9993.57  2783.90  0.00      0.00     527.42  95.46  ?       ?      0.00    95.46  
1 1 1 0   3   21 o 18 400.15  42.65  4879.81   964.73   4517.80  1364.31  5241.85   1364.35  370.19  66.65  403.51  60.78  -33.32  90.20  
1 1 1 0   3   22 o 18 603.42  73.74  12671.23  2501.39  12112.46 3537.51  13229.99  3537.49  517.08  121.28 552.86  115.20 -35.78  167.28 
1 1 1 0   3   23 o 15 112.96  13.45  374.28    85.47    370.66   121.74   377.79    120.03   111.07  19.82  112.27  19.32  -1.20   27.68  
1 1 1 0   3   24 o 6  242.15  25.54  1746.60   349.69   1680.88  494.70   1812.23   494.37   232.37  38.43  242.24  36.70  -9.88   53.14  
1 1 1 0   3   25 o 12 231.83  24.65  1601.99   323.06   1501.13  457.38   1702.40   456.36   219.09  37.73  234.93  34.90  -15.84  51.39  
1 1 1 0   3   26 o 13 65.37   14.89  129.25    54.60    134.07   86.42    126.06    70.44    67.22   20.52  64.68   18.21  2.55    27.43  
1 1 1 0   3   27 o 15 240.66  27.09  1786.24   367.71   1397.25  521.58   2170.61   518.48   199.67  46.39  259.29  35.79  -59.62  58.59  
1 1 1 0   3   28 o 3  342.50  42.41  4039.91   816.13   3532.10  1155.72  4545.05   1152.66  277.11  72.00  333.97  62.42  -56.86  95.29  
1 1 1 0   3   29 o 17 101.09  19.10  316.69    106.76   0.00     0.00     316.69    106.76   ?       ?      101.09  19.10  0.00    19.10  
1 1 1 0   3   30 o 1  225.18  43.99  1947.70   548.25   0.00     0.00     1947.70   548.25   ?       ?      225.18  43.99  0.00    43.99  
1 1 1 0   3   31 o 18 154.38  19.36  744.23    167.78   599.25   247.04   868.35    228.58   128.54  33.24  162.56  25.32  -34.02  41.78  
1 1 1 0   3   32 o 10 58.15   20.18  101.15    82.27    69.63    132.40   120.98    104.99   59.38   24.34  63.48   22.73  -4.10   33.30  
1 1 1 0   3   33 o 13 79.22   27.47  220.39    152.47   220.39   152.47   0.00      0.00     79.22   27.47  ?       ?      0.00    27.47  
1 1 1 0   4   0  o 1  270.25  20.99  2122.57   323.15   2253.94  559.89   2056.94   395.71   275.30  36.31  265.07  26.35  10.24   44.87  
1 1 1 0   4   1  o 9  752.34  55.03  17062.88  2360.26  17385.03 3337.92  16740.74  3337.90  740.60  79.77  725.09  81.61  15.52   114.12 
1 1 1 0   4   2  o 16 621.90  50.04  11587.69  1771.55  11895.85 2169.74  10971.41  3068.32  623.70  61.39  574.35  96.48  49.36   114.36 
1 1 1 0   4   3  o 2  873.34  72.85  23792.05  3618.96  21505.54 6268.11  24935.38  4432.34  739.13  152.78 877.19  89.26  -138.06 176.94 
1 1 1 0   4   4  o 2  785.34  89.07  20028.55  3944.65  20397.92 5578.59  19659.18  5578.58  739.59  136.42 721.71  139.70 17.87   195.26 
1 1 1 0   4   5  o 14 1172.12 175.67 58216.33  11456.92 60305.80 16202.54 56126.87  16202.52 922.70  280.81 861.52  283.22 61.18   398.83 
1 1 1 0   4   6  o 16 78.89   8.09   180.71    36.12    187.69   51.04    173.71    51.12    79.98   11.44  76.80   11.99  3.18    16.57  
1 1 1 0   4   7  o 12 180.49  18.28  949.73    186.76   910.05   264.09   989.43    264.15   175.00  27.17  182.90  25.88  -7.90   37.52  
1 1 1 0   4   8  o 15 223.58  22.79  1462.80   288.42   1477.07  407.87   1448.53   407.90   222.42  32.94  220.12  33.32  2.30    46.85  
1 1 1 0   4   9  o 18 499.92  53.25  7651.40   1504.82  7492.94  2128.11  7809.86   2128.15  476.58  80.66  488.28  78.59  -11.70  112.62 
1 1 1 0   4   10 o 19 262.67  39.95  2094.27   583.51   2094.27  583.51   0.00      0.00     262.67  39.95  ?       ?      0.00    39.95  
1 1 1 0   4   11 o 10 293.56  45.54  2665.21   742.57   0.00     0.00     2665.21   742.57   ?       ?      293.56  45.54  0.00    45.54  
1 1 1 0   4   12 f 0  46.24   5.57   62.33     14.48    52.82    20.27    72.25     20.69    42.07   8.68   49.57   7.51   -7.50   11.47  
1 1 1 0   4   13 f 0  76.61   11.80  173.30    50.22    0.00     0.00     173.30    50.22    ?       ?      76.61   11.80  0.00    11.80  
1 1 1 0   4   14 o 5  241.13  37.77  1813.69   505.69   0.00     0.00     1813.69   505.69   ?       ?      241.13  37.77  0.00    37.77  
1 1 1 0   4   15 o 4  86.96   13.39  223.99    64.69    0.00     0.00     223.99    64.69    ?       ?      86.96   13.39  0.00    13.39  
1 1 1 0   4   16 f 0  249.96  26.08  1872.91   368.73   1798.10  521.39   1947.77   521.54   238.63  39.44  249.55  37.57  -10.92  54.47  
1 1 1 0   4   17 o 8  468.74  53.27  7164.57   1408.14  6774.32  1991.34  7554.87   1991.48  418.88  85.70  450.57  79.92  -31.68  117.18 
1 1 1 0   4   18 o 6  97.97   11.01  280.15    60.84    281.22   86.37    279.10    85.73    97.28   16.02  96.92   15.96  0.36    22.62  
1 1 1 0   4   19 o 6  178.86  27.12  957.54    269.70   957.54   269.70   0.00      0.00     178.86  27.12  ?       ?      0.00    27.12  
1 1 1 0   4   20 o 9  428.97  71.72  6114.05   1703.86  6114.05  1703.86  0.00      0.00     428.97  71.72  ?       ?      0.00    71.72  
1 1 1 0   4   21 o 7  78.15   10.83  179.24    47.26    213.15   67.46    146.54    66.24    84.75   14.38  69.77   16.75  14.99   22.07  
1 1 1 0   4   22 o 8  180.46  27.94  984.87    280.08   984.87   280.08   0.00      0.00     180.46  27.94  ?       ?      0.00    27.94  
1 1 1 0   4   23 o 14 259.23  41.42  2122.60   595.63   2122.60  595.63   0.00      0.00     259.23  41.42  ?       ?      0.00    41.42  
1 1 1 0   4   24 o 7  36.08   14.95  9.74      50.66    48.95    76.92    -20.29    67.32    49.82   19.14  36.80   16.25  13.02   25.11  
1 1 1 0   4   25 o 13 119.34  14.51  418.94    97.38    446.24   140.91   393.99    134.72   121.75  20.91  114.13  21.35  7.62    29.88  
1 1 1 0   4   26 o 9  173.24  18.87  892.79    184.65   868.42   262.68   916.59    259.60   167.30  28.36  172.50  27.11  -5.21   39.23  
1 1 1 0   4   27 o 3  370.92  45.18  4731.19   942.28   4386.62  1332.79  5075.56   1332.39  313.72  75.02  349.49  68.86  -35.77  101.83 
1 1 1 0   4   28 o 12 182.99  20.71  1019.44   213.69   905.75   305.02   1129.03   299.47   165.25  33.31  188.10  28.64  -22.85  43.92  
1 1 1 0   4   29 o 18 193.81  34.46  1287.16   369.37   0.00     0.00     1287.16   369.37   ?       ?      193.81  34.46  0.00    34.46  
1 1 1 0   4   30 o 4  96.53   20.39  296.51    109.42   0.00     0.00     296.51    109.42   ?       ?      96.53   20.39  0.00    20.39  
1 1 1 0   4   31 f 0  75.86   18.58  183.93    80.25    0.00     0.00     183.93    80.25    ?       ?      75.86   18.58  0.00    18.58  
1 1 1 0   4   32 o 18 87.04   16.00  238.00    77.01    122.07   136.60   292.02    93.24    65.89   25.45  95.84   17.60  -29.95  30.94  
1 1 1 0   4   33 o 5  105.04  28.94  415.04    180.03   415.04   180.03   0.00      0.00     105.04  28.94  ?       ?      0.00    28.94  
1 1 1 0   5   0  o 11 425.88  32.08  5314.28   778.42   5855.99  1348.50  5043.56   953.29   439.08  54.68  412.23  40.82  26.86   68.24  
1 1 1 0   5   1  o 18 1038.43 117.70 37590.40  6892.58  43601.62 9747.84  31579.83  9747.31  1027.45 171.30 801.14  209.58 226.30  270.67 
1 1 1 0   5   2  o 11 839.00  92.27  22986.56  4370.78  24849.03 6181.42  21124.34  6181.01  819.05  136.25 734.24  151.66 84.81   203.88 
1 1 1 0   5   3  o 4  712.41  74.68  15944.80  3008.65  17623.58 4255.07  14266.35  4254.66  719.72  106.17 631.37  121.80 88.35   161.58 
1 1 1 0   5   4  o 10 881.21  226.99 41490.85  11553.24 0.00     0.00     41490.85  11553.24 ?       ?      881.21  226.99 0.00    226.99 
1 1 1 0   5   5  o 8  106.42  15.79  333.41    93.53    0.00     0.00     333.41    93.53    ?       ?      106.42  15.79  0.00    15.79  
1 1 1 0   5   6  x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   5   7  o 9  384.46  60.25  4617.39   1286.04  0.00     0.00     4617.39   1286.04  ?       ?      384.46  60.25  0.00    60.25  
1 1 1 0   5   8  o 6  505.58  85.32  8575.59   2388.18  0.00     0.00     8575.59   2388.18  ?       ?      505.58  85.32  0.00    85.32  
1 1 1 0   5   9  o 2  53.73   8.65   85.10     25.77    0.00     0.00     85.10     25.77    ?       ?      53.73   8.65   0.00    8.65   
1 1 1 0   5   10 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   5   11 o 19 313.99  49.95  3123.41   870.19   0.00     0.00     3123.41   870.19   ?       ?      313.99  49.95  0.00    49.95  
1 1 1 0   5   12 o 19 195.02  29.67  1152.89   321.68   0.00     0.00     1152.89   321.68   ?       ?      195.02  29.67  0.00    29.67  
1 1 1 0   5   13 o 9  229.13  35.63  1625.95   453.43   0.00     0.00     1625.95   453.43   ?       ?      229.13  35.63  0.00    35.63  
1 1 1 0   5   14 o 7  26.94   8.53   20.54     14.78    0.00     0.00     20.54     14.78    ?       ?      26.94   8.53   0.00    8.53   
1 1 1 0   5   15 o 18 315.20  33.66  3047.46   599.60   2999.49  847.90   3095.45   848.02   301.03  50.88  306.65  49.89  -5.62   71.25  
1 1 1 0   5   16 o 18 51.66   6.69   78.05     19.38    84.20    26.58    71.06     28.32    53.33   9.00   48.71   10.44  4.63    13.78  
1 1 1 0   5   17 o 7  91.32   10.30  243.42    53.04    205.24   77.54    276.99    72.70    82.60   16.92  96.97   13.42  -14.37  21.60  
1 1 1 0   5   18 o 2  180.01  18.81  951.03    191.47   1070.43  271.69   833.22    269.87   189.43  25.64  165.70  29.45  23.72   39.05  
1 1 1 0   5   19 o 13 243.49  37.31  1804.75   504.98   1804.75  504.98   0.00      0.00     243.49  37.31  ?       ?      0.00    37.31  
1 1 1 0   5   20 o 9  386.87  63.33  4871.01   1357.99  4871.01  1357.99  0.00      0.00     386.87  63.33  ?       ?      0.00    63.33  
1 1 1 0   5   21 o 14 486.85  92.85  8973.57   2500.21  8973.57  2500.21  0.00      0.00     486.85  92.85  ?       ?      0.00    92.85  
1 1 1 0   5   22 o 6  178.79  18.78  942.07    189.89   846.49   268.95   1037.08   268.13   166.33  29.23  185.64  25.86  -19.31  39.03  
1 1 1 0   5   23 o 7  229.02  24.10  1563.04   312.06   1529.74  442.27   1596.06   440.39   221.75  35.97  227.09  34.90  -5.34   50.12  
1 1 1 0   5   24 o 19 155.40  17.27  710.97    151.48   707.53   216.25   714.29    212.27   152.84  25.55  153.78  24.90  -0.94   35.67  
1 1 1 0   5   25 o 17 247.04  26.37  1838.38   368.13   1676.59  521.56   1999.01   519.68   228.32  41.31  252.30  36.98  -23.98  55.44  
1 1 1 0   5   26 o 3  82.87   14.55  206.03    66.68    166.91   99.09    238.42    90.15    74.12   21.82  88.41   18.36  -14.29  28.52  
1 1 1 0   5   27 o 15 325.90  38.18  3526.51   700.86   3317.38  991.34   3735.49   990.99   286.34  62.10  310.90  57.65  -24.56  84.73  
1 1 1 0   5   28 o 4  71.94   15.54  158.65    62.31    174.48   92.27    145.37    84.48    74.75   20.76  68.65   20.13  6.10    28.92  
1 1 1 0   5   29 o 12 54.95   16.80  91.46     57.92    3.81     84.20    170.20    79.80    43.72   18.75  73.53   18.83  -29.82  26.57  
1 1 1 0   5   30 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   5   31 o 10 149.83  28.41  779.40    235.39   0.00     0.00     779.40    235.39   ?       ?      149.83  28.41  0.00    28.41  
1 1 1 0   5   32 o 7  134.34  17.59  571.05    132.39   599.22   189.51   544.20    185.02   130.80  26.15  123.92  26.79  6.89    37.44  
1 1 1 0   5   33 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   6   0  o 13 289.76  43.97  2539.51   708.54   0.00     0.00     2539.51   708.54   ?       ?      289.76  43.97  0.00    43.97  
1 1 1 0   6   1  o 11 517.60  37.23  7909.44   1098.82  7891.76  1553.97  7927.12   1553.96  509.41  53.96  510.63  53.82  -1.22   76.21  
1 1 1 0   6   2  o 5  697.04  54.50  14737.92  2163.59  11483.35 3747.12  16365.62  2649.95  560.45  120.08 727.41  64.12  -166.95 136.12 
1 1 1 0   6   3  o 18 181.76  11.69  954.47    121.29   971.97   171.54   936.99    171.51   182.84  16.52  179.45  16.85  3.39    23.60  
1 1 1 0   6   4  o 1  471.97  40.15  6626.80   1077.44  6946.54  1866.02  6466.90   1319.64  466.23  72.04  461.49  50.64  4.74    88.06  
1 1 1 0   6   5  o 12 369.82  32.91  4038.07   691.49   4738.50  1197.59  3687.77   846.93   391.93  54.72  349.82  43.08  42.11   69.64  
1 1 1 0   6   6  o 4  151.61  15.42  669.81    132.32   664.17   187.11   675.45    187.14   149.72  22.46  151.06  22.25  -1.33   31.61  
1 1 1 0   6   7  o 8  155.55  23.16  717.82    200.51   717.82   200.51   0.00      0.00     155.55  23.16  ?       ?      0.00    23.16  
1 1 1 0   6   8  o 7  282.14  29.13  2358.40   465.02   2493.50  657.65   2223.32   657.62   285.94  41.26  268.58  44.19  17.36   60.45  
1 1 1 0   6   9  o 18 445.91  76.97  6819.29   1899.22  6819.29  1899.22  0.00      0.00     445.91  76.97  ?       ?      0.00    76.97  
1 1 1 0   6   10 o 11 189.22  28.63  1079.56   301.26   0.00     0.00     1079.56   301.26   ?       ?      189.22  28.63  0.00    28.63  
1 1 1 0   6   11 o 2  71.09   7.57   147.03    30.43    148.24   42.93    145.81    43.14    70.88   10.90  70.26   11.06  0.62    15.53  
1 1 1 0   6   12 o 16 234.87  24.41  1643.38   324.31   1657.37  458.57   1629.38   458.71   231.31  35.68  229.13  36.06  2.17    50.73  
1 1 1 0   6   13 o 17 65.41   7.25   124.63    26.76    137.86   37.65    111.12    38.05    68.44   9.87   61.07   11.27  7.37    14.98  
1 1 1 0   6   14 o 14 52.35   6.42   80.02     18.90    80.69    26.25    79.30     27.24    52.16   9.10   51.63   9.54   0.53    13.18  
1 1 1 0   6   15 o 15 77.65   8.34   175.65    36.61    178.11   51.40    173.11    52.15    77.62   11.92  76.43   12.30  1.19    17.13  
1 1 1 0   6   16 o 3  32.96   7.15   32.47     13.15    38.92    17.94    24.99     19.32    36.05   8.76   30.01   9.78   6.04    13.12  
1 1 1 0   6   17 o 9  109.03  17.44  353.41    105.47   353.41   105.47   0.00      0.00     109.03  17.44  ?       ?      0.00    17.44  
1 1 1 0   6   18 o 18 82.64   15.50  203.80    70.85    203.80   70.85    0.00      0.00     82.64   15.50  ?       ?      0.00    15.50  
1 1 1 0   6   19 o 15 67.97   15.78  138.88    60.39    138.88   60.39    0.00      0.00     67.97   15.78  ?       ?      0.00    15.78  
1 1 1 0   6   20 o 1  110.97  18.70  366.85    114.90   366.85   114.90   0.00      0.00     110.97  18.70  ?       ?      0.00    18.70  
1 1 1 0   6   21 o 18 310.02  32.92  2911.58   576.88   3006.01  816.23   2817.33   815.44   306.55  47.95  295.41  49.86  11.13   69.17  
1 1 1 0   6   22 o 18 295.80  31.59  2661.97   528.17   2722.46  747.50   2601.66   746.40   290.22  46.43  282.76  47.68  7.46    66.55  
1 1 1 0   6   23 o 6  207.16  32.69  1320.88   375.89   0.00     0.00     1320.88   375.89   ?       ?      207.16  32.69  0.00    32.69  
1 1 1 0   6   24 o 2  202.35  21.70  1215.61   248.10   1287.61  352.54   1144.94   349.23   205.00  30.92  192.35  32.80  12.66   45.08  
1 1 1 0   6   25 o 12 318.73  34.91  3181.00   628.32   2921.43  888.80   3440.30   888.35   287.93  55.79  318.36  50.27  -30.44  75.10  
1 1 1 0   6   26 o 17 77.59   15.07  182.14    64.72    156.47   96.46    203.16    87.27    71.80   21.63  81.23   19.05  -9.42   28.82  
1 1 1 0   6   27 o 3  210.90  36.64  1494.17   427.48   1494.17  427.48   0.00      0.00     210.90  36.64  ?       ?      0.00    36.64  
1 1 1 0   6   28 o 10 192.96  21.73  1152.35   236.56   1062.47  336.52   1240.16   332.60   176.04  34.53  193.48  30.99  -17.44  46.40  
1 1 1 0   6   29 o 8  167.80  19.60  873.61    185.21   834.48   265.85   910.51    258.18   155.92  30.79  165.13  28.25  -9.21   41.79  
1 1 1 0   6   30 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   6   31 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   6   32 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   7   0  o 13 180.37  13.80  943.12    141.78   1014.90  246.24   907.52    173.41   185.46  23.67  176.40  17.35  9.06    29.34  
1 1 1 0   7   1  o 14 1169.80 102.71 48459.02  6827.78  48634.74 9655.95  48283.30  9655.92  1023.54 170.32 1017.41 171.41 6.13    241.64 
1 1 1 0   7   2  o 18 251.07  38.03  1904.70   530.98   1904.70  530.98   0.00      0.00     251.07  38.03  ?       ?      0.00    38.03  
1 1 1 0   7   3  o 15 569.82  103.63 11723.91  3264.96  11723.91 3264.96  0.00      0.00     569.82  103.63 ?       ?      0.00    103.63 
1 1 1 0   7   4  o 19 223.63  33.73  1504.31   419.50   1504.31  419.50   0.00      0.00     223.63  33.73  ?       ?      0.00    33.73  
1 1 1 0   7   5  o 6  466.97  79.40  7368.93   2052.35  7368.93  2052.35  0.00      0.00     466.97  79.40  ?       ?      0.00    79.40  
1 1 1 0   7   6  o 19 713.12  92.63  18159.80  3702.69  19451.49 5236.15  16867.88  5236.64  655.54  143.16 586.47  153.71 69.07   210.05 
1 1 1 0   7   7  o 7  161.03  24.12  773.44    216.11   773.44   216.11   0.00      0.00     161.03  24.12  ?       ?      0.00    24.12  
1 1 1 0   7   8  o 6  206.55  31.41  1293.04   360.71   1293.04  360.71   0.00      0.00     206.55  31.41  ?       ?      0.00    31.41  
1 1 1 0   7   9  x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   7   10 o 7  252.43  26.34  1903.76   376.02   1992.58  531.77   1814.95   531.77   253.36  37.71  240.54  39.91  12.82   54.91  
1 1 1 0   7   11 o 19 48.05   6.01   67.40     16.22    64.41    23.04    70.34     22.83    46.51   8.96   48.73   8.47   -2.22   12.33  
1 1 1 0   7   12 o 12 106.94  16.16  339.88    96.09    339.88   96.09    0.00      0.00     106.94  16.16  ?       ?      0.00    16.16  
1 1 1 0   7   13 o 8  229.12  35.95  1639.55   457.26   1639.55  457.26   0.00      0.00     229.12  35.95  ?       ?      0.00    35.95  
1 1 1 0   7   14 o 10 68.64   11.01  139.44    41.93    139.44   41.93    0.00      0.00     68.64   11.01  ?       ?      0.00    11.01  
1 1 1 0   7   15 o 2  107.05  16.22  340.13    96.59    340.13   96.59    0.00      0.00     107.05  16.22  ?       ?      0.00    16.22  
1 1 1 0   7   16 o 9  51.93   13.91  80.67     42.32    80.67    42.32    0.00      0.00     51.93   13.91  ?       ?      0.00    13.91  
1 1 1 0   7   17 o 9  105.04  17.22  327.81    100.25   327.81   100.25   0.00      0.00     105.04  17.22  ?       ?      0.00    17.22  
1 1 1 0   7   18 o 19 109.40  17.96  355.54    108.89   355.54   108.89   0.00      0.00     109.40  17.96  ?       ?      0.00    17.96  
1 1 1 0   7   19 o 16 490.42  54.52  7604.39   1508.92  7968.00  2133.94  7240.78   2133.94  477.91  80.65  450.08  85.72  27.82   117.70 
1 1 1 0   7   20 o 6  98.78   12.05  285.75    66.89    301.16   96.01    271.22    93.25    100.47  17.27  95.14   17.73  5.33    24.75  
1 1 1 0   7   21 o 8  104.05  12.23  317.22    71.65    286.02   105.12   344.29    97.91    97.26   19.51  107.64  16.36  -10.38  25.46  
1 1 1 0   7   22 o 14 276.92  29.61  2322.28   463.44   2431.39  656.36   2213.81   654.46   276.03  42.81  261.71  45.19  14.32   62.25  
1 1 1 0   7   23 o 8  143.86  16.70  609.89    135.37   654.49   194.58   568.06    188.45   147.24  23.83  136.65  24.94  10.59   34.50  
1 1 1 0   7   24 o 5  433.16  50.06  6212.87   1221.84  6043.84  1728.10  6381.84   1727.79  390.29  79.83  405.25  77.09  -14.96  110.97 
1 1 1 0   7   25 o 14 476.28  63.98  8697.83   1705.14  8270.21  2411.50  9125.41   2411.36  374.93  106.86 408.87  102.84 -33.94  148.31 
1 1 1 0   7   26 o 19 48.88   17.21  63.12     59.94    23.47    95.19    89.18     77.16    49.27   20.46  56.79   19.55  -7.52   28.30  
1 1 1 0   7   27 o 17 306.54  101.65 7472.79   2085.46  7472.79  2085.46  0.00      0.00     306.54  101.65 ?       ?      0.00    101.65 
1 1 1 0   7   28 o 16 233.98  27.01  1775.13   356.14   1661.30  505.92   1886.95   501.42   208.29  43.71  227.13  39.91  -18.84  59.19  
1 1 1 0   7   29 f 0  205.32  24.56  1370.24   283.76   1434.76  408.92   1310.31   394.07   195.82  37.75  186.48  38.10  9.34    53.63  
1 1 1 0   7   30 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   7   31 o 5  153.71  30.87  878.72    262.90   0.00     0.00     878.72    262.90   ?       ?      153.71  30.87  0.00    30.87  
1 1 1 0   7   32 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   8   0  o 9  100.92  7.72   294.60    44.37    358.96   80.27    266.28    53.25    110.81  12.86  95.67   9.84   15.14   16.19  
1 1 1 0   8   1  o 7  420.66  35.85  5320.36   857.54   5100.21  1485.65  5430.35   1050.14  389.59  68.95  420.19  44.20  -30.60  81.90  
1 1 1 0   8   2  o 15 234.17  15.66  1593.30   209.29   1676.20  295.96   1510.37   296.01   238.89  21.82  226.35  23.10  12.54   31.78  
1 1 1 0   8   3  o 18 634.50  56.77  12854.38  2046.10  12793.76 3543.63  12884.70  2506.07  555.15  114.98 616.97  72.11  -61.82  135.72 
1 1 1 0   8   4  o 8  465.36  32.76  6472.24   869.72   6211.15  1229.95  6733.34   1229.98  445.31  48.92  465.52  46.65  -20.21  67.60  
1 1 1 0   8   5  o 6  125.35  10.83  456.24    77.18    494.87   131.83   436.10    95.21    129.30  18.27  122.08  13.83  7.22    22.91  
1 1 1 0   8   6  o 19 57.42   10.79  98.12     34.24    81.43    48.57    114.60    48.29    52.50   15.23  61.75   13.95  -9.25   20.65  
1 1 1 0   8   7  o 12 270.91  23.72  2170.71   365.13   2395.61  631.88   2057.96   447.38   277.11  40.95  261.27  30.39  15.84   51.00  
1 1 1 0   8   8  o 19 182.77  27.82  1011.80   282.64   1011.80  282.64   0.00      0.00     182.77  27.82  ?       ?      0.00    27.82  
1 1 1 0   8   9  f 0  229.23  35.71  1629.68   454.58   0.00     0.00     1629.68   454.58   ?       ?      229.23  35.71  0.00    35.71  
1 1 1 0   8   10 o 13 432.80  49.32  6088.77   1203.49  6517.38  1702.01  5660.18   1701.98  420.91  73.09  383.30  79.94  37.61   108.32 
1 1 1 0   8   11 o 6  72.58   11.56  155.94    46.53    155.94   46.53    0.00      0.00     72.58   11.56  ?       ?      0.00    11.56  
1 1 1 0   8   12 o 4  310.23  51.86  3197.46   891.05   3197.46  891.05   0.00      0.00     310.23  51.86  ?       ?      0.00    51.86  
1 1 1 0   8   13 o 12 44.92   9.28   60.30     23.14    60.30    23.14    0.00      0.00     44.92   9.28   ?       ?      0.00    9.28   
1 1 1 0   8   14 o 6  222.28  23.13  1465.93   290.88   1524.57  411.32   1407.26   411.40   223.10  33.12  213.53  34.76  9.58    48.01  
1 1 1 0   8   15 o 7  210.40  21.82  1306.33   259.71   1373.09  367.17   1239.49   367.40   212.96  30.94  201.46  32.90  11.49   45.16  
1 1 1 0   8   16 o 2  309.28  32.51  2864.74   568.54   2980.66  804.07   2748.85   804.00   309.01  46.79  295.35  49.15  13.67   67.86  
1 1 1 0   8   17 o 12 216.86  22.31  1383.26   273.76   1363.09  387.13   1403.44   387.19   212.35  32.81  215.71  32.26  -3.36   46.01  
1 1 1 0   8   18 o 17 132.89  14.62  516.31    109.70   584.80   154.51   446.70    155.77   140.58  19.68  121.81  23.12  18.77   30.36  
1 1 1 0   8   19 o 3  168.74  17.78  836.02    169.67   863.93   240.08   808.17    239.81   169.66  25.43  163.71  26.42  5.95    36.67  
1 1 1 0   8   20 o 16 491.75  57.99  8123.42   1605.49  8258.83  2270.43  7987.99   2270.57  452.48  90.57  441.88  92.48  10.59   129.45 
1 1 1 0   8   21 o 13 70.07   14.06  147.36    54.57    157.70   81.17    138.83    73.71    72.16   19.24  67.83   18.45  4.33    26.66  
1 1 1 0   8   22 o 10 66.39   15.81  133.16    59.38    112.05   89.49    149.76    79.38    63.32   21.06  70.43   19.14  -7.11   28.45  
1 1 1 0   8   23 o 8  37.54   15.47  12.70     53.81    -69.53   83.63    70.79     70.29    36.38   16.86  52.59   18.62  -16.21  25.12  
1 1 1 0   8   24 o 11 178.42  19.40  949.23    195.47   971.28   278.07   927.69    274.83   176.94  28.33  172.67  28.73  4.27    40.35  
1 1 1 0   8   25 f 0  56.34   16.48  95.47     56.64    129.07   83.46    66.79     77.12    65.56   20.19  52.53   19.38  13.03   27.99  
1 1 1 0   8   26 f 0  147.11  16.95  650.34    140.50   624.57   199.83   675.53    197.58   140.21  25.78  146.69  24.31  -6.48   35.43  
1 1 1 0   8   27 o 13 42.85   17.04  31.81     62.77    47.17    90.53    17.59     87.10    51.16   20.43  46.28   19.42  4.88    28.19  
1 1 1 0   8   28 o 17 112.13  16.39  386.17    102.37   432.12   146.70   342.56    142.93   115.40  22.95  101.59  24.74  13.81   33.75  
1 1 1 0   8   29 o 6  60.59   17.94  115.69    66.83    93.11    94.67    138.12    94.37    58.12   21.47  66.11   21.61  -7.99   30.46  
1 1 1 0   8   30 o 7  104.76  23.75  374.13    139.50   0.00     0.00     374.13    139.50   ?       ?      104.76  23.75  0.00    23.75  
1 1 1 0   8   31 o 19 57.35   22.01  92.43     101.66   0.00     0.00     92.43     101.66   ?       ?      57.35   22.01  0.00    22.01  
1 1 1 0   8   32 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   9   0  o 14 148.19  14.75  641.93    123.84   702.88   179.09   586.08    171.42   153.84  20.81  139.95  22.07  13.90   30.33  
1 1 1 0   9   1  o 19 530.25  73.14  9866.92   2167.02  7919.89  3065.06  11812.86  3064.20  401.24  122.14 535.97  103.34 -134.73 159.99 
1 1 1 0   9   2  o 2  456.71  35.63  6328.07   926.80   6603.50  1135.37  5778.02   1604.48  460.70  43.44  405.71  71.50  54.99   83.66  
1 1 1 0   9   3  o 13 521.23  46.38  8543.65   1373.34  8763.77  2378.20  8433.52   1682.16  475.74  90.38  504.55  59.20  -28.81  108.05 
1 1 1 0   9   4  o 19 239.99  20.92  1696.03   285.31   1662.60  403.54   1729.44   403.43   234.24  30.75  239.25  30.03  -5.01   42.99  
1 1 1 0   9   5  o 3  21.92   8.34   9.57      14.53    9.00     15.27    14.95     47.20    22.06   8.51   35.97   14.61  -13.91  16.91  
1 1 1 0   9   6  o 16 244.60  25.66  1787.33   354.94   1931.76  501.98   1642.92   501.95   249.90  36.03  228.39  39.73  21.51   53.63  
1 1 1 0   9   7  o 3  261.61  27.58  2056.49   408.00   2229.24  577.04   1883.80   576.95   266.98  38.78  242.85  42.96  24.13   57.87  
1 1 1 0   9   8  x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   9   9  o 13 190.75  17.81  1069.76   192.75   1384.76  332.50   910.32    236.56   213.99  27.72  173.99  24.35  40.00   36.89  
1 1 1 0   9   10 o 8  540.86  67.02  10321.25  2036.28  10627.83 2879.73  10014.66  2879.75  485.68  106.25 463.75  109.87 21.92   152.84 
1 1 1 0   9   11 o 2  305.38  32.64  2838.57   563.41   3115.87  796.81   2561.30   796.76   311.97  45.86  278.54  51.73  33.43   69.13  
1 1 1 0   9   12 o 19 82.84   8.98   199.97    42.00    218.27   59.31    181.56    59.49    86.06   12.36  78.08   13.78  7.97    18.51  
1 1 1 0   9   13 o 16 290.74  30.58  2539.76   502.84   2658.40  711.10   2421.11   711.14   290.99  43.94  276.08  46.52  14.91   63.99  
1 1 1 0   9   14 o 18 121.37  12.64  429.65    86.77    455.54   122.71   403.76    122.71   124.11  17.73  116.44  19.01  7.67    25.99  
1 1 1 0   9   15 o 2  344.15  35.98  3566.13   700.25   3456.09  990.13   3676.24   990.48   329.43  54.24  341.12  52.24  -11.69  75.31  
1 1 1 0   9   16 o 10 347.69  36.82  3643.17   723.72   3819.91  1023.44  3466.39   1023.56  347.79  52.93  329.18  56.18  18.61   77.19  
1 1 1 0   9   17 o 6  146.09  15.61  624.19    128.85   657.34   181.85   590.77    182.59   148.67  21.97  140.44  23.48  8.23    32.15  
1 1 1 0   9   18 o 12 160.17  16.74  752.38    151.66   726.59   214.57   778.12    214.39   155.41  24.89  161.22  23.89  -5.81   34.50  
1 1 1 0   9   19 o 1  406.82  45.54  5276.47   1045.37  5405.39  1478.18  5147.48   1478.56  388.99  68.71  377.02  70.92  11.97   98.74  
1 1 1 0   9   20 f 0  78.70   19.59  188.45    88.13    188.45   88.13    0.00      0.00     78.70   19.59  ?       ?      0.00    19.59  
1 1 1 0   9   21 o 3  55.56   16.48  91.12     56.33    93.95    82.61    88.66     77.00    59.02   20.23  57.24   19.53  1.78    28.12  
1 1 1 0   9   22 o 12 177.23  18.88  928.72    189.10   849.17   268.09   1007.49   266.78   166.09  29.18  182.33  26.24  -16.24  39.25  
1 1 1 0   9   23 o 7  232.41  25.03  1635.23   328.65   1650.94  465.20   1619.57   464.35   226.98  36.97  224.55  37.33  2.43    52.54  
1 1 1 0   9   24 o 18 92.36   14.36  255.20    73.65    214.03   103.89   296.81    104.43   82.99   21.60  98.43   19.17  -15.44  28.88  
1 1 1 0   9   25 o 9  50.54   16.89  72.23     57.53    69.58    83.69    74.59     79.22    53.93   20.13  54.13   19.69  -0.20   28.16  
1 1 1 0   9   26 o 1  45.17   16.48  50.99     55.50    64.52    85.15    41.00     73.19    53.02   20.19  46.82   18.47  6.20    27.37  
1 1 1 0   9   27 o 11 59.72   21.60  98.66     95.11    98.66    95.11    0.00      0.00     59.72   21.60  ?       ?      0.00    21.60  
1 1 1 0   9   28 o 9  102.36  16.04  324.13    91.15    326.69   129.20   321.60    128.61   99.27   23.11  98.46   23.15  0.81    32.71  
1 1 1 0   9   29 o 17 51.22   20.98  46.54     98.33    0.00     0.00     46.54     98.33    ?       ?      51.22   20.98  0.00    20.98  
1 1 1 0   9   30 f 0  88.43   24.48  276.68    128.47   0.00     0.00     276.68    128.47   ?       ?      88.43   24.48  0.00    24.48  
1 1 1 0   9   31 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   10  0  o 7  183.16  16.21  980.58    168.73   1236.60  243.40   743.72    234.11   204.71  21.01  156.61  27.02  48.10   34.22  
1 1 1 0   10  1  o 7  519.09  67.87  9296.07   1973.95  8142.22  2792.43  10448.54  2790.75  421.76  113.04 505.43  99.73  -83.67  150.74 
1 1 1 0   10  2  o 14 464.42  60.10  7215.22   1564.66  6048.27  2213.64  8380.31   2211.88  376.30  100.55 470.10  85.09  -93.80  131.73 
1 1 1 0   10  3  o 1  164.94  17.67  800.29    164.69   417.05   282.81   996.94    202.58   117.29  37.33  183.86  19.49  -66.57  42.11  
1 1 1 0   10  4  o 18 211.82  18.67  1317.66   224.66   1358.93  316.08   1275.52   319.39   212.80  26.44  205.62  27.77  7.18    38.34  
1 1 1 0   10  5  o 6  218.08  18.18  1394.76   225.58   1403.09  389.74   1390.57   276.63   213.82  32.80  216.51  22.59  -2.69   39.82  
1 1 1 0   10  6  o 14 274.35  26.21  2246.11   407.85   2797.82  705.52   1969.21   499.82   298.00  42.44  252.79  35.41  45.20   55.27  
1 1 1 0   10  7  o 15 464.28  94.64  8748.25   2436.68  8748.25  2436.68  0.00      0.00     464.28  94.64  ?       ?      0.00    94.64  
1 1 1 0   10  8  f 0  87.18   13.66  225.08    66.09    0.00     0.00     225.08    66.09    ?       ?      87.18   13.66  0.00    13.66  
1 1 1 0   10  9  o 10 287.74  23.12  2444.87   378.66   2314.00  654.19   2510.81   464.35   270.62  43.59  289.64  28.29  -19.02  51.96  
1 1 1 0   10  10 o 5  179.87  18.73  951.36    190.53   1089.42  269.54   813.49    269.36   190.90  25.21  163.17  29.86  27.73   39.08  
1 1 1 0   10  11 o 4  300.82  31.65  2718.29   538.46   2872.01  761.50   2564.58   761.48   302.69  45.21  284.02  48.44  18.67   66.26  
1 1 1 0   10  12 o 13 264.31  27.62  2075.19   412.86   2255.39  583.88   1895.01   583.87   271.56  38.53  246.80  42.76  24.76   57.56  
1 1 1 0   10  13 o 15 150.60  15.61  662.62    133.02   712.16   188.00   612.96    188.22   154.99  21.73  143.13  23.74  11.86   32.18  
1 1 1 0   10  14 o 1  101.36  10.84  299.26    62.12    326.97   87.61    271.23    88.10    105.38  14.90  95.47   16.68  9.90    22.36  
1 1 1 0   10  15 o 3  136.70  14.83  546.16    114.54   616.22   163.00   477.83    160.99   144.29  20.23  126.13  23.08  18.16   30.70  
1 1 1 0   10  16 o 14 225.13  23.33  1496.81   297.17   1485.61  419.97   1508.05   420.56   220.83  34.24  222.61  33.98  -1.78   48.24  
1 1 1 0   10  17 o 11 72.15   12.08  154.34    48.27    169.73   65.84    136.46    70.97    75.12   15.77  67.33   18.01  7.80    23.94  
1 1 1 0   10  18 o 15 45.83   14.61  59.75     43.29    78.92    59.13    37.60     63.55    52.81   17.09  44.76   17.34  8.06    24.35  
1 1 1 0   10  19 o 13 109.12  14.12  350.96    86.36    387.50   122.77   315.17    121.52   113.52  19.54  101.72  21.48  11.80   29.04  
1 1 1 0   10  20 o 16 339.92  37.04  3581.29   711.10   3646.10  1005.94  3516.56   1005.34  329.18  55.18  322.13  56.42  7.05    78.92  
1 1 1 0   10  21 o 12 226.20  24.08  1530.87   307.87   1511.93  434.44   1549.97   436.37   219.71  35.67  222.69  35.31  -2.98   50.19  
1 1 1 0   10  22 f 0  46.33   16.96  51.22     58.88    101.74   80.76    -6.12     86.03    60.10   20.00  43.66   18.84  16.44   27.48  
1 1 1 0   10  23 o 19 50.16   16.70  70.67     56.26    70.29    79.38    71.06     79.76    53.60   19.68  53.80   19.73  -0.20   27.87  
1 1 1 0   10  24 o 11 67.92   16.27  141.78    62.62    109.52   88.91    173.54    88.21    61.89   20.99  74.70   20.12  -12.81  29.08  
1 1 1 0   10  25 o 17 59.21   17.30  107.21    62.47    51.57    90.78    157.27    86.11    51.97   20.55  70.96   20.18  -18.99  28.80  
1 1 1 0   10  26 o 8  37.24   16.23  -7.16     65.26    -29.40   96.33    11.71     88.72    42.74   19.12  45.64   19.40  -2.90   27.24  
1 1 1 0   10  27 o 13 165.37  31.39  968.71    287.08   0.00     0.00     968.71    287.08   ?       ?      165.37  31.39  0.00    31.39  
1 1 1 0   10  28 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   10  29 o 4  52.66   20.67  67.48     91.28    0.00     0.00     67.48     91.28    ?       ?      52.66   20.67  0.00    20.67  
1 1 1 0   10  30 o 7  62.05   22.86  123.95    107.29   0.00     0.00     123.95    107.29   ?       ?      62.05   22.86  0.00    22.86  
1 1 1 0   10  31 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   11  0  o 16 111.39  13.26  363.03    83.11    326.79   196.78   370.89    91.69    104.28  30.77  112.40  14.55  -8.12   34.03  
1 1 1 0   11  1  o 15 341.12  55.67  3736.61   1052.53  0.00     0.00     3736.61   1052.53  ?       ?      341.12  55.67  0.00    55.67  
1 1 1 0   11  2  o 13 1016.60 111.01 41835.07  6373.23  37901.02 11039.17 43801.88  7805.43  539.24  221.78 941.58  149.39 -402.34 267.40 
1 1 1 0   11  3  o 14 232.82  15.55  1575.58   206.58   1759.65  254.79   1222.40   352.93   245.56  18.20  200.76  31.67  44.79   36.53  
1 1 1 0   11  4  o 1  378.83  39.97  4387.09   856.09   4468.35  1213.05  4306.46   1208.34  369.76  59.14  362.08  60.25  7.68    84.43  
1 1 1 0   11  5  o 14 290.08  32.99  2534.55   539.54   2225.72  765.63   2839.21   760.45   262.47  52.65  301.30  45.37  -38.84  69.50  
1 1 1 0   11  6  o 3  342.99  55.68  3798.19   1058.76  0.00     0.00     3798.19   1058.76  ?       ?      342.99  55.68  0.00    55.68  
1 1 1 0   11  7  x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   11  8  f 0  37.83   11.21  41.79     26.08    0.00     0.00     41.79     26.08    ?       ?      37.83   11.21  0.00    11.21  
1 1 1 0   11  9  o 14 59.59   11.28  105.67    37.19    0.00     0.00     105.67    37.19    ?       ?      59.59   11.28  0.00    11.28  
1 1 1 0   11  10 o 18 343.16  54.62  3730.84   1040.07  0.00     0.00     3730.84   1040.07  ?       ?      343.16  54.62  0.00    54.62  
1 1 1 0   11  11 o 11 242.90  15.91  1712.48   220.64   1100.36  365.09   2064.69   276.94   189.96  34.76  266.38  18.22  -76.42  39.25  
1 1 1 0   11  12 o 5  35.15   11.29  34.62     25.85    101.66   54.26    14.95     29.39    58.35   15.81  29.94   11.74  28.41   19.69  
1 1 1 0   11  13 f 0  403.94  44.37  5001.19   1011.92  6039.63  1431.40  3963.72   1430.73  434.45  58.91  339.61  75.36  94.84   95.65  
1 1 1 0   11  14 o 15 285.90  30.29  2441.53   489.55   2678.19  692.55   2205.19   692.10   294.49  42.17  264.36  47.34  30.13   63.40  
1 1 1 0   11  15 o 13 432.27  48.59  5923.30   1184.88  6486.45  1675.70  5360.18   1675.66  432.33  69.90  383.44  78.76  48.89   105.31 
1 1 1 0   11  16 o 13 354.86  61.42  4321.48   1205.98  4321.48  1205.98  0.00      0.00     354.86  61.42  ?       ?      0.00    61.42  
1 1 1 0   11  17 o 13 258.66  28.15  2020.67   411.23   2268.50  582.29   1774.06   580.85   268.54  38.90  233.58  44.95  34.95   59.45  
1 1 1 0   11  18 o 14 167.09  18.28  824.30    172.50   788.72   244.51   859.56    243.40   160.66  27.50  168.38  26.02  -7.72   37.86  
1 1 1 0   11  19 o 5  557.24  72.56  11359.70  2266.15  12059.41 3204.99  10660.14  3204.66  500.08  114.16 452.10  121.07 47.98   166.40 
1 1 1 0   11  20 o 9  203.18  22.25  1231.96   255.31   1303.55  362.19   1161.25   359.95   205.23  31.77  192.59  33.79  12.64   46.38  
1 1 1 0   11  21 o 16 102.42  15.36  312.83    87.51    337.65   130.24   292.39    118.17   104.66  22.36  97.42   21.69  7.24    31.15  
1 1 1 0   11  22 f 0  53.89   17.12  84.68     59.52    83.14    81.82    86.41     86.73    56.31   20.08  57.60   20.65  -1.29   28.80  
1 1 1 0   11  23 o 6  59.45   21.66  91.49     95.84    0.00     0.00     91.49     95.84    ?       ?      59.45   21.66  0.00    21.66  
1 1 1 0   11  24 o 13 74.58   21.32  174.90    95.84    0.00     0.00     174.90    95.84    ?       ?      74.58   21.32  0.00    21.32  
1 1 1 0   11  25 o 12 68.96   21.91  148.56    97.51    0.00     0.00     148.56    97.51    ?       ?      68.96   21.91  0.00    21.91  
1 1 1 0   11  26 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   11  27 o 7  175.37  35.89  1189.34   349.11   0.00     0.00     1189.34   349.11   ?       ?      175.37  35.89  0.00    35.89  
1 1 1 0   11  28 o 10 58.47   22.24  95.97     103.24   0.00     0.00     95.97     103.24   ?       ?      58.47   22.24  0.00    22.24  
1 1 1 0   11  29 o 16 118.91  27.45  530.55    183.62   0.00     0.00     530.55    183.62   ?       ?      118.91  27.45  0.00    27.45  
1 1 1 0   11  30 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   12  0  o 15 109.41  15.40  351.96    94.05    363.11   282.40   350.57    99.74    113.15  37.40  109.01  16.45  4.14    40.86  
1 1 1 0   12  1  f 0  354.35  56.54  3926.33   1111.43  0.00     0.00     3926.33   1111.43  ?       ?      354.35  56.54  0.00    56.54  
1 1 1 0   12  2  o 3  64.49   27.53  -0.63     179.99   0.00     0.00     -0.63     179.99   ?       ?      64.49   27.53  0.00    27.53  
1 1 1 0   12  3  o 13 496.07  61.71  7765.82   1719.40  9138.37  2427.34  6383.59   2435.87  519.85  84.22  417.09  102.48 102.76  132.64 
1 1 1 0   12  4  o 10 324.70  34.78  3144.57   638.25   3215.08  891.11   3070.29   914.60   322.33  49.76  313.52  52.68  8.80    72.47  
1 1 1 0   12  5  o 5  743.96  65.74  17620.67  2778.64  17973.25 3404.36  16917.03  4809.28  731.55  82.50  637.01  135.67 94.54   158.79 
1 1 1 0   12  6  o 5  182.59  19.36  976.08    199.84   976.08   199.84   0.00      0.00     182.59  19.36  ?       ?      0.00    19.36  
1 1 1 0   12  7  o 11 208.56  24.65  1283.74   289.42   0.00     0.00     1283.74   289.42   ?       ?      208.56  24.65  0.00    24.65  
1 1 1 0   12  8  f 0  122.40  14.15  437.83    97.57    524.28   150.37   374.96    128.24   132.99  20.34  111.97  20.71  21.02   29.03  
1 1 1 0   12  9  o 6  309.54  33.72  2861.81   589.59   3590.69  835.19   2137.74   832.43   343.08  43.37  257.59  57.73  85.49   72.21  
1 1 1 0   12  10 o 13 681.63  82.62  15940.91  3167.16  16833.21 4479.20  15048.74  4478.88  635.72  127.18 585.33  135.91 50.38   186.13 
1 1 1 0   12  11 o 1  103.05  12.04  310.23    69.87    297.71   108.63   319.06    91.24    99.57   19.70  103.89  15.80  -4.32   25.25  
1 1 1 0   12  12 o 12 201.67  30.78  1230.74   345.07   0.00     0.00     1230.74   345.07   ?       ?      201.67  30.78  0.00    30.78  
1 1 1 0   12  13 o 7  462.11  89.42  8204.19   2286.31  0.00     0.00     8204.19   2286.31  ?       ?      462.11  89.42  0.00    89.42  
1 1 1 0   12  14 o 3  251.85  40.08  1994.13   560.07   0.00     0.00     1994.13   560.07   ?       ?      251.85  40.08  0.00    40.08  
1 1 1 0   12  15 o 4  111.32  20.66  374.31    127.17   0.00     0.00     374.31    127.17   ?       ?      111.32  20.66  0.00    20.66  
1 1 1 0   12  16 o 3  137.66  23.76  573.88    180.96   0.00     0.00     573.88    180.96   ?       ?      137.66  23.76  0.00    23.76  
1 1 1 0   12  17 o 17 321.59  54.28  3453.14   966.39   0.00     0.00     3453.14   966.39   ?       ?      321.59  54.28  0.00    54.28  
1 1 1 0   12  18 f 0  50.79   20.17  41.50     87.77    0.00     0.00     41.50     87.77    ?       ?      50.79   20.17  0.00    20.17  
1 1 1 0   12  19 o 2  334.11  60.88  4020.12   1124.67  0.00     0.00     4020.12   1124.67  ?       ?      334.11  60.88  0.00    60.88  
1 1 1 0   12  20 o 1  184.32  30.64  1073.30   312.79   0.00     0.00     1073.30   312.79   ?       ?      184.32  30.64  0.00    30.64  
1 1 1 0   12  21 o 17 166.34  28.52  880.69    262.58   0.00     0.00     880.69    262.58   ?       ?      166.34  28.52  0.00    28.52  
1 1 1 0   12  22 o 16 120.21  22.96  454.14    152.70   0.00     0.00     454.14    152.70   ?       ?      120.21  22.96  0.00    22.96  
1 1 1 0   12  23 o 13 254.31  53.01  2663.14   748.79   0.00     0.00     2663.14   748.79   ?       ?      254.31  53.01  0.00    53.01  
1 1 1 0   12  24 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   12  25 o 15 132.41  25.45  588.19    186.41   588.19   186.41   0.00      0.00     132.41  25.45  ?       ?      0.00    25.45  
1 1 1 0   12  26 o 8  53.48   18.16  85.70     66.54    77.48    89.26    95.98     99.83    54.50   20.69  58.72   21.97  -4.22   30.18  
1 1 1 0   12  27 o 9  33.99   15.59  -37.99    68.96    -2.21    92.06    -83.74    104.09   43.61   19.14  38.88   18.27  4.73    26.46  
1 1 1 0   12  28 o 6  66.86   19.29  150.61    78.12    164.68   105.37   133.44    116.41   68.91   22.85  64.07   23.78  4.85    32.98  
1 1 1 0   12  29 o 3  44.17   19.77  -6.74     103.05   -6.74    103.05   0.00      0.00     44.17   19.77  ?       ?      0.00    19.77  
1 1 1 0   13  0  o 3  425.41  33.05  5358.73   800.69   5661.51  1415.58  5216.28   970.94   423.33  59.92  416.21  41.18  7.12    72.71  
1 1 1 0   13  1  o 14 325.57  31.23  3138.69   576.46   0.00     0.00     3138.69   576.46   ?       ?      325.57  31.23  0.00    31.23  
1 1 1 0   13  2  o 11 62.76   19.68  112.91    78.89    91.46    543.42   113.37    79.74    114.71  48.34  62.94   19.79  51.78   52.24  
1 1 1 0   13  3  o 12 299.77  23.05  2627.21   393.62   0.00     0.00     2627.21   393.62   ?       ?      299.77  23.05  0.00    23.05  
1 1 1 0   13  4  o 15 706.09  44.53  15070.38  1795.72  14401.31 2542.92  15735.88  2536.15  669.40  67.08  703.80  63.45  -34.39  92.33  
1 1 1 0   13  5  o 11 77.41   11.90  176.59    51.17    242.07   64.18    62.36     84.77    90.78   12.66  53.86   20.23  36.92   23.86  
1 1 1 0   13  6  x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   13  7  o 7  364.55  39.47  4031.91   812.89   4058.72  1130.58  4003.22   1169.61  355.73  57.31  351.46  60.13  4.28    83.07  
1 1 1 0   13  8  o 14 391.87  37.54  4648.50   834.22   3985.73  1156.37  5367.77   1204.65  349.29  59.82  412.01  52.09  -62.72  79.32  
1 1 1 0   13  9  o 7  496.93  46.62  7696.34   1314.32  6285.39  1840.23  9165.51   1877.81  419.35  79.35  525.80  63.50  -106.45 101.62 
1 1 1 0   13  10 o 9  102.55  19.75  316.53    112.04   316.53   112.04   0.00      0.00     102.55  19.75  ?       ?      0.00    19.75  
1 1 1 0   13  11 o 2  112.01  19.18  375.71    118.87   454.00   125.24   -335.88   377.58   123.61  18.19  74.77   35.03  48.84   39.47  
1 1 1 0   13  12 o 13 390.58  42.46  4790.13   936.75   4561.75  1287.11  5047.34   1365.93  362.40  64.22  380.98  64.77  -18.58  91.21  
1 1 1 0   13  13 o 10 432.70  36.11  5740.86   888.69   5497.16  1512.56  5869.35   1098.25  391.98  69.78  430.03  45.16  -38.05  83.12  
1 1 1 0   13  14 o 4  88.40   20.10  237.35    99.68    260.89   143.20   215.23    138.83   92.54   25.93  85.01   26.02  7.53    36.73  
1 1 1 0   13  15 o 11 126.74  18.25  477.50    129.00   552.16   186.93   409.62    178.23   134.70  25.10  115.22  27.36  19.48   37.13  
1 1 1 0   13  16 o 7  96.66   18.53  281.67    99.09    146.33   137.20   429.22    143.26   74.11   26.04  119.11  21.75  -45.00  33.93  
1 1 1 0   13  17 o 2  189.67  21.64  1074.72   231.37   1250.42  325.37   894.99    329.08   201.88  28.90  167.60  35.32  34.28   45.63  
1 1 1 0   13  18 o 15 275.96  29.95  2359.56   466.89   2287.56  659.67   2431.84   660.91   259.61  45.94  269.24  44.30  -9.62   63.82  
1 1 1 0   13  19 o 18 181.40  19.89  990.99    203.78   910.53   286.04   1073.92   290.39   168.60  30.68  184.78  28.27  -16.18  41.73  
1 1 1 0   13  20 o 5  111.87  16.79  378.16    104.49   447.56   138.57   286.69    159.09   120.44  20.79  94.59   27.60  25.85   34.55  
1 1 1 0   13  21 o 12 227.62  42.81  1876.26   538.83   0.00     0.00     1876.26   538.83   ?       ?      227.62  42.81  0.00    42.81  
1 1 1 0   13  22 o 15 123.17  17.54  464.77    120.54   493.96   161.68   428.24    180.86   124.13  23.55  113.14  28.00  11.00   36.59  
1 1 1 0   13  23 o 2  193.93  37.19  1390.10   398.93   1390.10  398.93   0.00      0.00     193.93  37.19  ?       ?      0.00    37.19  
1 1 1 0   13  24 f 0  170.66  21.60  936.10    206.89   989.95   284.99   876.09    300.83   166.91  30.88  152.30  35.12  14.61   46.77  
1 1 1 0   13  25 o 12 37.55   17.12  -38.78    81.69    -15.64   98.82    -88.73    145.17   43.93   19.53  47.13   21.96  -3.20   29.39  
1 1 1 0   13  26 o 2  59.09   22.64  98.41     107.52   98.41    107.52   0.00      0.00     59.09   22.64  ?       ?      0.00    22.64  
1 1 1 0   13  27 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   13  28 f 0  60.44   22.99  119.48    110.27   119.48   110.27   0.00      0.00     60.44   22.99  ?       ?      0.00    22.99  
1 1 1 0   14  0  o 14 398.73  44.50  4906.47   1001.15  4960.33  1478.62  4860.88   1360.43  382.69  69.88  383.33  64.08  -0.64   94.81  
1 1 1 0   14  1  o 14 453.72  46.22  6383.32   1187.19  0.00     0.00     6383.32   1187.19  ?       ?      453.72  46.22  0.00    46.22  
1 1 1 0   14  2  o 9  348.08  41.20  3722.24   807.39   3581.33  1241.89  3825.40   1062.60  323.43  68.99  344.12  55.69  -20.69  88.66  
1 1 1 0   14  3  o 1  142.77  22.28  608.71    176.66   0.00     0.00     608.71    176.66   ?       ?      142.77  22.28  0.00    22.28  
1 1 1 0   14  4  o 5  746.96  84.34  20239.13  3553.31  17706.39 6167.65  21497.44  4347.28  483.82  174.08 726.55  107.47 -242.73 204.58 
1 1 1 0   14  5  f 0  149.24  23.61  667.62    195.57   667.62   195.57   0.00      0.00     149.24  23.61  ?       ?      0.00    23.61  
1 1 1 0   14  6  o 16 265.99  32.36  2140.81   483.95   0.00     0.00     2140.81   483.95   ?       ?      265.99  32.36  0.00    32.36  
1 1 1 0   14  7  o 16 532.08  50.49  9020.27   1523.74  10041.55 2627.05  8502.49   1870.54  506.53  93.80  498.63  67.04  7.90    115.30 
1 1 1 0   14  8  o 5  291.72  31.92  2572.02   525.80   2910.99  742.88   2231.74   744.31   304.22  43.80  261.48  51.42  42.74   67.54  
1 1 1 0   14  9  o 16 70.06   17.59  148.24    70.63    137.59   98.02    159.74    101.87   69.09   21.97  73.53   22.24  -4.44   31.27  
1 1 1 0   14  10 o 2  243.44  26.44  1769.37   363.57   2257.03  570.25   1435.38   471.93   270.32  37.78  213.74  39.93  56.58   54.97  
1 1 1 0   14  11 o 6  325.41  34.35  3221.19   632.09   3065.23  894.89   3376.46   892.92   306.24  52.81  323.93  49.59  -17.69  72.45  
1 1 1 0   14  12 o 11 362.14  40.51  4074.25   827.85   4481.52  1168.75  3664.15   1172.79  366.95  57.36  324.80  65.17  42.15   86.82  
1 1 1 0   14  13 o 10 379.30  43.30  4535.87   925.99   5069.53  1310.74  4004.14   1308.35  385.12  61.34  332.79  70.67  52.33   93.58  
1 1 1 0   14  14 o 5  459.18  173.21 22359.30  6228.77  22359.30 6228.77  0.00      0.00     459.18  173.21 ?       ?      0.00    173.21 
1 1 1 0   14  15 o 5  166.75  26.28  850.95    243.20   793.27   261.12   1228.35   667.92   159.61  29.59  184.89  57.15  -25.28  64.36  
1 1 1 0   14  16 o 16 289.75  51.87  2958.72   831.16   2958.72  831.16   0.00      0.00     289.75  51.87  ?       ?      0.00    51.87  
1 1 1 0   14  17 o 9  240.19  41.71  1958.85   554.31   1958.85  554.31   0.00      0.00     240.19  41.71  ?       ?      0.00    41.71  
1 1 1 0   14  18 o 9  105.52  45.65  173.71    507.80   0.00     0.00     173.71    507.80   ?       ?      105.52  45.65  0.00    45.65  
1 1 1 0   14  19 o 3  80.01   21.79  201.36    102.80   201.36   102.80   0.00      0.00     80.01   21.79  ?       ?      0.00    21.79  
1 1 1 0   14  20 o 19 65.12   21.38  127.37    92.37    127.37   92.37    0.00      0.00     65.12   21.38  ?       ?      0.00    21.38  
1 1 1 0   14  21 o 4  46.29   19.55  16.01     89.22    16.01    89.22    0.00      0.00     46.29   19.55  ?       ?      0.00    19.55  
1 1 1 0   14  22 o 16 60.99   21.68  108.20    95.39    108.20   95.39    0.00      0.00     60.99   21.68  ?       ?      0.00    21.68  
1 1 1 0   14  23 f 0  103.19  23.48  357.42    135.92   357.42   135.92   0.00      0.00     103.19  23.48  ?       ?      0.00    23.48  
1 1 1 0   14  24 o 17 137.17  27.89  671.30    212.13   671.30   212.13   0.00      0.00     137.17  27.89  ?       ?      0.00    27.89  
1 1 1 0   14  25 o 15 125.06  26.89  567.82    187.33   567.82   187.33   0.00      0.00     125.06  26.89  ?       ?      0.00    26.89  
1 1 1 0   14  26 o 2  103.99  25.08  398.61    147.99   398.61   147.99   0.00      0.00     103.99  25.08  ?       ?      0.00    25.08  
1 1 1 0   14  27 o 18 42.38   19.55  -41.55    110.85   -41.55   110.85   0.00      0.00     42.38   19.55  ?       ?      0.00    19.55  
1 1 1 0   15  0  o 12 302.39  29.52  2718.05   505.93   8244.45  1152.24  1398.14   563.11   522.85  38.66  209.74  47.83  313.11  61.50  
1 1 1 0   15  1  o 7  682.76  34.80  13917.57  1359.66  26969.33 2098.34  4471.60   1785.10  946.78  38.69  347.82  89.03  598.96  97.08  
1 1 1 0   15  2  o 7  728.21  52.66  16631.91  2186.52  24900.08 3197.27  9367.83   2996.85  874.19  64.16  479.54  111.05 394.65  128.25 
1 1 1 0   15  3  o 13 581.84  47.56  10492.85  1574.59  0.00     0.00     10492.85  1574.59  ?       ?      581.84  47.56  0.00    47.56  
1 1 1 0   15  4  o 12 586.08  42.58  10510.69  1422.85  11399.56 2568.37  10117.10  1709.08  567.96  81.07  565.25  53.30  2.72    97.02  
1 1 1 0   15  5  x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   15  6  f 0  545.42  34.34  8937.53   1069.87  10370.49 1331.37  6325.43   1797.53  583.10  40.02  422.96  76.86  160.14  86.65  
1 1 1 0   15  7  o 18 728.54  57.91  17257.37  2402.13  14083.78 4139.29  18868.87  2949.62  529.78  135.56 742.49  70.03  -212.71 152.58 
1 1 1 0   15  8  o 7  546.07  53.11  9593.81   1643.83  9904.18  2818.59  9433.83   2023.62  488.10  103.79 523.02  69.09  -34.92  124.68 
1 1 1 0   15  9  o 9  178.33  20.54  941.13    206.40   1164.94  300.80   741.98    283.74   196.57  27.40  154.48  33.00  42.08   42.89  
1 1 1 0   15  10 o 3  81.12   17.14  198.59    77.32    161.45   101.98   248.78    118.56   73.75   22.24  90.25   22.86  -16.50  31.90  
1 1 1 0   15  11 o 11 78.17   17.22  185.03    75.20    211.31   101.61   153.21    111.82   83.19   21.21  72.78   23.50  10.42   31.66  
1 1 1 0   15  12 o 6  85.38   19.11  222.21    91.31    250.12   128.67   193.90    129.60   90.12   24.31  80.63   25.22  9.49    35.03  
1 1 1 0   15  13 o 3  366.54  35.31  4241.22   733.74   4590.29  1222.82  4044.83   917.21   349.81  63.22  345.94  47.43  3.87    79.04  
1 1 1 0   15  14 o 17 108.60  17.62  355.69    106.08   315.55   146.45   400.00    153.87   100.21  25.42  113.22  24.40  -13.01  35.23  
1 1 1 0   15  15 o 18 81.95   19.77  207.79    91.92    153.65   120.87   282.04    141.55   72.69   24.48  94.49   25.51  -21.80  35.35  
1 1 1 0   15  16 o 17 54.90   19.68  78.63     78.72    82.66    102.69   72.87     122.60   59.12   22.25  60.74   23.93  -1.62   32.67  
1 1 1 0   15  17 o 15 70.31   19.47  153.36    81.27    173.67   102.65   119.23    133.05   74.74   22.26  68.09   25.39  6.65    33.77  
1 1 1 0   15  18 o 9  156.53  18.72  748.12    164.85   726.72   225.34   772.77    241.79   149.51  27.26  153.48  28.49  -3.97   39.43  
1 1 1 0   15  19 o 17 83.44   17.90  217.98    83.15    224.98   106.08   206.83    133.90   83.60   21.86  80.20   25.70  3.40    33.74  
1 1 1 0   15  20 o 17 237.76  25.75  1852.74   345.83   2051.09  537.17   1712.35   451.94   228.07  42.59  213.79  38.23  14.29   57.23  
1 1 1 0   15  21 o 7  90.01   17.58  256.03    87.60    223.00   112.73   306.39    139.19   81.86   23.03  94.86   25.15  -13.00  34.10  
1 1 1 0   15  22 o 9  176.15  22.26  1016.34   220.04   1031.30  300.59   999.07    322.99   166.48  32.62  159.44  36.13  7.04    48.67  
1 1 1 0   15  23 o 3  126.54  18.95  517.04    133.45   560.24   172.64   452.92    210.34   127.34  24.51  107.45  31.84  19.88   40.18  
1 1 1 0   15  24 o 10 46.56   18.93  42.81     79.33    92.74    93.08    -89.76    151.66   56.29   21.19  47.12   22.12  9.18    30.63  
1 1 1 0   15  25 f 0  52.61   19.97  80.63     83.10    72.80    97.62    101.24    158.33   52.95   21.19  61.98   26.11  -9.02   33.62  
1 1 1 0   16  0  o 7  607.95  53.11  12161.63  1834.80  13046.68 3256.80  11750.10  2220.77  531.43  110.37 574.04  68.76  -42.61  130.03 
1 1 1 0   16  1  o 11 269.42  31.45  2210.59   477.28   0.00     0.00     2210.59   477.28   ?       ?      269.42  31.45  0.00    31.45  
1 1 1 0   16  2  o 14 175.53  26.46  933.28    258.32   0.00     0.00     933.28    258.32   ?       ?      175.53  26.46  0.00    26.46  
1 1 1 0   16  3  o 11 257.57  37.15  2069.31   533.45   1668.38  1119.97  2186.96   606.69   211.14  74.37  262.34  41.68  -51.19  85.25  
1 1 1 0   16  4  o 1  290.77  72.09  3175.95   1197.32  3175.95  1197.32  0.00      0.00     290.77  72.09  ?       ?      0.00    72.09  
1 1 1 0   16  5  o 9  157.64  27.22  760.57    237.43   0.00     0.00     760.57    237.43   ?       ?      157.64  27.22  0.00    27.22  
1 1 1 0   16  6  f 0  66.12   22.72  119.18    104.19   45.01    657.06   121.10    105.53   116.76  51.19  66.59   22.86  50.16   56.07  
1 1 1 0   16  7  o 9  79.86   22.60  194.02    108.27   0.00     0.00     194.02    108.27   ?       ?      79.86   22.60  0.00    22.60  
1 1 1 0   16  8  o 17 248.37  32.60  1920.54   453.54   0.00     0.00     1920.54   453.54   ?       ?      248.37  32.60  0.00    32.60  
1 1 1 0   16  9  o 2  152.48  16.96  689.14    145.96   756.77   209.08   624.84    203.86   157.60  23.86  142.19  25.93  15.41   35.23  
1 1 1 0   16  10 o 18 133.08  15.34  524.26    115.04   521.28   158.95   527.55    166.70   130.70  21.96  131.15  22.98  -0.46   31.79  
1 1 1 0   16  11 o 5  194.70  20.19  1137.23   222.35   1113.77  324.39   1158.01   305.38   187.29  31.27  192.56  28.48  -5.27   42.30  
1 1 1 0   16  12 o 3  102.30  16.52  315.30    93.70    243.33   126.13   403.93    139.98   88.20   24.19  114.29  22.13  -26.09  32.79  
1 1 1 0   16  13 o 18 83.25   18.80  213.89    87.74    229.26   111.74   189.18    141.69   85.59   22.46  79.54   26.50  6.05    34.74  
1 1 1 0   16  14 o 14 102.65  18.05  322.10    102.47   383.10   132.37   230.90    161.86   110.90  21.57  86.28   28.30  24.62   35.59  
1 1 1 0   16  15 o 17 109.30  17.67  364.97    107.07   387.66   139.76   332.71    166.61   110.75  22.74  100.83  27.86  9.91    35.96  
1 1 1 0   16  16 o 14 74.24   19.49  173.35    84.09    214.42   105.93   103.36    138.28   81.99   22.04  66.02   25.58  15.97   33.76  
1 1 1 0   16  17 o 15 224.95  26.73  1648.53   338.47   2007.88  515.29   1375.82   448.89   232.88  39.98  189.07  42.40  43.81   58.28  
1 1 1 0   16  18 o 2  67.53   19.73  144.63    81.26    91.92    103.02   231.47    132.22   59.32   22.30  83.55   25.35  -24.23  33.76  
1 1 1 0   16  19 o 19 68.82   19.03  151.77    77.73    161.50   96.20    133.48    131.93   70.71   21.66  67.88   25.29  2.83    33.30  
1 1 1 0   16  20 o 15 87.59   17.97  245.23    87.35    192.98   108.82   339.90    146.47   76.03   22.99  99.08   25.58  -23.05  34.39  
1 1 1 0   16  21 o 9  205.61  28.26  1502.04   324.75   1735.34  455.27   1260.38   463.37   201.97  40.68  157.71  47.38  44.26   62.44  
1 1 1 0   16  22 o 4  119.06  19.27  464.51    127.20   570.31   168.13   322.88    194.52   128.33  23.69  90.36   31.04  37.97   39.05  
1 1 1 0   16  23 o 11 48.28   19.16  55.86     79.20    68.27    91.64    19.24     157.43   51.90   20.61  55.13   24.57  -3.23   32.07  
1 1 1 0   16  24 o 9  143.78  22.46  730.88    179.28   863.90   237.43   554.45    273.45   147.65  29.05  103.88  36.73  43.77   46.83  
1 1 1 0   17  0  o 12 190.87  27.58  1120.07   293.44   0.00     0.00     1120.07   293.44   ?       ?      190.87  27.58  0.00    27.58  
1 1 1 0   17  1  o 3  358.31  77.68  5310.37   1551.55  0.00     0.00     5310.37   1551.55  ?       ?      358.31  77.68  0.00    77.68  
1 1 1 0   17  2  o 10 360.22  78.61  5429.51   1579.84  0.00     0.00     5429.51   1579.84  ?       ?      360.22  78.61  0.00    78.61  
1 1 1 0   17  3  o 16 259.39  57.93  2460.16   840.76   0.00     0.00     2460.16   840.76   ?       ?      259.39  57.93  0.00    57.93  
1 1 1 0   17  4  x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   17  5  o 1  74.14   21.45  167.31    96.45    -142.99  725.89   172.89    97.32    111.24  50.85  75.26   21.47  35.98   55.20  
1 1 1 0   17  6  o 10 148.49  22.77  672.98    187.94   966.22   721.53   651.63    194.66   161.59  59.33  145.55  24.14  16.04   64.06  
1 1 1 0   17  7  o 15 69.98   14.71  148.40    57.22    154.47   70.52    136.69    97.92    71.05   17.43  68.20   21.99  2.85    28.06  
1 1 1 0   17  8  o 12 56.51   15.71  96.58     52.81    78.84    65.35    129.96    89.63    53.25   18.00  66.22   21.01  -12.98  27.66  
1 1 1 0   17  9  o 11 134.50  16.16  539.91    122.29   597.00   166.78   473.51    179.86   139.62  21.50  122.18  26.41  17.44   34.06  
1 1 1 0   17  10 o 12 249.85  45.43  2223.28   627.54   0.00     0.00     2223.28   627.54   ?       ?      249.85  45.43  0.00    45.43  
1 1 1 0   17  11 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   17  12 o 15 179.57  32.70  1076.87   324.69   0.00     0.00     1076.87   324.69   ?       ?      179.57  32.70  0.00    32.70  
1 1 1 0   17  13 o 6  97.91   26.28  313.94    150.77   0.00     0.00     313.94    150.77   ?       ?      97.91   26.28  0.00    26.28  
1 1 1 0   17  14 f 0  270.59  71.63  4017.13   1130.02  0.00     0.00     4017.13   1130.02  ?       ?      270.59  71.63  0.00    71.63  
1 1 1 0   17  15 f 0  77.70   27.16  188.42    149.15   0.00     0.00     188.42    149.15   ?       ?      77.70   27.16  0.00    27.16  
1 1 1 0   17  16 o 10 127.27  29.33  561.24    209.91   0.00     0.00     561.24    209.91   ?       ?      127.27  29.33  0.00    29.33  
1 1 1 0   17  17 o 2  104.39  18.40  344.25    106.26   372.59   133.33   294.91    175.93   106.46  22.52  91.65   29.47  14.81   37.09  
1 1 1 0   17  18 o 18 38.80   17.31  -19.75    78.29    -41.13   92.58    33.88     146.66   40.14   18.28  57.46   24.69  -17.32  30.72  
1 1 1 0   17  19 o 18 103.77  18.59  346.79    106.67   329.52   138.25   372.21    167.70   97.26   24.71  101.13  27.95  -3.87   37.31  
1 1 1 0   17  20 o 11 54.08   20.27  82.42     84.96    97.80    104.30   52.06     146.50   58.53   22.33  57.83   24.76  0.69    33.35  
1 1 1 0   17  21 o 2  48.75   19.86  49.78     87.48    51.25    87.86    -117.58   938.24   49.02   19.93  83.75   42.20  -34.73  46.67  
1 1 1 0   17  22 o 8  51.58   19.33  77.98     77.31    90.76    91.08    45.02     146.25   55.05   20.90  55.55   24.26  -0.51   32.02  
1 1 1 0   18  0  o 5  163.54  25.19  831.20    228.92   0.00     0.00     831.20    228.92   ?       ?      163.54  25.19  0.00    25.19  
1 1 1 0   18  1  f 0  110.91  20.68  378.71    126.84   830.90   1025.04  371.68    127.83   151.84  65.27  109.72  21.06  42.11   68.58  
1 1 1 0   18  2  o 19 119.61  21.83  442.32    144.38   0.00     0.00     442.32    144.38   ?       ?      119.61  21.83  0.00    21.83  
1 1 1 0   18  3  o 9  113.35  53.32  -246.40   890.43   -246.40  890.43   0.00      0.00     113.35  53.32  ?       ?      0.00    53.32  
1 1 1 0   18  4  o 5  175.81  26.41  970.77    258.32   0.00     0.00     970.77    258.32   ?       ?      175.81  26.41  0.00    26.41  
1 1 1 0   18  5  o 6  300.16  64.15  3828.40   1071.94  0.00     0.00     3828.40   1071.94  ?       ?      300.16  64.15  0.00    64.15  
1 1 1 0   18  6  o 16 167.71  56.03  1175.65   633.39   0.00     0.00     1175.65   633.39   ?       ?      167.71  56.03  0.00    56.03  
1 1 1 0   18  7  o 4  188.21  61.84  1625.95   772.51   0.00     0.00     1625.95   772.51   ?       ?      188.21  61.84  0.00    61.84  
1 1 1 0   18  8  o 13 54.42   17.16  87.82     59.89    91.45    60.18    -281.68   607.50   55.32   17.16  92.32   43.62  -37.01  46.87  
1 1 1 0   18  9  o 11 263.52  40.11  2467.81   587.63   2654.62  736.56   2140.72   974.63   258.12  51.51  196.48  69.36  61.64   86.40  
1 1 1 0   18  10 o 11 159.38  24.01  805.66    212.85   751.60   225.39   1251.09   647.01   152.14  26.78  163.97  56.60  -11.83  62.62  
1 1 1 0   18  11 f 0  124.80  16.51  473.85    115.37   475.92   151.86   471.03    177.42   122.30  22.46  119.48  26.55  2.82    34.78  
1 1 1 0   18  12 o 1  138.10  17.85  586.10    138.20   632.60   186.45   529.40    205.90   140.02  24.06  124.61  29.28  15.41   37.90  
1 1 1 0   18  13 o 5  74.67   18.39  176.81    78.33    183.71   97.18    164.01    132.32   75.52   21.43  73.00   25.57  2.52    33.36  
1 1 1 0   18  14 o 9  67.79   19.46  146.56    79.72    134.42   93.31    179.36    153.40   65.62   21.49  75.85   27.43  -10.22  34.85  
1 1 1 0   18  15 o 8  99.75   18.22  315.17    100.47   325.53   123.27   294.67    173.41   99.35   22.18  91.35   29.24  8.00    36.70  
1 1 1 0   18  16 o 4  57.38   19.45  100.41    76.34    89.97    88.50    130.78    150.90   56.53   20.78  68.25   26.64  -11.71  33.79  
1 1 1 0   18  17 o 13 156.77  21.03  805.15    184.46   845.38   246.34   753.80    278.32   152.50  29.20  136.57  35.26  15.93   45.78  
1 1 1 0   18  18 o 10 59.88   20.07  115.41    81.27    118.05   94.25    107.76    160.45   60.99   21.57  64.75   26.70  -3.76   34.32  
1 1 1 0   18  19 o 2  61.46   26.69  67.36     174.95   0.00     0.00     67.36     174.95   ?       ?      61.46   26.69  0.00    26.69  
1 1 1 0   19  0  o 11 152.87  23.79  732.25    202.00   749.30   1258.45  731.80    204.65   143.00  65.95  152.63  24.16  -9.63   70.23  
1 1 1 0   19  1  o 19 81.26   20.13  206.97    93.44    0.00     0.00     206.97    93.44    ?       ?      81.26   20.13  0.00    20.13  
1 1 1 0   19  2  o 5  59.66   19.84  103.65    79.45    46.46    1142.22  103.93    79.64    123.90  58.91  59.73   19.87  64.17   62.17  
1 1 1 0   19  3  x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   19  4  o 5  215.49  29.01  1508.35   349.72   1690.37  1054.67  1485.87   370.69   169.95  69.06  211.80  31.44  -41.85  75.88  
1 1 1 0   19  5  o 2  51.14   20.49  45.49     91.45    -229.53  950.26   48.06     91.88    109.27  52.43  51.59   20.59  57.68   56.33  
1 1 1 0   19  6  o 16 90.86   21.50  262.99    110.37   412.04   1024.81  261.24    111.02   124.51  58.13  90.50   21.66  34.01   62.03  
1 1 1 0   19  7  o 18 84.60   22.14  229.76    108.73   0.00     0.00     229.76    108.73   ?       ?      84.60   22.14  0.00    22.14  
1 1 1 0   19  8  o 13 102.23  23.25  338.73    133.32   0.00     0.00     338.73    133.32   ?       ?      102.23  23.25  0.00    23.25  
1 1 1 0   19  9  o 11 112.33  15.11  383.13    94.93    439.26   125.30   307.50    145.46   118.62  19.05  96.02   25.83  22.60   32.09  
1 1 1 0   19  10 o 12 34.37   15.18  -13.18    58.69    -42.28   69.76    57.32     108.57   34.26   15.70  55.15   22.25  -20.90  27.23  
1 1 1 0   19  11 o 6  57.70   18.04  102.69    66.34    82.20    79.17    150.98    121.54   54.57   19.71  69.96   24.51  -15.38  31.45  
1 1 1 0   19  12 o 16 76.78   19.80  191.25    87.86    194.71   88.54    -28.93    706.81   77.46   19.83  94.08   45.16  -16.63  49.33  
1 1 1 0   19  13 o 19 107.58  21.37  380.22    127.33   376.15   129.05   530.11    782.81   106.73  21.80  106.88  50.19  -0.15   54.72  
1 1 1 0   19  14 o 5  42.44   18.25  8.08      80.22    8.69     80.48    -87.12    1005.30  42.58   18.29  94.33   46.96  -51.75  50.40  
1 1 1 0   19  15 o 12 91.29   21.70  282.76    112.01   277.35   112.61   785.31    1085.92  90.23   21.95  103.26  50.94  -13.03  55.47  
1 1 1 0   19  16 o 17 59.25   20.38  111.77    83.87    111.77   83.87    0.00      0.00     59.25   20.38  ?       ?      0.00    20.38  
1 1 1 0   20  0  o 14 102.32  20.26  330.21    114.79   -385.40  1538.07  334.22    115.11   118.07  58.66  102.98  20.19  15.10   62.04  
1 1 1 0   20  1  o 16 110.77  21.86  391.35    134.04   0.00     0.00     391.35    134.04   ?       ?      110.77  21.86  0.00    21.86  
1 1 1 0   20  2  x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 0   20  3  o 19 80.95   22.19  211.88    106.14   0.00     0.00     211.88    106.14   ?       ?      80.95   22.19  0.00    22.19  
1 1 1 0   20  4  o 16 46.45   19.82  11.03     93.26    0.00     0.00     11.03     93.26    ?       ?      46.45   19.82  0.00    19.82  
1 1 1 0   20  5  o 3  67.92   23.36  140.76    110.12   842.45   1166.68  134.45    110.62   125.13  59.51  66.90   23.39  58.23   63.94  
1 1 1 0   20  6  o 11 57.15   21.53  84.24     96.19    0.00     0.00     84.24     96.19    ?       ?      57.15   21.53  0.00    21.53  
1 1 1 0   20  7  o 10 85.42   23.45  242.56    118.46   0.00     0.00     242.56    118.46   ?       ?      85.42   23.45  0.00    23.45  
1 1 1 0   20  8  o 1  115.52  24.36  446.64    156.46   0.00     0.00     446.64    156.46   ?       ?      115.52  24.36  0.00    24.36  
1 1 1 0   20  9  o 15 139.10  28.01  674.24    215.95   0.00     0.00     674.24    215.95   ?       ?      139.10  28.01  0.00    28.01  
1 1 1 0   20  10 o 7  58.92   17.64  109.85    64.30    85.72    76.33    168.85    119.33   54.47   19.39  71.82   24.32  -17.35  31.11  
1 1 1 0   20  11 o 8  183.87  22.45  1112.84   232.02   1115.49  319.38   1109.88   337.64   171.43  33.66  167.73  36.13  3.69    49.38  
1 1 1 1   -20 0  o 17 130.24  62.25  758.31    1310.82  0.00     0.00     758.31    1310.82  ?       ?      130.24  62.25  0.00    62.25  
1 1 1 1   -20 1  o 5  258.83  41.48  2485.21   595.52   2333.48  660.83   3141.05   1373.89  238.97  49.79  193.89  78.81  45.08   93.22  
1 1 1 1   -19 0  o 19 44.12   17.49  34.11     65.90    33.06    66.06    247.15    939.62   43.97   17.49  123.13  56.86  -79.16  59.48  
1 1 1 1   -19 1  o 9  55.30   18.33  88.32     67.84    82.87    68.02    1140.43   944.49   54.13   18.36  153.94  64.23  -99.80  66.80  
1 1 1 1   -19 2  o 3  148.88  22.70  691.15    187.87   690.77   191.85   700.04    927.77   148.55  23.26  137.30  60.50  11.25   64.81  
1 1 1 1   -19 3  o 15 150.95  24.80  720.64    207.42   723.84   212.21   652.16    981.76   150.96  25.39  136.17  60.98  14.79   66.05  
1 1 1 1   -19 4  o 8  99.82   19.52  309.45    107.82   307.42   108.49   470.30    966.08   99.41   19.71  129.96  59.12  -30.54  62.32  
1 1 1 1   -19 5  o 2  141.79  24.26  636.10    190.41   649.00   194.48   338.23    934.79   143.09  24.56  125.02  57.36  18.07   62.39  
1 1 1 1   -19 6  o 19 217.83  29.01  1533.92   353.77   1543.59  375.40   1457.20   1057.49  216.84  31.04  163.00  67.98  53.84   74.73  
1 1 1 1   -19 7  o 5  74.33   19.09  172.48    81.87    173.36   82.18    55.53     949.01   74.52   19.12  118.13  55.41  -43.61  58.61  
1 1 1 1   -18 0  f 0  128.56  20.32  504.99    145.01   491.74   147.24   933.15    837.10   126.58  21.00  153.99  61.90  -27.41  65.37  
1 1 1 1   -18 1  o 5  103.01  18.82  324.38    107.18   308.72   108.34   1041.74   733.44   100.23  19.53  160.70  59.68  -60.47  62.79  
1 1 1 1   -18 2  o 15 119.85  19.47  437.72    129.39   426.53   131.20   834.39    781.29   118.07  20.07  149.44  59.90  -31.37  63.17  
1 1 1 1   -18 3  o 18 189.47  23.20  1099.69   247.06   1074.56  258.63   1361.96   835.37   186.46  24.77  177.39  64.03  9.07    68.66  
1 1 1 1   -18 4  o 7  108.92  19.25  362.59    115.98   342.98   117.43   1141.15   739.79   105.59  20.11  166.60  60.24  -61.01  63.51  
1 1 1 1   -18 5  o 11 137.91  21.96  584.90    168.07   567.79   172.31   920.07    762.64   135.43  22.98  153.32  59.89  -17.89  64.15  
1 1 1 1   -18 6  o 15 147.75  23.01  674.07    188.84   695.78   194.55   320.44    785.12   150.00  23.35  126.23  55.63  23.77   60.33  
1 1 1 1   -18 7  o 19 86.09   19.28  229.32    92.93    219.12   93.63    904.95    761.80   84.04   19.75  151.31  59.63  -67.27  62.81  
1 1 1 1   -18 8  o 1  95.99   18.98  283.73    100.91   285.87   101.78   160.31    772.98   96.33   19.08  118.64  53.53  -22.31  56.83  
1 1 1 1   -18 9  o 7  101.15  18.91  314.63    105.74   324.36   106.69   -224.17   793.86   102.78  18.77  107.19  50.40  -4.41   53.78  
1 1 1 1   -18 10 o 14 44.81   22.74  -1042.30  304.33   -1300.88 325.36   766.76    860.58   ?       ?      141.92  60.37  0.00    60.37  
1 1 1 1   -17 0  o 3  148.20  43.46  739.28    393.64   739.28   393.64   0.00      0.00     148.20  43.46  ?       ?      0.00    43.46  
1 1 1 1   -17 1  o 11 179.97  22.49  977.26    227.27   1017.17  241.35   664.85    675.25   183.27  23.48  145.47  56.48  37.80   61.17  
1 1 1 1   -17 2  o 19 308.74  27.97  2913.88   490.41   2685.86  561.97   3642.06   1004.26  292.06  34.16  317.95  57.12  -25.89  66.56  
1 1 1 1   -17 3  o 10 140.50  20.76  596.30    162.39   629.54   167.47   72.80     664.62   144.42  20.80  115.53  51.04  28.88   55.12  
1 1 1 1   -17 4  o 17 182.22  25.82  1019.03   262.58   1215.62  281.12   -325.17   735.09   199.62  25.08  106.29  49.49  93.33   55.49  
1 1 1 1   -17 5  o 5  248.31  26.65  1888.46   373.89   1904.33  418.48   1825.64   832.46   247.28  30.10  214.43  63.28  32.86   70.08  
1 1 1 1   -17 6  o 2  248.53  26.53  1893.55   372.70   1887.15  416.57   1919.23   834.38   245.90  30.14  219.64  62.94  26.26   69.78  
1 1 1 1   -17 7  o 3  123.41  20.90  464.37    142.80   485.90   146.11   5.41      674.66   126.31  20.88  112.19  50.37  14.12   54.52  
1 1 1 1   -17 8  o 7  74.61   18.04  170.66    76.40    166.26   76.96    468.92    634.08   73.62   18.29  130.40  53.34  -56.78  56.39  
1 1 1 1   -17 9  o 11 159.71  34.40  834.53    306.11   1014.44  340.50   76.33     699.00   176.23  34.89  115.46  51.59  60.77   62.29  
1 1 1 1   -17 10 o 15 165.16  59.81  1079.27   729.52   0.00     0.00     1079.27   729.52   ?       ?      165.16  59.81  0.00    59.81  
1 1 1 1   -17 11 o 14 94.67   45.71  -714.97   748.85   0.00     0.00     -714.97   748.85   ?       ?      94.67   45.71  0.00    45.71  
1 1 1 1   -17 12 o 1  155.89  60.02  984.87    757.73   0.00     0.00     984.87    757.73   ?       ?      155.89  60.02  0.00    60.02  
1 1 1 1   -17 13 o 2  94.10   35.50  249.24    261.61   229.23   278.63   398.18    760.08   93.36   36.27  126.77  55.33  -33.41  66.16  
1 1 1 1   -16 0  o 5  69.31   19.25  144.77    79.31    145.55   79.98    98.45     615.27   69.50   19.34  116.88  50.41  -47.38  53.99  
1 1 1 1   -16 1  o 12 116.66  18.69  407.19    120.93   415.50   123.52   214.61    594.57   117.82  18.90  120.91  50.74  -3.10   54.15  
1 1 1 1   -16 2  o 13 92.74   37.94  130.42    320.80   130.42   320.80   0.00      0.00     92.74   37.94  ?       ?      0.00    37.94  
1 1 1 1   -16 3  o 2  89.71   37.10  103.89    311.17   103.89   311.17   0.00      0.00     89.71   37.10  ?       ?      0.00    37.10  
1 1 1 1   -16 4  f 0  101.44  37.56  267.51    290.18   267.51   290.18   0.00      0.00     101.44  37.56  ?       ?      0.00    37.56  
1 1 1 1   -16 5  o 16 165.56  23.80  826.82    219.73   826.82   219.73   0.00      0.00     165.56  23.80  ?       ?      0.00    23.80  
1 1 1 1   -16 6  o 16 134.72  18.61  541.00    140.07   529.67   145.08   696.48    537.47   133.02  19.58  147.19  51.54  -14.17  55.14  
1 1 1 1   -16 7  f 0  84.00   33.55  129.99    244.26   102.90   276.16   227.37    523.59   85.29   35.08  115.26  47.93  -29.97  59.40  
1 1 1 1   -16 8  o 8  84.74   33.88  134.30    249.40   134.30   249.40   0.00      0.00     84.74   33.88  ?       ?      0.00    33.88  
1 1 1 1   -16 9  o 8  169.60  56.83  1037.98   651.56   0.00     0.00     1037.98   651.56   ?       ?      169.60  56.83  0.00    56.83  
1 1 1 1   -16 10 o 1  234.32  34.03  1739.86   444.37   2011.84  549.48   1225.76   755.46   248.11  39.93  179.51  61.19  68.60   73.07  
1 1 1 1   -16 11 o 16 154.99  34.34  778.21    297.54   950.30   336.87   167.58    634.55   171.10  35.46  117.10  50.84  53.99   61.99  
1 1 1 1   -16 12 o 11 95.28   34.47  257.07    242.22   43.60    263.60   1415.06   613.95   78.26   33.35  196.04  53.21  -117.79 62.80  
1 1 1 1   -16 13 o 14 75.23   31.44  65.86     226.94   99.40    247.22   -113.83   572.19   80.46   33.15  99.90   45.47  -19.44  56.27  
1 1 1 1   -16 14 o 15 100.57  45.92  -111.36   589.72   0.00     0.00     -111.36   589.72   ?       ?      100.57  45.92  0.00    45.92  
1 1 1 1   -16 15 f 0  179.70  61.25  1371.60   756.86   0.00     0.00     1371.60   756.86   ?       ?      179.70  61.25  0.00    61.25  
1 1 1 1   -16 16 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   -15 0  o 4  41.23   20.30  -357.25   169.93   -110.45  174.67   -4718.50  734.26   54.74   24.99  ?       ?      0.00    24.99  
1 1 1 1   -15 1  o 15 171.62  43.19  928.47    425.12   2102.10  498.63   -2195.10  813.47   264.03  33.66  80.84   40.54  183.18  52.70  
1 1 1 1   -15 2  o 19 446.60  60.74  6477.82   1517.00  7772.92  2107.54  5085.41   2185.29  470.05  81.03  356.86  101.73 113.19  130.06 
1 1 1 1   -15 3  o 13 171.02  23.69  870.85    226.35   928.38   243.81   511.94    609.01   176.40  24.76  142.15  54.04  34.25   59.44  
1 1 1 1   -15 4  o 12 287.15  30.42  2470.97   493.81   2470.97  493.81   0.00      0.00     287.15  30.42  ?       ?      0.00    30.42  
1 1 1 1   -15 5  f 0  293.23  36.60  2631.99   602.71   2830.53  800.24   2371.76   916.19   297.66  48.50  264.01  61.59  33.65   78.39  
1 1 1 1   -15 6  o 10 175.65  38.63  974.56    378.93   974.56   378.93   0.00      0.00     175.65  38.63  ?       ?      0.00    38.63  
1 1 1 1   -15 7  o 14 108.06  36.05  342.99    262.18   342.99   262.18   0.00      0.00     108.06  36.05  ?       ?      0.00    36.05  
1 1 1 1   -15 8  f 0  190.75  37.85  1149.57   399.81   1149.57  399.81   0.00      0.00     190.75  37.85  ?       ?      0.00    37.85  
1 1 1 1   -15 9  o 12 70.44   26.77  108.80    149.42   -81.99   156.21   2162.57   512.51   52.75   23.91  264.63  34.56  -211.89 42.02  
1 1 1 1   -15 10 o 4  157.75  31.86  777.85    278.53   998.06   326.00   182.56    536.01   178.75  32.99  114.62  48.14  64.13   58.36  
1 1 1 1   -15 11 o 16 106.93  44.80  159.53    462.25   0.00     0.00     159.53    462.25   ?       ?      106.93  44.80  0.00    44.80  
1 1 1 1   -15 12 o 7  84.95   31.40  184.10    202.72   200.78   221.20   96.64     506.58   88.46   32.79  106.39  45.81  -17.93  56.33  
1 1 1 1   -15 13 o 3  74.60   30.87  68.76     215.65   147.53   234.05   -374.00   554.92   84.04   33.07  90.79   42.51  -6.75   53.86  
1 1 1 1   -15 14 o 12 145.36  31.46  674.08    254.93   696.57   282.75   576.38    589.32   146.67  34.21  136.86  52.87  9.81    62.97  
1 1 1 1   -15 15 o 1  57.74   25.31  -22.85    160.55   -38.59   166.51   185.17    605.32   57.53   25.47  115.51  49.91  -57.98  56.03  
1 1 1 1   -15 16 o 13 193.38  31.00  1187.59   332.50   1131.80  375.59   1389.74   714.95   185.33  36.60  187.20  59.32  -1.87   69.70  
1 1 1 1   -15 17 o 18 116.25  50.18  247.49    610.99   0.00     0.00     247.49    610.99   ?       ?      116.25  50.18  0.00    50.18  
1 1 1 1   -15 18 o 17 126.00  53.36  433.81    667.35   0.00     0.00     433.81    667.35   ?       ?      126.00  53.36  0.00    53.36  
1 1 1 1   -14 0  o 10 452.94  49.27  6420.07   1260.47  6420.07  1260.47  0.00      0.00     452.94  49.27  ?       ?      0.00    49.27  
1 1 1 1   -14 1  o 16 583.26  67.69  11278.43  2224.33  11278.43 2224.33  0.00      0.00     583.26  67.69  ?       ?      0.00    67.69  
1 1 1 1   -14 2  o 19 194.60  21.46  1114.90   235.77   1072.92  260.35   1306.25   555.83   190.15  24.41  202.47  48.47  -12.32  54.27  
1 1 1 1   -14 3  o 10 458.71  79.43  7227.58   2015.80  7227.58  2015.80  0.00      0.00     458.71  79.43  ?       ?      0.00    79.43  
1 1 1 1   -14 4  o 5  35.90   18.12  -578.35   176.85   -474.53  187.98   -1378.36  521.80   40.77   20.30  66.11   33.05  -25.34  38.79  
1 1 1 1   -14 5  x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   -14 6  o 8  345.20  64.04  3880.68   1222.26  0.00     0.00     3880.68   1222.26  ?       ?      345.20  64.04  0.00    64.04  
1 1 1 1   -14 7  o 15 205.64  31.34  1273.54   358.27   1457.86  441.15   916.44    614.02   218.67  36.42  171.63  55.04  47.04   66.00  
1 1 1 1   -14 8  o 5  274.53  53.45  2424.43   812.02   0.00     0.00     2424.43   812.02   ?       ?      274.53  53.45  0.00    53.45  
1 1 1 1   -14 9  o 15 144.52  30.83  642.42    248.00   642.42   248.00   0.00      0.00     144.52  30.83  ?       ?      0.00    30.83  
1 1 1 1   -14 10 o 9  91.58   32.76  220.53    218.13   220.53   218.13   0.00      0.00     91.58   32.76  ?       ?      0.00    32.76  
1 1 1 1   -14 11 o 15 112.17  34.69  383.55    246.00   383.55   246.00   0.00      0.00     112.17  34.69  ?       ?      0.00    34.69  
1 1 1 1   -14 12 f 0  80.88   31.89  123.13    218.04   123.13   218.04   0.00      0.00     80.88   31.89  ?       ?      0.00    31.89  
1 1 1 1   -14 13 o 4  134.63  31.21  568.11    236.55   635.27   267.34   325.94    507.68   141.86  33.39  121.09  48.37  20.77   58.77  
1 1 1 1   -14 14 o 5  68.88   27.17  87.63     158.35   46.84    168.47   396.71    463.74   66.03   27.30  122.27  46.99  -56.24  54.34  
1 1 1 1   -14 15 o 9  49.18   22.60  -98.49    146.02   -74.42   153.32   -333.42   479.05   52.46   23.74  85.07   39.73  -32.61  46.28  
1 1 1 1   -14 16 o 14 77.06   28.01  155.08    160.25   130.43   168.66   383.87    513.76   74.89   28.44  122.24  48.71  -47.35  56.41  
1 1 1 1   -14 17 o 13 52.60   23.73  -65.97    151.77   -55.60   159.34   -167.27   498.17   54.88   24.57  92.27   42.16  -37.39  48.80  
1 1 1 1   -14 18 o 18 73.48   27.59  132.47    157.66   109.41   165.77   351.05    510.37   71.66   27.94  118.03  48.01  -46.37  55.55  
1 1 1 1   -14 19 o 10 99.68   28.29  317.29    169.41   331.94   177.67   170.53    562.29   101.78  29.00  109.94  47.80  -8.16   55.91  
1 1 1 1   -14 20 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   -13 0  o 13 362.14  31.69  3885.67   652.15   3887.66  792.79   3881.49   1146.91  359.38  39.05  349.08  59.35  10.30   71.05  
1 1 1 1   -13 1  o 18 340.63  28.29  3420.65   548.14   3410.43  664.50   3442.43   969.66   337.88  34.75  331.46  52.72  6.42    63.15  
1 1 1 1   -13 2  o 16 66.87   17.77  133.98    69.36    133.98   69.36    0.00      0.00     66.87   17.77  ?       ?      0.00    17.77  
1 1 1 1   -13 3  o 5  80.72   15.59  194.57    69.63    184.69   71.72    356.61    290.44   78.48   16.45  112.42  37.94  -33.93  41.35  
1 1 1 1   -13 4  o 14 252.93  29.41  1904.78   419.06   2047.71  572.10   1739.29   615.58   258.73  39.79  235.20  47.23  23.53   61.76  
1 1 1 1   -13 5  o 8  160.91  26.32  776.65    234.72   1047.92  300.30   350.72    376.29   186.77  28.94  117.22  42.88  69.55   51.73  
1 1 1 1   -13 6  o 7  312.90  34.53  2937.77   609.89   2777.58  842.86   3113.83   883.62   296.69  51.34  314.89  50.60  -18.20  72.08  
1 1 1 1   -13 7  o 1  430.20  74.88  6213.74   1782.03  0.00     0.00     6213.74   1782.03  ?       ?      430.20  74.88  0.00    74.88  
1 1 1 1   -13 8  o 3  136.77  46.75  532.97    441.14   0.00     0.00     532.97    441.14   ?       ?      136.77  46.75  0.00    46.75  
1 1 1 1   -13 9  x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   -13 10 o 3  313.49  39.26  2974.71   691.10   3851.14  934.76   1918.07   1026.36  353.49  47.25  239.66  70.15  113.83  84.57  
1 1 1 1   -13 11 o 4  84.38   31.12  169.70    198.88   151.39   223.94   238.05    432.64   85.20   32.67  112.82  44.78  -27.62  55.44  
1 1 1 1   -13 12 o 6  99.62   31.42  293.16    200.82   345.69   228.15   112.47    423.16   107.50  33.43  103.15  43.01  4.36    54.48  
1 1 1 1   -13 13 o 5  273.58  45.75  2385.17   693.12   2385.17  693.12   0.00      0.00     273.58  45.75  ?       ?      0.00    45.75  
1 1 1 1   -13 14 f 0  164.38  30.49  831.77    277.11   831.77   277.11   0.00      0.00     164.38  30.49  ?       ?      0.00    30.49  
1 1 1 1   -13 15 o 11 200.25  27.02  1213.56   302.66   1193.48  368.87   1254.92   529.44   195.72  34.07  194.33  47.79  1.39    58.69  
1 1 1 1   -13 16 o 1  349.01  40.66  3878.09   799.35   3889.14  1097.31  3865.60   1166.78  331.89  59.79  325.72  64.68  6.17    88.08  
1 1 1 1   -13 17 o 6  328.18  41.80  3494.74   769.67   4122.69  1061.07  2797.43   1118.13  342.32  55.92  263.23  71.95  79.09   91.13  
1 1 1 1   -13 18 o 4  114.95  41.63  392.50    353.50   0.00     0.00     392.50    353.50   ?       ?      114.95  41.63  0.00    41.63  
1 1 1 1   -13 19 o 11 53.18   23.29  -21.01    135.73   19.86    147.28   -251.22   349.56   59.32   25.09  72.87   34.00  -13.56  42.26  
1 1 1 1   -13 20 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   -13 21 o 11 57.85   24.17  31.98     134.02   36.62    142.90   -1.92     386.37   59.88   24.98  87.56   38.79  -27.68  46.14  
1 1 1 1   -13 22 o 12 96.03   41.12  135.31    403.89   0.00     0.00     135.31    403.89   ?       ?      96.03   41.12  0.00    41.12  
1 1 1 1   -12 0  o 17 363.12  57.62  4123.05   1160.98  4123.05  1160.98  0.00      0.00     363.12  57.62  ?       ?      0.00    57.62  
1 1 1 1   -12 1  o 1  120.58  14.17  424.74    96.25    431.62   105.30   389.79    237.27   121.37  15.46  114.29  33.80  7.08    37.17  
1 1 1 1   -12 2  o 5  184.11  15.38  984.20    161.03   811.16   184.72   1532.21   328.72   166.34  19.73  228.22  25.53  -61.89  32.26  
1 1 1 1   -12 3  o 4  815.35  97.68  22751.03  4481.19  22680.83 6335.90  22821.30  6338.82  730.20  155.89 733.37  155.40 -3.17   220.12 
1 1 1 1   -12 4  o 16 312.85  33.40  2900.64   590.61   2944.58  827.77   2855.07   842.93   310.25  48.03  304.68  49.92  5.57    69.27  
1 1 1 1   -12 5  o 13 269.78  28.95  2147.67   441.41   2068.20  614.69   2232.27   634.25   260.67  42.54  271.18  42.11  -10.50  59.86  
1 1 1 1   -12 6  o 19 152.65  22.46  690.28    190.93   849.15   249.32   464.98    296.91   168.72  26.62  124.79  38.02  43.93   46.41  
1 1 1 1   -12 7  o 6  181.04  38.62  1009.44   389.18   0.00     0.00     1009.44   389.18   ?       ?      181.04  38.62  0.00    38.62  
1 1 1 1   -12 8  o 19 166.32  28.47  832.50    262.07   832.50   262.07   0.00      0.00     166.32  28.47  ?       ?      0.00    28.47  
1 1 1 1   -12 9  o 3  411.53  45.46  5188.00   1056.00  5462.31  1480.82  4904.15   1506.33  409.63  65.15  383.61  71.02  26.02   96.38  
1 1 1 1   -12 10 o 10 355.72  61.38  4067.38   1208.10  0.00     0.00     4067.38   1208.10  ?       ?      355.72  61.38  0.00    61.38  
1 1 1 1   -12 11 o 11 211.03  50.82  1407.82   608.27   0.00     0.00     1407.82   608.27   ?       ?      211.03  50.82  0.00    50.82  
1 1 1 1   -12 12 o 7  273.66  53.71  2365.82   813.59   0.00     0.00     2365.82   813.59   ?       ?      273.66  53.71  0.00    53.71  
1 1 1 1   -12 13 o 16 329.83  35.63  3265.75   663.89   3029.47  904.27   3542.04   977.82   309.77  52.74  335.60  52.47  -25.83  74.40  
1 1 1 1   -12 14 o 16 253.53  30.77  1929.61   438.61   2339.28  591.18   1427.98   654.18   276.40  38.28  208.94  54.11  67.46   66.29  
1 1 1 1   -12 15 o 2  166.93  30.09  852.25    277.71   852.25   277.71   0.00      0.00     166.93  30.09  ?       ?      0.00    30.09  
1 1 1 1   -12 16 o 18 339.79  58.31  3893.04   1096.40  3893.04  1096.40  0.00      0.00     339.79  58.31  ?       ?      0.00    58.31  
1 1 1 1   -12 17 o 9  128.56  27.94  511.28    200.31   511.28   200.31   0.00      0.00     128.56  27.94  ?       ?      0.00    27.94  
1 1 1 1   -12 18 o 18 124.95  23.87  477.76    164.98   440.81   191.45   584.32    325.15   118.76  28.45  134.54  39.51  -15.78  48.69  
1 1 1 1   -12 19 o 4  186.04  33.14  1095.09   340.91   1095.09  340.91   0.00      0.00     186.04  33.14  ?       ?      0.00    33.14  
1 1 1 1   -12 20 o 6  163.20  43.16  906.79    410.54   0.00     0.00     906.79    410.54   ?       ?      163.20  43.16  0.00    43.16  
1 1 1 1   -12 21 o 11 64.48   24.24  97.97     121.81   121.30   131.50   -43.13    323.37   69.04   25.33  79.68   35.38  -10.64  43.52  
1 1 1 1   -12 22 o 14 72.75   25.27  149.76    129.08   152.42   139.80   134.39    336.26   74.09   26.26  91.47   38.26  -17.38  46.40  
1 1 1 1   -12 23 o 10 42.69   19.59  -69.88    109.28   -74.03   115.13   -32.20    347.23   43.73   20.09  81.55   36.41  -37.82  41.58  
1 1 1 1   -11 0  o 1  90.52   20.60  247.49    104.60   210.89   138.92   295.41    158.97   84.77   26.04  98.81   27.18  -14.04  37.64  
1 1 1 1   -11 1  o 13 298.57  31.67  2657.34   534.53   2687.40  752.67   2626.75   759.27   294.49  46.03  290.58  47.13  3.90    65.88  
1 1 1 1   -11 2  o 1  338.43  53.95  3598.99   1012.94  3598.99  1012.94  0.00      0.00     338.43  53.95  ?       ?      0.00    53.95  
1 1 1 1   -11 3  o 19 236.91  37.49  1699.81   492.93   1699.81  492.93   0.00      0.00     236.91  37.49  ?       ?      0.00    37.49  
1 1 1 1   -11 4  f 0  119.97  25.66  434.36    171.34   434.36   171.34   0.00      0.00     119.97  25.66  ?       ?      0.00    25.66  
1 1 1 1   -11 5  o 15 241.97  26.34  1722.39   360.01   1857.12  501.48   1579.12   517.15   248.84  36.16  227.68  41.08  21.15   54.73  
1 1 1 1   -11 6  o 11 496.45  53.42  7512.11   1498.44  7855.23  2115.65  7166.74   2122.59  493.03  77.29  467.28  82.12  25.75   112.77 
1 1 1 1   -11 7  o 8  126.64  21.64  476.94    151.66   5.11     180.19   1623.15   280.84   65.14   27.66  235.96  20.95  -170.82 34.70  
1 1 1 1   -11 8  o 2  260.86  28.02  2003.44   413.00   1988.44  572.38   2019.74   596.51   256.58  40.18  258.17  41.67  -1.59   57.88  
1 1 1 1   -11 9  o 14 334.87  36.36  3342.44   687.73   3671.31  965.69   3004.00   979.64   345.72  50.12  309.06  57.33  36.66   76.15  
1 1 1 1   -11 10 o 14 372.53  40.27  4179.84   847.43   4410.08  1191.05  3943.78   1206.00  374.28  57.25  350.90  62.14  23.38   84.49  
1 1 1 1   -11 11 o 14 281.84  31.27  2365.24   497.45   2596.67  695.35   2122.63   711.94   291.12  42.89  260.01  49.50  31.11   65.50  
1 1 1 1   -11 12 o 7  224.50  24.70  1486.74   313.03   1187.38  420.23   1859.92   469.19   196.46  38.64  248.78  33.72  -52.33  51.28  
1 1 1 1   -11 13 o 9  291.36  48.72  2633.37   786.15   0.00     0.00     2633.37   786.15   ?       ?      291.36  48.72  0.00    48.72  
1 1 1 1   -11 14 o 14 516.32  91.94  9331.67   2625.17  0.00     0.00     9331.67   2625.17  ?       ?      516.32  91.94  0.00    91.94  
1 1 1 1   -11 15 o 11 90.72   36.33  129.91    287.22   0.00     0.00     129.91    287.22   ?       ?      90.72   36.33  0.00    36.33  
1 1 1 1   -11 16 o 14 149.21  22.89  664.85    189.81   638.88   232.17   717.18    329.58   144.70  28.96  151.44  37.98  -6.74   47.76  
1 1 1 1   -11 17 o 4  243.21  28.12  1775.73   385.35   1926.65  525.83   1600.65   566.36   249.23  37.95  223.10  45.76  26.14   59.45  
1 1 1 1   -11 18 o 11 237.33  39.03  1769.83   513.28   1769.83  513.28   0.00      0.00     237.33  39.03  ?       ?      0.00    39.03  
1 1 1 1   -11 19 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   -11 20 o 15 137.92  27.25  590.36    208.09   590.36   208.09   0.00      0.00     137.92  27.25  ?       ?      0.00    27.25  
1 1 1 1   -11 21 f 0  169.02  23.62  868.75    222.90   977.29   277.11   669.76    375.19   177.49  28.13  141.34  42.67  36.15   51.11  
1 1 1 1   -11 22 o 4  232.51  28.43  1677.27   371.56   1753.38  492.05   1576.29   566.78   231.08  38.44  211.73  47.77  19.35   61.32  
1 1 1 1   -11 23 o 16 117.20  22.55  425.61    146.21   411.42   163.01   483.99    330.65   114.19  25.51  120.85  40.48  -6.67   47.85  
1 1 1 1   -11 24 o 9  42.73   19.46  -57.35    104.95   -71.84   110.88   67.30     325.14   42.92   19.71  85.19   36.69  -42.27  41.65  
1 1 1 1   -11 25 f 0  150.57  23.41  706.69    195.75   782.57   232.68   522.93    362.08   156.77  26.82  122.26  42.34  34.51   50.12  
1 1 1 1   -10 0  o 9  179.26  17.38  942.16    176.60   821.40   243.93   1075.17   256.00   164.87  26.68  189.92  24.02  -25.05  35.90  
1 1 1 1   -10 1  x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   -10 2  o 8  161.15  18.44  764.29    167.56   877.25   241.28   659.08    232.86   171.09  25.33  146.98  28.63  24.10   38.23  
1 1 1 1   -10 3  o 4  236.04  25.30  1652.14   337.42   1844.37  479.04   1462.85   475.35   246.20  34.87  217.01  39.62  29.20   52.78  
1 1 1 1   -10 4  f 0  631.99  76.38  13694.32  2715.05  14342.22 3838.77  13045.81  3840.55  586.18  118.16 546.54  125.12 39.64   172.09 
1 1 1 1   -10 5  x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   -10 6  o 5  199.19  30.78  1191.27   340.62   1191.27  340.62   0.00      0.00     199.19  30.78  ?       ?      0.00    30.78  
1 1 1 1   -10 7  o 12 199.27  30.77  1188.45   340.66   1188.45  340.66   0.00      0.00     199.27  30.77  ?       ?      0.00    30.77  
1 1 1 1   -10 8  o 1  312.15  32.99  2884.41   582.30   3011.68  818.91   2754.25   828.15   314.43  46.79  299.25  49.97  15.18   68.46  
1 1 1 1   -10 9  o 1  696.40  83.04  15740.27  3254.63  19292.62 4602.22  12186.33  4603.25  739.43  111.92 548.31  144.31 191.12  182.62 
1 1 1 1   -10 10 o 13 157.72  20.25  730.73    179.16   953.88   248.15   487.74    258.94   179.71  24.71  126.95  34.59  52.76   42.51  
1 1 1 1   -10 11 o 16 188.07  21.50  1037.22   227.95   1150.19  310.26   904.70    336.03   196.77  28.28  172.55  35.12  24.22   45.09  
1 1 1 1   -10 12 o 19 674.89  143.47 19324.03  5387.11  0.00     0.00     19324.03  5387.11  ?       ?      674.89  143.47 0.00    143.47 
1 1 1 1   -10 13 o 18 54.47   20.78  59.84     90.22    131.61   105.74   -132.35   173.02   68.98   22.89  53.07   24.47  15.91   33.50  
1 1 1 1   -10 14 o 1  366.38  39.02  4047.49   808.01   4007.75  1134.69  4088.38   1150.89  354.98  57.66  358.45  57.90  -3.48   81.71  
1 1 1 1   -10 15 o 2  154.19  37.81  733.03    332.11   0.00     0.00     733.03    332.11   ?       ?      154.19  37.81  0.00    37.81  
1 1 1 1   -10 16 o 4  275.47  48.29  2358.45   735.79   0.00     0.00     2358.45   735.79   ?       ?      275.47  48.29  0.00    48.29  
1 1 1 1   -10 17 o 1  503.76  93.63  9300.80   2608.02  0.00     0.00     9300.80   2608.02  ?       ?      503.76  93.63  0.00    93.63  
1 1 1 1   -10 18 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   -10 19 o 13 303.42  52.51  3030.50   881.52   0.00     0.00     3030.50   881.52   ?       ?      303.42  52.51  0.00    52.51  
1 1 1 1   -10 20 o 9  133.02  25.23  540.74    185.64   540.74   185.64   0.00      0.00     133.02  25.23  ?       ?      0.00    25.23  
1 1 1 1   -10 21 o 1  67.12   22.96  124.17    106.40   124.17   106.40   0.00      0.00     67.12   22.96  ?       ?      0.00    22.96  
1 1 1 1   -10 22 o 8  103.02  23.95  329.56    138.98   329.56   138.98   0.00      0.00     103.02  23.95  ?       ?      0.00    23.95  
1 1 1 1   -10 23 f 0  225.68  28.10  1578.16   356.20   1856.50  474.82   1219.90   538.69   240.07  35.52  184.16  49.78  55.91   61.15  
1 1 1 1   -10 24 o 18 128.40  21.90  506.74    155.64   575.83   179.69   299.18    311.45   136.29  23.83  102.79  38.74  33.51   45.48  
1 1 1 1   -10 25 o 16 265.57  32.88  2290.09   490.55   2563.33  674.32   1982.95   714.93   268.06  45.44  223.07  55.94  44.99   72.07  
1 1 1 1   -10 26 o 19 160.62  22.72  800.69    203.68   867.14   252.82   677.84    343.79   164.39  27.78  137.35  40.70  27.04   49.28  
1 1 1 1   -9  0  o 1  329.06  35.19  3296.91   654.41   3477.52  925.19   3116.09   925.75   328.54  50.68  308.29  54.29  20.24   74.27  
1 1 1 1   -9  1  o 14 159.07  17.64  744.22    158.40   859.97   227.50   635.31    220.68   169.53  24.05  144.30  27.65  25.23   36.64  
1 1 1 1   -9  2  o 12 431.26  48.49  5904.29   1179.70  6825.84  1668.95  4984.07   1667.74  445.62  67.34  365.56  81.55  80.06   105.76 
1 1 1 1   -9  3  x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   -9  4  o 19 395.17  68.82  5390.37   1504.44  0.00     0.00     5390.37   1504.44  ?       ?      395.17  68.82  0.00    68.82  
1 1 1 1   -9  5  o 18 239.43  37.63  1768.72   500.14   0.00     0.00     1768.72   500.14   ?       ?      239.43  37.63  0.00    37.63  
1 1 1 1   -9  6  o 2  64.21   13.87  123.70    49.64    10.74    57.48    455.09    98.46    38.39   15.92  124.72  13.99  -86.33  21.19  
1 1 1 1   -9  7  o 16 357.42  38.23  3876.55   772.30   4048.84  1091.35  3703.73   1093.05  355.50  55.27  337.69  58.50  17.80   80.48  
1 1 1 1   -9  8  f 0  514.06  93.98  9581.64   2671.16  9581.64  2671.16  0.00      0.00     514.06  93.98  ?       ?      0.00    93.98  
1 1 1 1   -9  9  o 18 358.00  56.83  4034.82   1128.93  4034.82  1128.93  0.00      0.00     358.00  56.83  ?       ?      0.00    56.83  
1 1 1 1   -9  10 o 12 211.82  32.51  1343.02   382.71   1343.02  382.71   0.00      0.00     211.82  32.51  ?       ?      0.00    32.51  
1 1 1 1   -9  11 o 14 113.80  16.19  380.82    102.77   398.94   132.18   353.12    163.42   115.75  20.65  108.12  26.53  7.63    33.62  
1 1 1 1   -9  12 o 11 216.45  22.89  1371.72   280.07   1285.30  388.79   1464.92   403.78   207.02  33.89  221.61  32.72  -14.59  47.11  
1 1 1 1   -9  13 o 11 518.80  54.78  8244.21   1606.99  7716.81  2270.36  8773.73   2274.89  481.49  85.26  518.97  78.83  -37.48  116.12 
1 1 1 1   -9  14 o 18 228.00  24.76  1530.48   318.87   1604.29  441.14   1449.72   461.45   230.96  34.31  218.16  38.24  12.80   51.38  
1 1 1 1   -9  15 o 18 42.80   18.80  -22.89    89.01    37.49    101.40   -225.66   185.81   53.37   21.51  50.22   23.84  3.15    32.11  
1 1 1 1   -9  16 o 5  338.33  36.76  3436.76   702.42   3722.40  983.41   3139.23   1003.65  345.57  51.11  313.40  57.92  32.16   77.25  
1 1 1 1   -9  17 o 1  276.98  31.22  2280.79   487.79   2552.19  667.59   1969.91   714.49   289.68  41.31  250.05  51.49  39.63   66.02  
1 1 1 1   -9  18 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   -9  19 o 18 204.17  37.85  1291.19   427.31   0.00     0.00     1291.19   427.31   ?       ?      204.17  37.85  0.00    37.85  
1 1 1 1   -9  20 o 16 201.46  37.63  1271.54   419.22   0.00     0.00     1271.54   419.22   ?       ?      201.46  37.63  0.00    37.63  
1 1 1 1   -9  21 o 17 194.61  23.36  1132.32   255.80   1263.58  337.20   954.41    392.58   203.36  29.77  172.13  40.42  31.23   50.20  
1 1 1 1   -9  22 o 5  339.62  39.87  3671.57   762.58   4213.37  1068.11  3108.29   1089.08  349.67  55.03  287.32  67.23  62.35   86.88  
1 1 1 1   -9  23 o 13 217.88  36.40  1526.03   439.18   1526.03  439.18   0.00      0.00     217.88  36.40  ?       ?      0.00    36.40  
1 1 1 1   -9  24 o 6  213.47  36.47  1483.72   430.88   1483.72  430.88   0.00      0.00     213.47  36.47  ?       ?      0.00    36.47  
1 1 1 1   -9  25 o 7  218.89  37.85  1594.51   458.46   1594.51  458.46   0.00      0.00     218.89  37.85  ?       ?      0.00    37.85  
1 1 1 1   -9  26 o 8  86.43   21.39  234.04    105.52   300.51   118.28   -25.25    233.62   98.00   21.61  68.32   30.22  29.67   37.15  
1 1 1 1   -9  27 o 18 165.37  22.66  849.80    209.45   1012.65  270.49   605.92    331.01   177.84  27.37  129.83  40.25  48.01   48.68  
1 1 1 1   -8  0  o 8  545.44  62.26  9707.91   1914.68  9886.78  2707.70  9529.03   2707.83  512.09  95.62  499.60  97.92  12.49   136.86 
1 1 1 1   -8  1  o 19 228.90  35.21  1597.43   447.83   1597.43  447.83   0.00      0.00     228.90  35.21  ?       ?      0.00    35.21  
1 1 1 1   -8  2  o 16 730.83  98.33  20434.75  4020.86  20103.57 5686.18  20765.97  5686.52  594.00  162.21 611.11  160.18 -17.10  227.97 
1 1 1 1   -8  3  o 7  133.85  14.56  524.09    110.07   514.66   151.74   534.57    159.89   131.36  20.82  133.76  21.56  -2.40   29.97  
1 1 1 1   -8  4  o 2  245.93  25.58  1795.44   355.92   1775.17  501.76   1815.97   504.94   240.08  37.64  242.98  37.40  -2.90   53.06  
1 1 1 1   -8  5  o 12 21.98   10.12  -22.79    29.43    -134.28  34.08    303.62    58.32    ?       ?      102.16  10.07  0.00    10.07  
1 1 1 1   -8  6  o 7  200.29  31.10  1219.53   346.00   0.00     0.00     1219.53   346.00   ?       ?      200.29  31.10  0.00    31.10  
1 1 1 1   -8  7  o 17 52.49   17.34  76.31     60.68    0.00     0.00     76.31     60.68    ?       ?      52.49   17.34  0.00    17.34  
1 1 1 1   -8  8  f 0  278.04  43.99  2422.38   678.82   0.00     0.00     2422.38   678.82   ?       ?      278.04  43.99  0.00    43.99  
1 1 1 1   -8  9  o 18 210.24  22.27  1303.38   264.71   1416.88  374.47   1190.01   374.24   216.76  30.97  197.24  34.30  19.51   46.21  
1 1 1 1   -8  10 o 8  211.96  22.21  1321.81   266.21   1267.01  372.68   1378.89   380.39   204.58  32.85  213.88  31.96  -9.30   45.83  
1 1 1 1   -8  11 o 6  406.57  66.07  5336.32   1489.22  5336.32  1489.22  0.00      0.00     406.57  66.07  ?       ?      0.00    66.07  
1 1 1 1   -8  12 o 10 544.08  93.51  10099.34  2815.34  10099.34 2815.34  0.00      0.00     544.08  93.51  ?       ?      0.00    93.51  
1 1 1 1   -8  13 o 8  416.34  65.89  5453.96   1522.39  5453.96  1522.39  0.00      0.00     416.34  65.89  ?       ?      0.00    65.89  
1 1 1 1   -8  14 o 6  234.60  24.98  1614.78   331.25   1672.39  461.92   1553.78   475.30   236.40  35.10  226.97  37.81  9.43    51.59  
1 1 1 1   -8  15 o 4  456.12  49.00  6332.32   1262.94  6689.23  1784.27  5973.96   1787.88  455.92  70.44  426.95  75.72  28.97   103.42 
1 1 1 1   -8  16 o 7  478.64  53.22  7119.76   1437.66  7996.60  2031.15  6239.44   2035.19  490.86  74.41  422.46  86.82  68.40   114.35 
1 1 1 1   -8  17 o 8  161.34  26.45  780.29    236.49   780.29   236.49   0.00      0.00     161.34  26.45  ?       ?      0.00    26.45  
1 1 1 1   -8  18 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   -8  19 o 9  35.65   17.65  -310.36   134.50   -133.31  155.88   -826.28   266.09   49.47   22.95  44.83   22.58  4.63    32.19  
1 1 1 1   -8  20 o 17 80.67   21.05  196.51    98.49    179.20   111.83   256.37    207.96   77.82   23.25  95.46   32.11  -17.64  39.64  
1 1 1 1   -8  21 o 7  160.42  33.17  799.75    295.34   0.00     0.00     799.75    295.34   ?       ?      160.42  33.17  0.00    33.17  
1 1 1 1   -8  22 o 10 103.38  32.45  323.61    214.40   0.00     0.00     323.61    214.40   ?       ?      103.38  32.45  0.00    32.45  
1 1 1 1   -8  23 o 15 63.66   21.58  112.17    93.97    167.21   106.19   -86.47    201.73   74.79   22.73  60.69   27.37  14.10   35.58  
1 1 1 1   -8  24 o 8  255.87  30.08  2031.30   433.34   2649.24  610.19   1402.52   615.52   286.61  38.02  196.76  53.22  89.84   65.41  
1 1 1 1   -8  25 o 3  48.02   19.33  34.09     81.75    132.53   101.24   -150.43   138.60   67.67   22.39  43.92   20.77  23.76   30.55  
1 1 1 1   -8  26 o 6  144.84  26.64  661.90    213.36   661.90   213.36   0.00      0.00     144.84  26.64  ?       ?      0.00    26.64  
1 1 1 1   -8  27 o 18 116.20  24.14  427.50    155.78   427.50   155.78   0.00      0.00     116.20  24.14  ?       ?      0.00    24.14  
1 1 1 1   -8  28 o 7  52.60   23.79  -59.37    153.76   0.00     0.00     -59.37    153.76   ?       ?      52.60   23.79  0.00    23.79  
1 1 1 1   -7  0  o 15 424.75  44.91  5470.33   1078.47  5522.92  1525.10  5417.72   1525.28  414.48  66.33  409.93  67.14  4.55    94.38  
1 1 1 1   -7  1  o 14 357.90  37.37  3834.52   756.43   3862.85  1069.51  3806.17   1069.99  351.31  54.82  348.41  55.35  2.90    77.90  
1 1 1 1   -7  2  o 10 816.01  104.71 24353.90  4792.17  23872.99 6777.01  24834.85  6777.28  685.57  172.39 708.26  169.04 -22.69  241.44 
1 1 1 1   -7  3  o 4  429.75  71.54  6109.23   1702.87  0.00     0.00     6109.23   1702.87  ?       ?      429.75  71.54  0.00    71.54  
1 1 1 1   -7  4  o 5  262.02  26.66  2030.29   395.42   1624.35  558.26   2439.00   560.15   228.21  44.21  284.61  35.02  -56.40  56.40  
1 1 1 1   -7  5  f 0  142.22  14.15  589.85    113.98   -1.56    156.80   1252.48   165.97   59.98   25.65  207.79  14.00  -147.81 29.22  
1 1 1 1   -7  6  o 6  52.92   9.55   83.08     27.93    68.16    33.09    120.07    52.09    47.70   12.07  63.20   14.65  -15.50  18.98  
1 1 1 1   -7  7  o 3  353.45  37.71  3804.58   753.26   3914.04  1065.10  3695.06   1065.44  347.81  55.18  336.40  57.22  11.42   79.49  
1 1 1 1   -7  8  o 2  270.35  28.87  2186.16   441.07   2521.74  624.20   1851.49   623.34   286.10  39.02  240.91  46.76  45.19   60.90  
1 1 1 1   -7  9  o 14 117.50  19.01  411.54    123.85   0.00     0.00     411.54    123.85   ?       ?      117.50  19.01  0.00    19.01  
1 1 1 1   -7  10 o 12 75.74   15.89  172.33    66.89    0.00     0.00     172.33    66.89    ?       ?      75.74   15.89  0.00    15.89  
1 1 1 1   -7  11 o 5  341.08  36.88  3524.69   710.59   4198.78  1005.58  2852.36   1004.27  365.59  49.16  293.13  61.64  72.45   78.84  
1 1 1 1   -7  12 o 10 180.00  19.46  950.56    197.94   1195.36  281.70   711.85    278.18   200.85  24.97  152.43  32.77  48.41   41.20  
1 1 1 1   -7  13 f 0  164.52  18.18  792.05    168.82   909.58   234.12   664.73    243.67   175.34  23.88  148.20  29.68  27.14   38.09  
1 1 1 1   -7  14 o 19 572.98  99.73  11345.17  3161.32  11345.17 3161.32  0.00      0.00     572.98  99.73  ?       ?      0.00    99.73  
1 1 1 1   -7  15 o 14 630.73  113.62 14221.47  3962.62  14221.47 3962.62  0.00      0.00     630.73  113.62 ?       ?      0.00    113.62 
1 1 1 1   -7  16 o 2  383.65  40.21  4402.15   872.35   4478.49  1231.60  4325.29   1235.79  378.89  58.51  371.50  59.99  7.39    83.80  
1 1 1 1   -7  17 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   -7  18 o 6  148.48  17.85  647.52    149.13   789.98   197.95   460.50    226.79   163.45  21.63  122.64  31.91  40.81   38.55  
1 1 1 1   -7  19 o 10 406.92  44.06  5045.80   1012.82  5721.32  1429.35  4364.59   1435.36  423.34  60.54  361.70  71.66  61.64   93.81  
1 1 1 1   -7  20 o 5  407.63  44.39  5068.33   1022.01  5870.54  1440.07  4254.27   1450.67  429.14  60.10  355.66  73.48  73.48   94.93  
1 1 1 1   -7  21 o 6  468.92  52.78  6965.58   1396.05  7893.42  1971.57  6032.58   1977.05  479.27  74.04  404.57  87.66  74.70   114.75 
1 1 1 1   -7  22 o 3  244.27  27.19  1788.99   374.76   2243.94  520.47   1299.18   540.05   270.74  34.25  199.18  47.83  71.56   58.83  
1 1 1 1   -7  23 o 8  203.11  35.58  1294.26   399.71   0.00     0.00     1294.26   399.71   ?       ?      203.11  35.58  0.00    35.58  
1 1 1 1   -7  24 o 16 229.55  38.40  1689.76   488.10   0.00     0.00     1689.76   488.10   ?       ?      229.55  38.40  0.00    38.40  
1 1 1 1   -7  25 o 12 112.57  25.74  397.04    162.69   0.00     0.00     397.04    162.69   ?       ?      112.57  25.74  0.00    25.74  
1 1 1 1   -7  26 o 14 137.89  17.77  570.29    137.43   697.77   184.77   412.45    205.59   151.18  21.93  112.94  30.85  38.24   37.85  
1 1 1 1   -7  27 o 2  83.54   18.31  215.12    85.41    290.01   106.03   76.79     144.10   96.89   19.73  64.47   25.76  32.42   32.45  
1 1 1 1   -7  28 o 15 155.15  27.87  776.67    239.14   776.67   239.14   0.00      0.00     155.15  27.87  ?       ?      0.00    27.87  
1 1 1 1   -7  29 o 15 116.56  23.58  434.18    152.35   434.18   152.35   0.00      0.00     116.56  23.58  ?       ?      0.00    23.58  
1 1 1 1   -6  0  o 19 424.72  67.30  5693.00   1586.27  5693.00  1586.27  0.00      0.00     424.72  67.30  ?       ?      0.00    67.30  
1 1 1 1   -6  1  f 0  634.58  114.56 14433.93  4019.96  14433.93 4019.96  0.00      0.00     634.58  114.56 ?       ?      0.00    114.56 
1 1 1 1   -6  2  o 6  716.99  143.89 20526.35  5716.36  20526.35 5716.36  0.00      0.00     716.99  143.89 ?       ?      0.00    143.89 
1 1 1 1   -6  3  o 9  681.86  76.55  14967.75  2944.56  14700.91 4164.13  15234.63  4164.34  630.57  119.41 645.38  116.70 -14.81  166.96 
1 1 1 1   -6  4  f 0  99.34   10.80  287.28    60.62    -5.26    81.71    645.48    90.42    43.02   18.46  149.41  10.61  -106.39 21.29  
1 1 1 1   -6  5  o 13 466.61  43.91  6570.80   1162.33  -2.14    1642.33  13167.01  1645.23  181.86  80.29  662.01  43.53  -480.15 91.34  
1 1 1 1   -6  6  f 0  416.28  43.96  5266.92   1034.64  5110.29  1463.01  5423.63   1463.38  396.46  66.64  410.29  64.24  -13.83  92.56  
1 1 1 1   -6  7  o 3  228.83  23.56  1542.97   305.07   1527.58  431.32   1558.37   431.55   224.43  34.59  226.85  34.20  -2.42   48.64  
1 1 1 1   -6  8  o 14 309.72  32.36  2874.52   566.93   2855.93  801.69   2893.12   801.82   301.49  47.92  303.68  47.55  -2.19   67.51  
1 1 1 1   -6  9  o 13 223.57  34.45  1525.54   427.98   0.00     0.00     1525.54   427.98   ?       ?      223.57  34.45  0.00    34.45  
1 1 1 1   -6  10 o 18 249.24  26.31  1848.70   370.79   2202.95  524.85   1495.75   523.89   268.96  34.81  217.33  43.51  51.63   55.72  
1 1 1 1   -6  11 o 12 38.47   14.95  26.67     47.35    0.00     0.00     26.67     47.35    ?       ?      38.47   14.95  0.00    14.95  
1 1 1 1   -6  12 o 14 70.82   15.72  150.89    62.24    0.00     0.00     150.89    62.24    ?       ?      70.82   15.72  0.00    15.72  
1 1 1 1   -6  13 o 7  186.95  28.70  1050.83   298.22   0.00     0.00     1050.83   298.22   ?       ?      186.95  28.70  0.00    28.70  
1 1 1 1   -6  14 o 10 387.85  41.20  4547.86   903.40   5035.76  1277.66  4060.06   1277.54  399.42  57.36  353.29  65.40  46.14   86.99  
1 1 1 1   -6  15 o 10 406.46  64.87  5236.35   1462.86  0.00     0.00     5236.35   1462.86  ?       ?      406.46  64.87  0.00    64.87  
1 1 1 1   -6  16 f 0  181.88  27.84  984.16    281.49   984.16   281.49   0.00      0.00     181.88  27.84  ?       ?      0.00    27.84  
1 1 1 1   -6  17 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   -6  18 o 14 266.65  41.22  2169.94   610.65   2169.94  610.65   0.00      0.00     266.65  41.22  ?       ?      0.00    41.22  
1 1 1 1   -6  19 o 7  471.77  51.94  6956.74   1383.39  7946.86  1955.98  5965.75   1956.83  487.36  72.08  409.00  86.07  78.36   112.27 
1 1 1 1   -6  20 o 15 358.80  38.14  3881.59   773.60   4270.18  1092.84  3491.31   1095.23  368.65  53.18  328.80  60.24  39.84   80.35  
1 1 1 1   -6  21 o 11 499.84  55.45  7850.26   1564.33  8987.31  2211.47  6711.50   2213.13  515.86  77.03  430.68  92.29  85.18   120.22 
1 1 1 1   -6  22 o 3  183.84  20.57  996.27    213.35   1121.72  296.60   861.75    307.12   193.34  27.50  167.38  33.14  25.96   43.06  
1 1 1 1   -6  23 o 12 106.92  15.99  339.17    95.13    379.94   122.62   277.56    150.76   112.46  19.71  95.30   26.56  17.15   33.08  
1 1 1 1   -6  24 o 12 160.69  19.07  766.55    172.52   771.56   228.49   759.91    263.12   159.10  25.91  156.27  30.42  2.83    39.96  
1 1 1 1   -6  25 f 0  58.38   18.71  98.32     70.98    113.09   79.87    42.87     154.77   62.35   19.84  63.20   26.15  -0.86   32.82  
1 1 1 1   -6  26 o 10 238.10  42.48  1915.48   559.28   0.00     0.00     1915.48   559.28   ?       ?      238.10  42.48  0.00    42.48  
1 1 1 1   -6  27 o 8  59.02   25.93  -21.89    169.33   0.00     0.00     -21.89    169.33   ?       ?      59.02   25.93  0.00    25.93  
1 1 1 1   -6  28 o 16 144.81  19.09  637.17    154.83   671.50   197.42   582.33    249.57   146.33  24.36  131.76  33.05  14.57   41.06  
1 1 1 1   -6  29 o 1  142.84  19.43  626.33    155.16   671.71   199.41   556.70    247.01   145.21  24.81  127.15  33.41  18.06   41.62  
1 1 1 1   -6  30 o 8  82.11   23.13  216.62    113.66   216.62   113.66   0.00      0.00     82.11   23.13  ?       ?      0.00    23.13  
1 1 1 1   -5  0  o 11 669.77  118.84 15806.80  4402.03  0.00     0.00     15806.80  4402.03  ?       ?      669.77  118.84 0.00    118.84 
1 1 1 1   -5  1  o 6  952.34  115.91 31504.74  6206.31  32181.38 8777.05  30828.10  8777.05  859.27  183.51 831.79  188.22 27.48   262.88 
1 1 1 1   -5  2  o 11 388.91  40.11  4492.29   882.77   4252.39  1248.27  4732.30   1248.57  370.48  60.80  392.87  57.02  -22.39  83.36  
1 1 1 1   -5  3  o 2  771.65  154.77 23762.39  6617.21  23762.39 6617.21  0.00      0.00     771.65  154.77 ?       ?      0.00    154.77 
1 1 1 1   -5  4  o 8  10.48   3.90   2.38      3.14     2.38     3.14     0.00      0.00     10.48   3.90   ?       ?      0.00    3.90   
1 1 1 1   -5  5  o 16 118.36  17.69  413.08    116.51   413.08   116.51   0.00      0.00     118.36  17.69  ?       ?      0.00    17.69  
1 1 1 1   -5  6  o 3  68.85   8.65   138.39    33.45    139.25   45.67    137.41    49.12    68.56   12.04  67.94   13.07  0.62    17.77  
1 1 1 1   -5  7  o 10 278.44  28.65  2287.73   451.47   2286.38  638.34   2289.08   638.60   274.26  41.87  274.43  41.86  -0.17   59.21  
1 1 1 1   -5  8  o 12 212.97  21.86  1331.00   263.42   1303.55  372.38   1358.50   372.70   208.13  32.20  212.77  31.46  -4.64   45.02  
1 1 1 1   -5  9  o 6  60.89   9.34   109.15    31.61    127.85   43.71    88.64     45.77    65.58   12.06  54.44   14.42  11.14   18.80  
1 1 1 1   -5  10 f 0  480.80  53.43  7346.65   1449.74  7685.71  2050.21  7007.57   2050.27  466.72  79.36  440.18  84.20  26.54   115.71 
1 1 1 1   -5  11 o 14 411.20  44.85  5265.12   1041.63  5779.30  1473.09  4750.95   1473.08  415.53  63.79  368.95  72.14  46.58   96.29  
1 1 1 1   -5  12 o 13 263.98  41.50  2175.08   608.16   0.00     0.00     2175.08   608.16   ?       ?      263.98  41.50  0.00    41.50  
1 1 1 1   -5  13 o 9  208.82  21.77  1287.22   257.18   1468.11  363.81   1106.54   363.59   220.80  29.43  189.44  34.71  31.36   45.51  
1 1 1 1   -5  14 o 9  238.50  36.84  1740.32   488.18   0.00     0.00     1740.32   488.18   ?       ?      238.50  36.84  0.00    36.84  
1 1 1 1   -5  15 o 16 258.35  39.78  2037.76   571.02   0.00     0.00     2037.76   571.02   ?       ?      258.35  39.78  0.00    39.78  
1 1 1 1   -5  16 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   -5  17 o 9  482.48  79.21  7595.44   2117.88  0.00     0.00     7595.44   2117.88  ?       ?      482.48  79.21  0.00    79.21  
1 1 1 1   -5  18 o 2  228.65  34.83  1569.75   442.80   1569.75  442.80   0.00      0.00     228.65  34.83  ?       ?      0.00    34.83  
1 1 1 1   -5  19 o 4  270.26  41.78  2235.24   627.28   2235.24  627.28   0.00      0.00     270.26  41.78  ?       ?      0.00    41.78  
1 1 1 1   -5  20 o 9  162.68  25.59  792.37    231.08   792.37   231.08   0.00      0.00     162.68  25.59  ?       ?      0.00    25.59  
1 1 1 1   -5  21 f 0  226.07  23.95  1506.82   306.07   1610.19  428.85   1399.50   436.95   231.08  33.29  213.97  36.90  17.10   49.70  
1 1 1 1   -5  22 o 10 415.59  44.72  5297.75   1050.23  5636.95  1483.59  4957.04   1486.90  415.52  64.27  385.15  69.82  30.37   94.90  
1 1 1 1   -5  23 f 0  52.37   18.56  69.39     69.83    54.20    79.71    119.57    144.86   51.34   19.54  71.56   26.53  -20.22  32.95  
1 1 1 1   -5  24 o 17 276.10  29.74  2312.23   464.02   2391.12  651.32   2230.92   661.25   273.34  42.92  262.19  45.59  11.15   62.61  
1 1 1 1   -5  25 o 9  97.80   17.42  287.67    94.19    273.13   114.16   318.69    166.73   94.39   21.54  101.27  27.83  -6.88   35.19  
1 1 1 1   -5  26 o 8  129.58  17.39  501.51    126.13   527.97   160.77   459.15    203.39   131.55  22.07  120.14  29.67  11.41   36.98  
1 1 1 1   -5  27 o 7  238.26  26.75  1758.77   359.51   1804.05  500.03   1710.31   517.27   232.50  38.83  223.86  41.79  8.64    57.05  
1 1 1 1   -5  28 o 14 117.39  29.85  450.70    201.57   0.00     0.00     450.70    201.57   ?       ?      117.39  29.85  0.00    29.85  
1 1 1 1   -5  29 o 5  199.65  38.38  1390.35   423.92   0.00     0.00     1390.35   423.92   ?       ?      199.65  38.38  0.00    38.38  
1 1 1 1   -5  30 f 0  74.17   20.10  173.80    87.70    205.79   102.15   84.11     171.06   80.30   21.66  67.68   27.70  12.62   35.16  
1 1 1 1   -4  0  o 6  695.06  76.27  15204.10  2993.17  14975.60 4232.96  15432.60  4233.01  653.57  117.12 665.88  114.89 -12.31  164.06 
1 1 1 1   -4  1  o 1  317.91  48.26  3061.42   853.11   0.00     0.00     3061.42   853.11   ?       ?      317.91  48.26  0.00    48.26  
1 1 1 1   -4  2  o 2  806.00  162.99 26149.47  7281.75  0.00     0.00     26149.47  7281.75  ?       ?      806.00  162.99 0.00    162.99 
1 1 1 1   -4  3  o 14 344.38  52.58  3612.08   1006.59  0.00     0.00     3612.08   1006.59  ?       ?      344.38  52.58  0.00    52.58  
1 1 1 1   -4  4  o 8  544.06  56.43  8972.20   1736.95  1.13     2455.70  17953.66  2457.13  223.02  98.34  771.73  55.84  -548.71 113.08 
1 1 1 1   -4  5  o 4  330.68  50.41  3325.10   926.75   0.00     0.00     3325.10   926.75   ?       ?      330.68  50.41  0.00    50.41  
1 1 1 1   -4  6  o 14 460.50  73.49  6739.98   1877.52  6739.98  1877.52  0.00      0.00     460.50  73.49  ?       ?      0.00    73.49  
1 1 1 1   -4  7  o 16 647.89  118.30 15216.85  4237.85  15216.85 4237.85  0.00      0.00     647.89  118.30 ?       ?      0.00    118.30 
1 1 1 1   -4  8  o 10 199.50  20.50  1163.91   231.40   1321.69  327.16   1005.94   327.34   211.26  27.64  182.73  32.39  28.53   42.58  
1 1 1 1   -4  9  o 12 284.58  29.35  2395.30   472.60   2394.84  668.27   2395.75   668.46   280.02  42.94  280.07  42.94  -0.05   60.73  
1 1 1 1   -4  10 o 19 492.63  53.95  7616.78   1500.67  7672.45  2122.22  7561.10   2122.32  470.50  81.52  466.27  82.30  4.23    115.84 
1 1 1 1   -4  11 o 14 138.78  21.27  573.54    164.03   0.00     0.00     573.54    164.03   ?       ?      138.78  21.27  0.00    21.27  
1 1 1 1   -4  12 o 14 223.64  23.14  1479.00   292.77   1564.36  413.82   1393.46   414.26   226.90  32.71  213.04  35.09  13.86   47.98  
1 1 1 1   -4  13 o 4  190.27  19.68  1065.92   211.90   1166.42  299.30   964.93    300.03   197.00  27.19  177.83  30.49  19.17   40.85  
1 1 1 1   -4  14 o 7  80.72   10.19  190.72    46.17    201.55   63.83    178.84    66.86    82.36   14.00  77.21   15.62  5.16    20.98  
1 1 1 1   -4  15 o 11 342.44  36.20  3550.49   700.87   3925.35  991.49   3176.09   990.88   352.10  50.50  311.96  57.45  40.14   76.48  
1 1 1 1   -4  16 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   -4  17 f 0  234.09  35.63  1649.17   463.70   0.00     0.00     1649.17   463.70   ?       ?      234.09  35.63  0.00    35.63  
1 1 1 1   -4  18 o 16 203.20  20.99  1207.72   241.31   1295.89  340.98   1119.25   341.54   208.82  29.24  193.15  31.92  15.67   43.29  
1 1 1 1   -4  19 o 3  189.75  29.12  1075.40   307.11   0.00     0.00     1075.40   307.11   ?       ?      189.75  29.12  0.00    29.12  
1 1 1 1   -4  20 o 15 359.72  57.90  4136.72   1155.09  4136.72  1155.09  0.00      0.00     359.72  57.90  ?       ?      0.00    57.90  
1 1 1 1   -4  21 o 4  353.31  57.53  4033.13   1126.83  4033.13  1126.83  0.00      0.00     353.31  57.53  ?       ?      0.00    57.53  
1 1 1 1   -4  22 o 9  427.49  72.54  6152.78   1716.72  6152.78  1716.72  0.00      0.00     427.49  72.54  ?       ?      0.00    72.54  
1 1 1 1   -4  23 o 17 177.96  19.51  930.79    196.04   1003.42  270.80   850.81    284.18   183.13  26.53  167.21  30.74  15.93   40.60  
1 1 1 1   -4  24 o 17 241.37  25.63  1738.98   349.76   1840.01  491.57   1635.39   497.76   243.94  36.20  228.25  39.41  15.69   53.51  
1 1 1 1   -4  25 o 16 83.21   15.84  208.10    72.92    273.53   91.62    95.06     120.43   95.36   17.38  64.39   24.13  30.97   29.73  
1 1 1 1   -4  26 o 6  199.17  21.75  1189.29   244.61   1203.60  342.47   1174.38   349.50   196.04  31.50  192.99  32.71  3.05    45.41  
1 1 1 1   -4  27 f 0  53.44   18.46  77.42     68.85    111.80   85.76    15.11     115.45   62.39   20.61  52.67   22.25  9.71    30.33  
1 1 1 1   -4  28 o 1  181.64  20.53  1000.75   210.29   1209.81  294.16   782.24    300.73   196.45  26.78  152.79  35.03  43.67   44.10  
1 1 1 1   -4  29 o 17 70.99   25.71  138.59    134.85   0.00     0.00     138.59    134.85   ?       ?      70.99   25.71  0.00    25.71  
1 1 1 1   -4  30 o 5  80.71   26.67  204.69    143.62   0.00     0.00     204.69    143.62   ?       ?      80.71   26.67  0.00    26.67  
1 1 1 1   -4  31 o 5  61.85   25.23  69.73     141.44   0.00     0.00     69.73     141.44   ?       ?      61.85   25.23  0.00    25.23  
1 1 1 1   -3  0  o 15 383.11  59.13  4518.72   1258.58  4518.72  1258.58  0.00      0.00     383.11  59.13  ?       ?      0.00    59.13  
1 1 1 1   -3  1  o 11 343.31  35.27  3479.75   685.16   3428.84  968.95   3530.66   968.98   335.48  51.99  340.84  51.09  -5.36   72.90  
1 1 1 1   -3  2  o 14 602.89  64.62  11178.73  2201.71  10783.10 3113.67  11574.37  3113.71  568.01  99.09  592.30  94.77  -24.29  137.11 
1 1 1 1   -3  3  o 3  221.73  22.58  1436.18   283.47   0.32     400.29   2880.51   401.47   95.89   40.99  314.85  22.36  -218.97 46.69  
1 1 1 1   -3  4  o 2  919.88  246.83 47777.77  13304.14 0.00     0.00     47777.77  13304.14 ?       ?      919.88  246.83 0.00    246.83 
1 1 1 1   -3  5  o 2  854.77  185.83 31810.18  8857.99  0.00     0.00     31810.18  8857.99  ?       ?      854.77  185.83 0.00    185.83 
1 1 1 1   -3  6  o 19 738.92  82.02  17364.76  3420.49  18389.08 4837.29  16340.44  4837.31  722.48  120.90 670.29  130.41 52.19   177.83 
1 1 1 1   -3  7  o 16 175.66  17.90  899.21    177.94   981.45   251.56   816.87    251.72   182.44  24.65  165.60  27.44  16.84   36.89  
1 1 1 1   -3  8  o 13 605.86  105.94 12747.96  3550.35  12747.96 3550.35  0.00      0.00     605.86  105.94 ?       ?      0.00    105.94 
1 1 1 1   -3  9  o 9  295.36  45.10  2655.97   740.56   2655.97  740.56   0.00      0.00     295.36  45.10  ?       ?      0.00    45.10  
1 1 1 1   -3  10 o 7  329.87  51.43  3379.53   942.11   3379.53  942.11   0.00      0.00     329.87  51.43  ?       ?      0.00    51.43  
1 1 1 1   -3  11 o 10 246.88  25.42  1799.97   355.09   1855.46  502.14   1744.48   502.20   247.18  36.48  239.05  37.86  8.13    52.57  
1 1 1 1   -3  12 o 11 91.90   10.11  246.16    52.46    280.84   74.05    211.24    74.32    97.69   13.57  84.06   15.99  13.63   20.97  
1 1 1 1   -3  13 o 7  195.50  20.16  1125.51   222.98   1162.04  315.15   1088.89   315.54   196.19  28.84  189.42  30.02  6.77    41.63  
1 1 1 1   -3  14 o 9  134.88  14.11  532.10    107.63   580.26   151.92   483.55    152.52   139.82  19.45  126.89  21.72  12.94   29.16  
1 1 1 1   -3  15 o 3  458.64  87.08  7928.49   2208.98  7928.49  2208.98  0.00      0.00     458.64  87.08  ?       ?      0.00    87.08  
1 1 1 1   -3  16 o 14 228.25  35.11  1589.49   445.30   0.00     0.00     1589.49   445.30   ?       ?      228.25  35.11  0.00    35.11  
1 1 1 1   -3  17 o 15 301.73  31.25  2708.27   533.40   2973.99  754.33   2442.52   754.36   311.55  43.35  279.53  48.78  32.02   65.26  
1 1 1 1   -3  18 o 12 352.08  55.12  3861.97   1077.54  0.00     0.00     3861.97   1077.54  ?       ?      352.08  55.12  0.00    55.12  
1 1 1 1   -3  19 o 19 237.48  36.05  1696.37   476.09   0.00     0.00     1696.37   476.09   ?       ?      237.48  36.05  0.00    36.05  
1 1 1 1   -3  20 o 15 229.70  23.69  1550.89   307.86   1660.59  435.40   1441.20   435.36   235.26  33.16  218.02  36.04  17.24   48.98  
1 1 1 1   -3  21 o 7  382.47  40.73  4461.11   880.64   4459.31  1245.11  4462.92   1245.73  369.88  60.75  370.03  60.75  -0.15   85.91  
1 1 1 1   -3  22 o 4  388.19  64.99  5006.03   1397.20  5006.03  1397.20  0.00      0.00     388.19  64.99  ?       ?      0.00    64.99  
1 1 1 1   -3  23 o 3  182.19  28.97  999.71    292.89   999.71   292.89   0.00      0.00     182.19  28.97  ?       ?      0.00    28.97  
1 1 1 1   -3  24 o 3  104.86  15.55  325.23    90.79    346.18   122.64   299.84    135.04   107.21  20.68  99.18   23.98  8.02    31.67  
1 1 1 1   -3  25 o 2  185.08  20.09  1015.47   210.03   1099.22  295.22   929.65    298.86   190.01  27.90  173.23  31.20  16.78   41.85  
1 1 1 1   -3  26 o 3  112.78  15.94  378.21    100.30   385.81   139.51   370.08    144.31   112.24  22.44  109.57  23.64  2.66    32.59  
1 1 1 1   -3  27 o 18 209.86  22.96  1332.85   272.16   1380.27  384.26   1285.11   385.52   208.05  33.30  199.66  34.91  8.39    48.24  
1 1 1 1   -3  28 o 10 88.13   17.70  237.80    86.43    245.69   117.90   228.63    127.08   88.47   23.00  85.42   24.59  3.05    33.67  
1 1 1 1   -3  29 o 10 142.06  26.97  646.95    211.93   0.00     0.00     646.95    211.93   ?       ?      142.06  26.97  0.00    26.97  
1 1 1 1   -3  30 o 2  88.33   18.85  243.50    92.67    311.27   127.84   168.45    134.53   98.62   23.00  74.91   25.81  23.71   34.58  
1 1 1 1   -3  31 f 0  93.57   25.61  290.27    141.51   0.00     0.00     290.27    141.51   ?       ?      93.57   25.61  0.00    25.61  
1 1 1 1   -2  0  o 7  352.13  36.22  3664.85   721.69   3622.78  1020.62  3706.92   1020.63  344.48  53.33  348.80  52.61  -4.32   74.91  
1 1 1 1   -2  1  o 3  572.41  60.95  10017.76  1972.15  9687.70  2789.03  10347.83  2789.06  542.11  92.96  563.38  89.20  -21.27  128.84 
1 1 1 1   -2  2  o 18 253.77  26.25  1886.72   376.91   -0.15    532.69   3778.40   533.37   110.10  47.18  360.11  25.98  -250.00 53.86  
1 1 1 1   -2  3  o 16 226.43  23.71  1499.74   303.61   0.93     428.97   3004.26   429.78   99.20   42.42  321.38  23.46  -222.18 48.47  
1 1 1 1   -2  4  o 6  241.40  24.57  1704.59   335.75   1760.41  474.79   1648.75   474.87   243.10  35.03  234.78  36.41  8.32    50.53  
1 1 1 1   -2  5  o 6  336.13  34.53  3332.83   656.91   3148.24  928.96   3517.46   929.06   321.17  52.17  341.03  48.85  -19.86  71.47  
1 1 1 1   -2  6  o 14 549.52  90.25  9868.08   2748.34  0.00     0.00     9868.08   2748.34  ?       ?      549.52  90.25  0.00    90.25  
1 1 1 1   -2  7  o 10 662.24  116.34 15302.81  4261.71  0.00     0.00     15302.81  4261.71  ?       ?      662.24  116.34 0.00    116.34 
1 1 1 1   -2  8  o 14 500.50  52.73  7578.86   1492.36  7397.63  2110.50  7760.09   2110.54  479.64  79.43  492.93  77.11  -13.28  110.70 
1 1 1 1   -2  9  o 12 768.02  88.25  19401.13  3820.25  19346.62 5402.60  19455.64  5402.69  707.19  138.03 709.90  137.54 -2.71   194.86 
1 1 1 1   -2  10 o 10 212.07  31.83  1344.84   375.61   1344.84  375.61   0.00      0.00     212.07  31.83  ?       ?      0.00    31.83  
1 1 1 1   -2  11 o 17 80.12   12.90  189.63    57.32    189.63   57.32    0.00      0.00     80.12   12.90  ?       ?      0.00    12.90  
1 1 1 1   -2  12 f 0  276.74  43.02  2370.50   661.23   2370.50  661.23   0.00      0.00     276.74  43.02  ?       ?      0.00    43.02  
1 1 1 1   -2  13 o 10 297.42  47.28  2797.86   780.30   0.00     0.00     2797.86   780.30   ?       ?      297.42  47.28  0.00    47.28  
1 1 1 1   -2  14 o 18 161.73  16.73  767.29    153.12   843.58   216.55   691.02    216.53   168.15  23.04  151.13  25.89  17.02   34.66  
1 1 1 1   -2  15 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   -2  16 o 10 255.18  26.56  1939.62   383.40   2031.96  542.25   1847.31   542.18   256.63  37.95  243.47  40.19  13.15   55.28  
1 1 1 1   -2  17 o 8  483.18  53.37  7388.77   1455.68  7728.30  2058.68  7049.26   2058.61  470.06  79.10  443.67  83.90  26.39   115.31 
1 1 1 1   -2  18 f 0  163.86  16.98  784.36    157.41   882.59   222.68   686.26    222.53   172.74  23.03  151.17  26.61  21.57   35.19  
1 1 1 1   -2  19 o 18 533.60  92.46  9797.93   2729.81  9797.93  2729.81  0.00      0.00     533.60  92.46  ?       ?      0.00    92.46  
1 1 1 1   -2  20 o 19 194.15  29.48  1126.48   318.26   0.00     0.00     1126.48   318.26   ?       ?      194.15  29.48  0.00    29.48  
1 1 1 1   -2  21 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   -2  22 o 16 213.05  33.11  1381.01   391.80   1381.01  391.80   0.00      0.00     213.05  33.11  ?       ?      0.00    33.11  
1 1 1 1   -2  23 o 9  379.27  40.39  4390.87   865.93   4542.28  1224.24  4239.28   1224.97  373.95  58.98  359.19  61.62  14.76   85.30  
1 1 1 1   -2  24 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   -2  25 f 0  117.66  22.55  419.82    146.75   419.82   146.75   0.00      0.00     117.66  22.55  ?       ?      0.00    22.55  
1 1 1 1   -2  26 o 19 146.45  25.61  657.98    207.45   657.98   207.45   0.00      0.00     146.45  25.61  ?       ?      0.00    25.61  
1 1 1 1   -2  27 o 9  105.24  16.28  331.64    95.20    351.06   131.01   309.91    138.57   106.75  22.11  99.70   24.41  7.05    32.93  
1 1 1 1   -2  28 o 6  53.28   18.93  74.38     72.68    119.05   97.93    19.59     108.45   64.78   22.03  51.64   21.67  13.14   30.90  
1 1 1 1   -2  29 o 19 68.08   23.20  134.53    108.59   134.53   108.59   0.00      0.00     68.08   23.20  ?       ?      0.00    23.20  
1 1 1 1   -2  30 o 7  154.91  28.75  787.24    246.26   0.00     0.00     787.24    246.26   ?       ?      154.91  28.75  0.00    28.75  
1 1 1 1   -2  31 o 19 116.94  17.80  421.75    115.76   439.53   166.39   405.07    161.14   115.43  25.76  110.67  25.83  4.76    36.49  
1 1 1 1   -2  32 o 2  215.80  25.71  1530.78   312.30   1612.32  442.02   1449.49   441.30   206.29  38.75  192.07  41.25  14.21   56.60  
1 1 1 1   -1  0  o 12 374.53  38.65  4157.00   819.06   4368.24  1158.33  3945.76   1158.32  378.25  54.95  357.80  58.41  20.45   80.19  
1 1 1 1   -1  1  o 14 288.38  29.40  2441.90   479.84   1861.43  678.55   3022.56   678.66   246.09  49.74  319.03  37.79  -72.94  62.47  
1 1 1 1   -1  2  o 6  198.33  19.98  1147.07   224.44   -0.05    317.06   2299.16   317.75   85.53   36.52  281.52  19.79  -195.99 41.54  
1 1 1 1   -1  3  o 1  158.04  15.90  726.81    142.27   -27.42   200.90   1485.55   201.50   66.10   28.66  226.56  15.59  -160.45 32.62  
1 1 1 1   -1  4  o 16 585.21  62.57  10499.08  2069.37  11358.75 2926.52  9639.41   2926.53  590.84  89.04  536.55  98.65  54.29   132.89 
1 1 1 1   -1  5  o 7  652.48  70.78  13248.17  2608.63  13223.65 3689.15  13272.70  3689.16  622.92  107.02 624.32  106.77 -1.40   151.17 
1 1 1 1   -1  6  o 12 485.50  50.88  7093.68   1397.06  7129.16  1975.74  7058.21   1975.76  474.51  75.02  471.84  75.49  2.67    106.43 
1 1 1 1   -1  7  o 1  524.01  55.32  8319.93   1639.15  8623.65  2318.11  8016.20   2318.10  519.28  80.36  498.00  84.07  21.28   116.30 
1 1 1 1   -1  8  o 9  119.19  17.77  418.57    117.89   0.00     0.00     418.57    117.89   ?       ?      119.19  17.77  0.00    17.77  
1 1 1 1   -1  9  o 17 345.21  53.03  3650.94   1017.29  0.00     0.00     3650.94   1017.29  ?       ?      345.21  53.03  0.00    53.03  
1 1 1 1   -1  10 o 11 356.49  36.92  3778.29   744.55   4036.03  1052.99  3520.58   1052.93  362.70  52.06  336.43  56.52  26.27   76.84  
1 1 1 1   -1  11 o 8  229.34  23.47  1543.66   304.68   1532.73  430.87   1554.59   430.89   225.77  34.32  227.48  34.04  -1.72   48.34  
1 1 1 1   -1  12 o 8  263.66  40.50  2127.63   593.41   2127.63  593.41   0.00      0.00     263.66  40.50  ?       ?      0.00    40.50  
1 1 1 1   -1  13 o 11 258.04  40.02  2055.81   573.62   2055.81  573.62   0.00      0.00     258.04  40.02  ?       ?      0.00    40.02  
1 1 1 1   -1  14 o 6  86.10   13.93  219.79    66.50    219.79   66.50    0.00      0.00     86.10   13.93  ?       ?      0.00    13.93  
1 1 1 1   -1  15 o 17 366.62  63.15  4596.48   1281.07  0.00     0.00     4596.48   1281.07  ?       ?      366.62  63.15  0.00    63.15  
1 1 1 1   -1  16 o 1  198.72  20.56  1165.73   231.15   1149.15  326.68   1182.34   327.10   194.25  30.28  197.25  29.82  -3.01   42.50  
1 1 1 1   -1  17 o 13 495.55  55.97  7939.93   1564.48  7882.97  2212.47  7996.89   2212.54  460.21  86.93  464.56  86.13  -4.36   122.38 
1 1 1 1   -1  18 f 0  141.69  14.75  586.13    118.20   610.84   166.82   561.21    167.49   143.52  20.86  137.20  22.01  6.32    30.32  
1 1 1 1   -1  19 o 4  131.95  13.79  507.38    102.94   583.75   145.18   430.16    145.98   140.89  18.39  119.91  22.02  20.98   28.69  
1 1 1 1   -1  20 o 2  323.19  33.38  3102.97   610.37   3371.42  863.38   2834.74   863.02   331.99  46.58  301.84  51.66  30.15   69.56  
1 1 1 1   -1  21 o 14 301.41  47.07  2815.89   787.84   0.00     0.00     2815.89   787.84   ?       ?      301.41  47.07  0.00    47.07  
1 1 1 1   -1  22 o 11 345.11  56.42  3863.90   1079.12  0.00     0.00     3863.90   1079.12  ?       ?      345.11  56.42  0.00    56.42  
1 1 1 1   -1  23 o 15 226.99  23.80  1524.70   305.52   1617.68  432.97   1432.49   431.18   230.58  33.71  215.86  36.07  14.72   49.37  
1 1 1 1   -1  24 o 16 484.32  53.93  7475.09   1474.15  7515.48  2084.88  7434.72   2084.64  457.70  82.38  454.57  82.94  3.13    116.90 
1 1 1 1   -1  25 o 14 222.06  35.38  1523.96   435.96   1523.96  435.96   0.00      0.00     222.06  35.38  ?       ?      0.00    35.38  
1 1 1 1   -1  26 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   -1  27 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   -1  28 o 8  186.08  20.62  1045.61   216.55   1129.15  307.41   963.33    305.11   188.99  29.28  172.83  31.93  16.16   43.32  
1 1 1 1   -1  29 o 17 214.23  23.91  1422.59   289.09   1505.56  410.20   1340.71   407.49   212.21  34.88  198.17  37.19  14.04   50.99  
1 1 1 1   -1  30 o 14 53.28   22.22  30.59     112.99   30.59    112.99   0.00      0.00     53.28   22.22  ?       ?      0.00    22.22  
1 1 1 1   -1  31 o 5  101.52  26.33  342.87    154.70   342.87   154.70   0.00      0.00     101.52  26.33  ?       ?      0.00    26.33  
1 1 1 1   -1  32 o 6  146.65  28.98  740.86    235.32   0.00     0.00     740.86    235.32   ?       ?      146.65  28.98  0.00    28.98  
1 1 1 1   0   0  o 17 166.82  24.68  823.01    229.26   823.01   229.26   0.00      0.00     166.82  24.68  ?       ?      0.00    24.68  
1 1 1 1   0   1  f 0  404.81  41.20  4868.86   944.00   -0.09    1334.88  9739.87   1335.16  169.90  73.76  574.06  40.78  -404.16 84.28  
1 1 1 1   0   2  o 4  177.55  18.04  918.46    181.37   0.20     256.30   1839.45   256.68   77.07   32.87  251.92  17.86  -174.86 37.41  
1 1 1 1   0   3  o 18 667.69  72.75  13932.75  2743.33  14075.95 3879.65  13789.56  3879.65  640.48  109.45 632.48  110.89 8.01    155.81 
1 1 1 1   0   4  o 8  431.83  44.90  5568.00   1096.86  5827.80  1551.20  5308.20   1551.18  433.55  64.27  411.64  68.02  21.91   93.58  
1 1 1 1   0   5  o 5  500.44  52.59  7558.54   1488.42  7488.26  2104.93  7628.81   2104.94  484.38  78.37  489.53  77.48  -5.14   110.21 
1 1 1 1   0   6  o 12 239.65  35.84  1714.94   477.88   1714.94  477.88   0.00      0.00     239.65  35.84  ?       ?      0.00    35.84  
1 1 1 1   0   7  x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   0   8  o 6  166.42  16.93  806.57    159.50   859.03   225.63   754.18    225.50   170.69  23.66  159.38  25.51  11.31   34.79  
1 1 1 1   0   9  o 9  474.37  76.15  7193.57   2003.53  0.00     0.00     7193.57   2003.53  ?       ?      474.37  76.15  0.00    76.15  
1 1 1 1   0   10 o 9  359.51  55.74  3995.48   1113.17  0.00     0.00     3995.48   1113.17  ?       ?      359.51  55.74  0.00    55.74  
1 1 1 1   0   11 o 9  75.46   8.34   165.67    35.53    183.59   50.41    147.99    50.07    79.05   11.44  70.60   12.83  8.46    17.19  
1 1 1 1   0   12 o 11 212.12  21.72  1320.69   260.79   1305.32  368.74   1336.07   368.89   208.30  31.85  210.91  31.43  -2.61   44.74  
1 1 1 1   0   13 o 18 159.42  24.02  759.16    213.03   759.16   213.03   0.00      0.00     159.42  24.02  ?       ?      0.00    24.02  
1 1 1 1   0   14 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   0   15 o 11 135.54  14.05  537.52    107.75   569.09   152.30   505.87    152.48   138.30  19.74  129.89  21.18  8.40    28.95  
1 1 1 1   0   16 o 16 294.79  31.09  2628.12   518.19   2703.76  732.84   2552.49   732.83   291.19  45.31  281.78  46.95  9.41    65.25  
1 1 1 1   0   17 o 10 73.76   9.18   159.08    38.01    161.85   53.84    156.32    53.68    73.74   13.20  72.40   13.41  1.34    18.82  
1 1 1 1   0   18 o 4  207.17  21.34  1263.33   250.17   1326.27  353.88   1200.44   353.72   209.81  30.25  198.84  32.08  10.96   44.10  
1 1 1 1   0   19 o 18 328.90  34.18  3229.34   635.90   3461.79  899.45   2997.04   899.15   334.62  48.21  308.90  52.59  25.72   71.34  
1 1 1 1   0   20 o 17 314.01  32.40  2927.05   575.63   3236.87  814.31   2617.60   813.82   325.77  44.72  289.97  50.74  35.80   67.63  
1 1 1 1   0   21 f 0  325.61  33.92  3164.08   624.69   3176.88  883.42   3151.27   883.47   319.56  49.78  318.12  50.03  1.43    70.57  
1 1 1 1   0   22 o 1  504.25  56.14  8149.60   1597.70  8840.03  2259.78  7459.53   2259.20  498.43  81.81  446.74  91.18  51.69   122.51 
1 1 1 1   0   23 o 18 521.54  112.80 11767.80  3278.90  0.00     0.00     11767.80  3278.90  ?       ?      521.54  112.80 0.00    112.80 
1 1 1 1   0   24 o 19 166.92  26.83  839.38    248.40   0.00     0.00     839.38    248.40   ?       ?      166.92  26.83  0.00    26.83  
1 1 1 1   0   25 o 19 150.00  16.77  661.22    141.94   793.24   203.15   535.29    198.42   163.16  22.27  132.32  27.04  30.84   35.03  
1 1 1 1   0   26 o 9  92.20   16.24  254.82    82.83    283.55   113.78   222.42    120.81   96.33   21.16  85.31   23.78  11.02   31.83  
1 1 1 1   0   27 o 18 253.87  43.15  2147.83   606.42   2147.83  606.42   0.00      0.00     253.87  43.15  ?       ?      0.00    43.15  
1 1 1 1   0   28 o 1  135.53  24.49  571.62    183.52   571.62   183.52   0.00      0.00     135.53  24.49  ?       ?      0.00    24.49  
1 1 1 1   0   29 o 8  58.73   21.15  91.09     91.07    0.00     0.00     91.09     91.07    ?       ?      58.73   21.15  0.00    21.15  
1 1 1 1   0   30 o 12 161.88  18.87  800.25    172.11   881.76   245.86   721.91    241.02   165.31  26.83  147.61  29.47  17.70   39.85  
1 1 1 1   0   31 o 11 139.21  27.59  644.76    212.72   644.76   212.72   0.00      0.00     139.21  27.59  ?       ?      0.00    27.59  
1 1 1 1   0   32 o 8  158.74  19.46  790.35    173.60   846.43   249.28   737.53    241.91   157.07  28.70  145.28  30.00  11.80   41.52  
1 1 1 1   1   0  o 12 112.22  11.35  365.87    72.12    359.89   101.97   371.85    102.00   110.54  16.58  112.45  16.27  -1.91   23.23  
1 1 1 1   1   1  o 5  234.20  23.44  1602.82   310.88   0.00     439.50   3207.82   439.80   100.30  42.92  332.17  23.21  -231.87 48.79  
1 1 1 1   1   2  o 3  195.11  19.56  1109.81   216.14   -6.83    305.50   2229.00   305.85   83.53   35.76  277.23  19.34  -193.70 40.66  
1 1 1 1   1   3  o 17 607.62  65.25  11379.24  2240.29  11151.91 3168.24  11606.58  3168.25  577.13  99.20  591.00  96.73  -13.86  138.55 
1 1 1 1   1   4  o 7  339.53  34.90  3403.24   670.63   3527.67  948.41   3278.81   948.40   341.03  49.92  327.77  52.15  13.26   72.19  
1 1 1 1   1   5  o 4  593.37  63.56  10823.01  2131.24  10643.00 3014.03  11003.02  3014.04  565.65  96.26  576.87  94.27  -11.22  134.73 
1 1 1 1   1   6  o 1  541.60  57.38  8924.44   1756.87  8841.78  2484.59  9007.11   2484.60  521.78  85.94  527.40  84.95  -5.62   120.84 
1 1 1 1   1   7  o 10 427.94  44.48  5468.48   1076.90  5456.76  1522.96  5480.20   1522.98  418.42  65.56  419.41  65.39  -1.00   92.59  
1 1 1 1   1   8  o 3  270.83  27.63  2151.42   423.59   2282.06  599.07   2020.80   599.04   276.26  38.85  258.87  41.73  17.39   57.01  
1 1 1 1   1   9  o 12 413.90  43.00  5115.80   1006.82  5326.04  1423.87  4905.57   1423.83  414.30  61.75  395.80  64.91  18.50   89.59  
1 1 1 1   1   10 o 3  487.23  79.80  7737.49   2154.95  0.00     0.00     7737.49   2154.95  ?       ?      487.23  79.80  0.00    79.80  
1 1 1 1   1   11 f 0  307.89  47.35  2907.07   810.12   0.00     0.00     2907.07   810.12   ?       ?      307.89  47.35  0.00    47.35  
1 1 1 1   1   12 o 2  369.89  38.81  4120.69   811.77   4137.54  1148.00  4103.85   1148.04  361.18  57.28  359.51  57.57  1.67    81.21  
1 1 1 1   1   13 o 12 180.80  27.29  981.51    274.48   981.51   274.48   0.00      0.00     180.80  27.29  ?       ?      0.00    27.29  
1 1 1 1   1   14 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   1   15 o 9  185.10  28.27  1039.43   290.87   1039.43  290.87   0.00      0.00     185.10  28.27  ?       ?      0.00    28.27  
1 1 1 1   1   16 o 12 163.00  24.79  800.63    224.71   800.63   224.71   0.00      0.00     163.00  24.79  ?       ?      0.00    24.79  
1 1 1 1   1   17 o 13 65.41   8.44   125.22    30.94    135.95   42.82    113.50    44.76    67.72   11.42  61.51   13.08  6.21    17.36  
1 1 1 1   1   18 o 15 175.54  18.07  904.09    179.53   959.00   253.68   849.00    254.12   179.05  25.39  167.74  27.33  11.31   37.31  
1 1 1 1   1   19 o 9  473.28  51.37  6964.90   1373.33  6801.00  1942.14  7128.80   1942.21  446.08  78.72  458.97  76.40  -12.89  109.70 
1 1 1 1   1   20 o 2  424.58  45.05  5478.27   1081.28  5323.44  1528.97  5633.18   1529.34  404.77  68.22  418.17  65.89  -13.40  94.84  
1 1 1 1   1   21 o 12 283.18  29.28  2376.25   469.10   2431.72  663.78   2320.92   663.04   281.90  42.32  274.83  43.47  7.07    60.67  
1 1 1 1   1   22 o 5  279.37  43.92  2433.68   681.19   2433.68  681.19   0.00      0.00     279.37  43.92  ?       ?      0.00    43.92  
1 1 1 1   1   23 o 1  310.29  32.63  2911.03   572.47   3118.32  810.54   2704.70   808.65   313.59  46.43  289.23  50.54  24.36   68.63  
1 1 1 1   1   24 o 3  239.19  37.34  1763.30   495.93   0.00     0.00     1763.30   495.93   ?       ?      239.19  37.34  0.00    37.34  
1 1 1 1   1   25 o 18 169.16  26.66  864.22    250.34   0.00     0.00     864.22    250.34   ?       ?      169.16  26.66  0.00    26.66  
1 1 1 1   1   26 o 7  333.25  36.36  3466.39   684.23   3547.49  968.69   3385.63   966.60   322.36  54.27  313.44  55.76  8.92    77.81  
1 1 1 1   1   27 o 10 55.70   18.86  85.83     71.73    46.24    101.35   125.56    101.54   53.94   21.59  66.62   22.43  -12.68  31.13  
1 1 1 1   1   28 o 11 79.57   23.93  194.80    118.18   194.80   118.18   0.00      0.00     79.57   23.93  ?       ?      0.00    23.93  
1 1 1 1   1   29 o 17 244.52  46.07  2192.40   622.95   2192.40  622.95   0.00      0.00     244.52  46.07  ?       ?      0.00    46.07  
1 1 1 1   1   30 o 7  89.20   18.91  248.66    93.80    226.72   136.59   268.24    129.04   84.02   25.82  91.07   24.25  -7.05   35.43  
1 1 1 1   1   31 o 15 101.30  18.35  320.25    102.76   451.17   152.21   210.57    139.31   118.17  23.27  80.74   26.24  37.44   35.07  
1 1 1 1   1   32 o 2  80.14   20.20  208.07    92.91    184.27   145.38   224.50    120.79   75.96   26.79  82.10   24.07  -6.14   36.02  
1 1 1 1   1   33 o 17 118.96  25.68  487.15    170.24   0.00     0.00     487.15    170.24   ?       ?      118.96  25.68  0.00    25.68  
1 1 1 1   2   0  o 7  229.77  23.86  1544.26   310.18   -3.39    438.48   3094.58   438.85   100.01  42.83  326.16  23.60  -226.16 48.90  
1 1 1 1   2   1  o 12 351.15  36.08  3643.84   717.06   0.17     1013.88  7290.19   1014.26  149.59  64.61  498.02  35.71  -348.43 73.82  
1 1 1 1   2   2  o 9  211.51  21.47  1306.00   257.09   1270.76  363.57   1341.25   363.60   206.59  31.66  212.58  30.68  -5.99   44.09  
1 1 1 1   2   3  o 11 605.93  65.07  11314.58  2228.11  11428.64 3151.03  11200.51  3151.03  585.99  97.07  579.01  98.31  6.97    138.15 
1 1 1 1   2   4  o 15 318.92  32.66  2996.11   589.49   2909.89  833.66   3082.33   833.68   309.60  48.50  319.37  46.87  -9.77   67.44  
1 1 1 1   2   5  o 1  194.89  19.79  1107.86   218.36   1114.26  308.81   1101.45   308.82   193.82  28.61  192.64  28.81  1.18    40.60  
1 1 1 1   2   6  o 7  369.02  38.06  4035.16   794.64   4018.04  1123.79  4052.29   1123.80  361.94  55.88  363.62  55.60  -1.68   78.83  
1 1 1 1   2   7  o 19 630.30  68.28  12337.84  2431.20  12611.76 3438.24  12063.93  3438.24  611.18  101.56 595.02  104.47 16.17   145.70 
1 1 1 1   2   8  o 10 124.22  12.63  448.60    88.81    460.04   125.59   437.16    125.59   125.02  18.02  121.72  18.56  3.30    25.87  
1 1 1 1   2   9  o 3  310.75  31.90  2847.72   561.03   2878.36  793.41   2817.08   793.41   308.05  46.30  304.49  46.89  3.56    65.90  
1 1 1 1   2   10 o 1  203.98  30.49  1240.62   346.03   0.00     0.00     1240.62   346.03   ?       ?      203.98  30.49  0.00    30.49  
1 1 1 1   2   11 o 15 312.12  48.17  2997.81   835.29   0.00     0.00     2997.81   835.29   ?       ?      312.12  48.17  0.00    48.17  
1 1 1 1   2   12 o 16 212.58  21.74  1326.97   261.52   1233.47  369.75   1420.58   369.95   201.93  33.04  217.80  30.42  -15.87  44.91  
1 1 1 1   2   13 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   2   14 o 3  115.05  11.88  386.13    77.31    393.38   109.24   378.85    109.41   115.18  17.03  112.91  17.44  2.27    24.38  
1 1 1 1   2   15 o 11 208.06  32.07  1327.56   370.73   1327.56  370.73   0.00      0.00     208.06  32.07  ?       ?      0.00    32.07  
1 1 1 1   2   16 o 2  107.17  16.35  341.20    97.38    341.20   97.38    0.00      0.00     107.17  16.35  ?       ?      0.00    16.35  
1 1 1 1   2   17 o 14 253.17  26.43  1915.97   378.52   1875.11  535.17   1956.88   535.44   244.73  39.43  250.60  38.44  -5.87   55.07  
1 1 1 1   2   18 o 8  189.87  19.47  1060.12   209.24   1155.43  295.83   964.70    296.01   196.28  26.97  178.13  30.01  18.15   40.35  
1 1 1 1   2   19 o 1  226.46  23.20  1510.03   297.31   1632.76  420.51   1387.35   420.42   232.96  32.31  213.38  35.57  19.58   48.06  
1 1 1 1   2   20 o 7  356.77  37.36  3818.34   753.91   3759.12  1066.33  3877.54   1066.06  345.31  55.69  351.38  54.62  -6.07   78.00  
1 1 1 1   2   21 o 4  344.04  35.95  3549.05   699.61   3624.91  989.61   3473.25   989.19   340.00  52.38  331.97  53.74  8.03    75.05  
1 1 1 1   2   22 o 11 202.72  21.02  1210.13   241.08   1321.46  341.13   1099.06   340.74   209.64  29.13  189.82  32.43  19.82   43.59  
1 1 1 1   2   23 o 17 314.99  33.37  3011.34   594.23   3100.63  840.68   2922.19   840.06   310.68  48.74  300.30  50.52  10.38   70.20  
1 1 1 1   2   24 o 16 248.27  26.20  1836.30   367.84   1821.13  521.46   1851.33   518.95   242.18  38.82  244.49  38.23  -2.31   54.48  
1 1 1 1   2   25 o 15 318.44  52.54  3309.73   926.99   0.00     0.00     3309.73   926.99   ?       ?      318.44  52.54  0.00    52.54  
1 1 1 1   2   26 o 8  317.09  55.17  3461.61   967.81   0.00     0.00     3461.61   967.81   ?       ?      317.09  55.17  0.00    55.17  
1 1 1 1   2   27 o 3  277.79  30.24  2401.11   474.53   2518.51  673.93   2285.66   668.28   273.08  44.52  257.90  46.86  15.19   64.64  
1 1 1 1   2   28 o 15 218.09  24.14  1458.69   297.13   1455.01  422.61   1462.28   417.85   209.78  36.41  210.75  35.82  -0.97   51.08  
1 1 1 1   2   29 o 10 117.31  26.11  443.48    171.30   443.48   171.30   0.00      0.00     117.31  26.11  ?       ?      0.00    26.11  
1 1 1 1   2   30 o 1  196.49  37.30  1370.39   405.29   1370.39  405.29   0.00      0.00     196.49  37.30  ?       ?      0.00    37.30  
1 1 1 1   2   31 o 14 98.43   27.28  327.88    159.47   327.88   159.47   0.00      0.00     98.43   27.28  ?       ?      0.00    27.28  
1 1 1 1   2   32 o 3  75.02   21.63  184.11    98.27    80.34    151.00   260.36    129.44   63.24   25.97  87.77   24.67  -24.54  35.82  
1 1 1 1   2   33 o 12 82.65   21.78  229.21    104.77   219.69   164.24   235.74    136.05   79.82   28.44  82.30   25.85  -2.48   38.44  
1 1 1 1   3   0  o 15 165.40  17.02  796.88    159.31   0.56     225.01   1597.24   225.58   72.32   30.82  234.80  16.85  -162.49 35.12  
1 1 1 1   3   1  o 14 270.89  28.22  2153.57   432.44   -10.78   611.30   4321.54   611.81   117.15  50.38  384.81  27.88  -267.67 57.58  
1 1 1 1   3   2  o 17 187.66  19.05  1026.65   202.35   958.41   286.15   1094.91   286.20   179.46  28.75  192.53  26.61  -13.07  39.17  
1 1 1 1   3   3  o 17 159.36  16.17  739.26    145.84   770.85   206.25   707.66    206.26   161.68  22.86  154.56  24.03  7.12    33.16  
1 1 1 1   3   4  o 13 472.91  49.53  6723.65   1324.64  6803.72  1873.32  6643.57   1873.33  464.27  72.67  458.08  73.74  6.19    103.53 
1 1 1 1   3   5  o 1  164.67  16.71  789.55    155.73   799.20   220.22   779.90    220.26   164.45  24.04  162.34  24.39  2.10    34.24  
1 1 1 1   3   6  o 5  80.04   8.19   186.00    37.09    178.83   52.40    193.20    52.50    77.93   12.10  81.14   11.60  -3.21   16.77  
1 1 1 1   3   7  o 8  610.23  65.85  11521.04  2270.47  11721.12 3210.92  11320.96  3210.93  591.33  98.02  579.15  100.20 12.17   140.17 
1 1 1 1   3   8  o 1  319.69  32.82  3015.48   593.87   3002.32  839.84   3028.65   839.86   314.26  48.08  315.75  47.83  -1.49   67.82  
1 1 1 1   3   9  o 14 272.14  41.16  2235.65   622.96   0.00     0.00     2235.65   622.96   ?       ?      272.14  41.16  0.00    41.16  
1 1 1 1   3   10 o 8  335.35  51.93  3472.83   967.48   0.00     0.00     3472.83   967.48   ?       ?      335.35  51.93  0.00    51.93  
1 1 1 1   3   11 o 4  158.90  23.71  750.07    209.71   0.00     0.00     750.07    209.71   ?       ?      158.90  23.71  0.00    23.71  
1 1 1 1   3   12 o 9  279.54  43.34  2414.65   672.94   2414.65  672.94   0.00      0.00     279.54  43.34  ?       ?      0.00    43.34  
1 1 1 1   3   13 o 14 247.05  38.26  1883.13   525.13   0.00     0.00     1883.13   525.13   ?       ?      247.05  38.26  0.00    38.26  
1 1 1 1   3   14 o 18 148.25  15.22  643.78    127.68   649.66   180.54   637.89    180.59   147.36  22.02  145.93  22.26  1.43    31.31  
1 1 1 1   3   15 o 10 222.16  34.55  1527.69   426.36   1527.69  426.36   0.00      0.00     222.16  34.55  ?       ?      0.00    34.55  
1 1 1 1   3   16 o 16 164.36  25.01  815.78    228.54   815.78   228.54   0.00      0.00     164.36  25.01  ?       ?      0.00    25.01  
1 1 1 1   3   17 o 12 115.44  17.59  396.35    112.87   396.35   112.87   0.00      0.00     115.44  17.59  ?       ?      0.00    17.59  
1 1 1 1   3   18 o 15 371.26  39.73  4231.24   833.69   4306.05  1179.02  4156.42   1179.02  361.43  58.85  353.98  60.17  7.45    84.16  
1 1 1 1   3   19 o 13 274.85  28.50  2242.11   443.12   2122.31  626.24   2362.23   627.09   261.94  43.15  277.75  40.52  -15.81  59.19  
1 1 1 1   3   20 o 13 509.26  55.56  8110.43   1597.91  8122.42  2259.79  8098.45   2259.79  485.71  84.09  484.83  84.25  0.88    119.03 
1 1 1 1   3   21 o 3  148.77  15.77  646.74    132.60   666.31   187.54   627.17    187.52   149.70  22.52  144.97  23.32  4.73    32.42  
1 1 1 1   3   22 o 12 286.51  45.48  2585.06   723.06   2585.06  723.06   0.00      0.00     286.51  45.48  ?       ?      0.00    45.48  
1 1 1 1   3   23 o 2  241.78  25.39  1743.37   347.15   1737.90  491.02   1748.84   490.86   236.42  37.42  237.25  37.27  -0.83   52.81  
1 1 1 1   3   24 o 17 141.37  23.19  600.79    181.65   0.00     0.00     600.79    181.65   ?       ?      141.37  23.19  0.00    23.19  
1 1 1 1   3   25 o 10 329.89  35.46  3332.65   661.06   3268.22  935.94   3396.79   933.82   314.64  53.75  321.94  52.32  -7.30   75.01  
1 1 1 1   3   26 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   3   27 o 3  205.37  34.06  1355.51   387.55   0.00     0.00     1355.51   387.55   ?       ?      205.37  34.06  0.00    34.06  
1 1 1 1   3   28 f 0  139.58  17.18  584.37    134.78   575.30   196.41   592.43    185.30   134.83  26.32  137.76  24.32  -2.92   35.84  
1 1 1 1   3   29 o 8  203.19  23.70  1287.83   271.30   1102.52  385.72   1469.26   381.67   176.28  39.14  210.14  32.70  -33.86  51.00  
1 1 1 1   3   30 o 2  71.55   25.07  152.57    127.13   152.57   127.13   0.00      0.00     71.55   25.07  ?       ?      0.00    25.07  
1 1 1 1   3   31 o 9  194.08  39.07  1426.09   420.28   1426.09  420.28   0.00      0.00     194.08  39.07  ?       ?      0.00    39.07  
1 1 1 1   3   32 o 13 46.27   18.92  33.98     79.76    51.08    133.99   24.59     99.26    57.59   24.12  48.82   20.62  8.77    31.74  
1 1 1 1   3   33 o 8  83.57   20.02  231.26    94.78    223.30   158.76   235.66    118.14   79.73   28.01  82.64   23.68  -2.91   36.68  
1 1 1 1   4   0  o 6  490.80  78.54  7678.52   2138.38  0.00     0.00     7678.52   2138.38  ?       ?      490.80  78.54  0.00    78.54  
1 1 1 1   4   1  o 14 215.69  32.13  1384.11   385.77   0.00     0.00     1384.11   385.77   ?       ?      215.69  32.13  0.00    32.13  
1 1 1 1   4   2  o 3  236.65  35.37  1671.50   465.77   0.00     0.00     1671.50   465.77   ?       ?      236.65  35.37  0.00    35.37  
1 1 1 1   4   3  o 18 544.32  89.53  9696.73   2700.31  0.00     0.00     9696.73   2700.31  ?       ?      544.32  89.53  0.00    89.53  
1 1 1 1   4   4  o 9  551.41  91.16  10000.13  2784.80  0.00     0.00     10000.13  2784.80  ?       ?      551.41  91.16  0.00    91.16  
1 1 1 1   4   5  o 8  530.02  86.81  9156.94   2550.03  0.00     0.00     9156.94   2550.03  ?       ?      530.02  86.81  0.00    86.81  
1 1 1 1   4   6  o 10 169.54  25.15  850.81    237.37   0.00     0.00     850.81    237.37   ?       ?      169.54  25.15  0.00    25.15  
1 1 1 1   4   7  f 0  367.41  56.81  4162.93   1159.54  0.00     0.00     4162.93   1159.54  ?       ?      367.41  56.81  0.00    56.81  
1 1 1 1   4   8  o 13 468.07  75.84  7067.31   1968.27  0.00     0.00     7067.31   1968.27  ?       ?      468.07  75.84  0.00    75.84  
1 1 1 1   4   9  o 14 244.81  36.92  1803.73   502.76   0.00     0.00     1803.73   502.76   ?       ?      244.81  36.92  0.00    36.92  
1 1 1 1   4   10 o 16 135.61  20.19  544.15    152.38   0.00     0.00     544.15    152.38   ?       ?      135.61  20.19  0.00    20.19  
1 1 1 1   4   11 o 5  162.70  16.59  773.40    152.77   767.44   216.01   779.38    216.08   160.50  24.20  161.82  23.99  -1.32   34.07  
1 1 1 1   4   12 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   4   13 o 12 56.78   6.62   93.95     21.18    98.20    29.67    89.53     30.26    57.67   9.28   54.90   9.97   2.77    13.62  
1 1 1 1   4   14 o 13 340.00  36.50  3557.12   701.23   3596.29  991.66   3517.94   991.70   329.27  54.36  325.01  55.12  4.27    77.41  
1 1 1 1   4   15 o 2  106.51  16.13  337.01    95.55    337.01   95.55    0.00      0.00     106.51  16.13  ?       ?      0.00    16.13  
1 1 1 1   4   16 o 4  167.27  25.47  846.12    236.89   846.12   236.89   0.00      0.00     167.27  25.47  ?       ?      0.00    25.47  
1 1 1 1   4   17 o 17 279.61  44.72  2487.44   693.66   2487.44  693.66   0.00      0.00     279.61  44.72  ?       ?      0.00    44.72  
1 1 1 1   4   18 o 1  433.82  47.38  5895.86   1160.68  5780.21  1641.38  6011.53   1641.52  407.94  72.76  417.90  70.96  -9.96   101.63 
1 1 1 1   4   19 o 4  121.18  13.09  428.43    89.63    435.60   126.30   421.16    127.21   121.20  18.76  119.03  19.28  2.17    26.90  
1 1 1 1   4   20 o 17 231.69  23.93  1580.43   313.67   1581.58  443.59   1579.27   443.59   228.65  34.90  228.47  34.93  0.18    49.37  
1 1 1 1   4   21 o 5  324.83  34.05  3166.80   625.46   3141.67  884.52   3191.94   884.56   315.67  50.51  318.49  50.03  -2.82   71.09  
1 1 1 1   4   22 o 2  223.10  23.31  1474.85   294.15   1408.42  415.93   1541.31   416.05   213.86  35.10  224.66  33.26  -10.79  48.35  
1 1 1 1   4   23 o 10 103.22  13.23  313.21    76.57    356.57   109.03   271.01    107.57   109.26  18.01  94.50   20.42  14.76   27.23  
1 1 1 1   4   24 o 17 175.36  19.00  906.52    188.19   857.68   267.10   954.67    265.19   167.74  28.77  177.81  26.81  -10.07  39.33  
1 1 1 1   4   25 o 17 111.15  15.02  364.78    93.36    334.34   139.42   389.53    125.71   104.50  23.78  113.81  19.97  -9.31   31.05  
1 1 1 1   4   26 f 0  187.23  30.29  1092.04   314.47   0.00     0.00     1092.04   314.47   ?       ?      187.23  30.29  0.00    30.29  
1 1 1 1   4   27 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   4   28 o 4  160.30  27.24  815.99    241.70   0.00     0.00     815.99    241.70   ?       ?      160.30  27.24  0.00    27.24  
1 1 1 1   4   29 f 0  195.55  21.90  1185.55   241.63   1375.81  346.94   1006.31   336.73   204.16  30.54  170.14  35.62  34.02   46.92  
1 1 1 1   4   30 o 11 94.68   18.34  280.45    96.09    232.97   138.74   324.21    133.20   84.31   26.05  99.66   23.64  -15.36  35.17  
1 1 1 1   4   31 o 12 53.07   22.62  23.90     121.24   23.90    121.24   0.00      0.00     53.07   22.62  ?       ?      0.00    22.62  
1 1 1 1   4   32 o 17 156.42  33.78  925.41    294.41   925.41   294.41   0.00      0.00     156.42  33.78  ?       ?      0.00    33.78  
1 1 1 1   4   33 o 3  57.60   21.05  98.39     90.65    148.58   145.80   66.77     115.73   68.92   26.38  55.82   22.80  13.10   34.87  
1 1 1 1   5   0  o 11 603.29  42.36  10774.54  1457.88  8707.75  1785.54  14907.96  2525.08  534.26  59.21  697.47  63.77  -163.20 87.02  
1 1 1 1   5   1  o 19 210.77  15.95  1287.19   191.57   1110.77  331.43   1375.69   234.75   193.03  30.96  217.52  18.99  -24.50  36.32  
1 1 1 1   5   2  o 12 415.91  43.15  5154.69   1015.21  5323.49  1435.74  4985.88   1435.72  414.91  62.19  400.15  64.71  14.76   89.75  
1 1 1 1   5   3  o 6  227.84  23.18  1517.55   299.00   1631.44  422.89   1403.70   422.81   234.44  32.28  216.45  35.24  17.99   47.79  
1 1 1 1   5   4  o 14 285.08  29.15  2387.97   470.34   2433.39  665.17   2342.56   665.14   284.40  42.00  278.65  42.96  5.75    60.08  
1 1 1 1   5   5  o 15 378.02  58.63  4419.98   1231.13  0.00     0.00     4419.98   1231.13  ?       ?      378.02  58.63  0.00    58.63  
1 1 1 1   5   6  o 3  300.65  30.88  2664.64   525.40   2744.15  743.03   2585.12   743.03   301.13  44.31  291.57  45.91  9.56    63.80  
1 1 1 1   5   7  o 15 98.84   10.14  283.90    56.70    296.19   80.19    271.60    80.19    100.39  14.32  95.93   15.06  4.46    20.78  
1 1 1 1   5   8  o 14 331.43  34.31  3263.08   643.41   3309.39  909.90   3216.77   909.92   327.90  49.91  322.83  50.77  5.07    71.20  
1 1 1 1   5   9  o 12 440.27  46.73  5910.14   1162.93  5798.16  1644.60  6022.13   1644.66  421.20  70.51  430.57  68.86  -9.37   98.55  
1 1 1 1   5   10 o 6  104.39  10.73  317.06    63.37    325.86   89.53    308.22    89.72    105.13  15.28  102.09  15.82  3.04    22.00  
1 1 1 1   5   11 o 5  259.06  40.12  2071.51   577.40   2071.51  577.40   0.00      0.00     259.06  40.12  ?       ?      0.00    40.12  
1 1 1 1   5   12 o 19 109.56  16.50  355.82    100.56   0.00     0.00     355.82    100.56   ?       ?      109.56  16.50  0.00    16.50  
1 1 1 1   5   13 o 10 211.08  21.81  1319.82   260.53   1323.44  368.37   1316.19   368.52   207.84  31.89  207.22  32.01  0.63    45.18  
1 1 1 1   5   14 o 10 267.52  42.96  2286.36   637.40   2286.36  637.40   0.00      0.00     267.52  42.96  ?       ?      0.00    42.96  
1 1 1 1   5   15 o 18 333.72  57.19  3790.21   1056.16  3790.21  1056.16  0.00      0.00     333.72  57.19  ?       ?      0.00    57.19  
1 1 1 1   5   16 o 2  156.13  23.68  733.41    205.61   733.41   205.61   0.00      0.00     156.13  23.68  ?       ?      0.00    23.68  
1 1 1 1   5   17 o 14 79.52   8.79   184.29    39.46    195.22   55.41    173.04    56.21    81.33   12.25  76.28   13.32  5.05    18.10  
1 1 1 1   5   18 o 17 84.10   9.29   206.07    44.09    226.74   61.76    184.60    62.96    87.76   12.62  78.71   14.47  9.06    19.20  
1 1 1 1   5   19 o 1  229.47  23.81  1551.38   309.13   1709.90  437.58   1393.44   436.77   238.42  32.84  213.51  36.97  24.91   49.45  
1 1 1 1   5   20 o 6  311.24  32.48  2892.12   571.88   2945.39  808.80   2838.87   808.71   307.80  47.28  301.57  48.35  6.23    67.62  
1 1 1 1   5   21 o 4  657.61  82.45  15446.95  3044.49  15692.26 4305.55  15201.64  4305.56  579.12  132.40 564.70  134.71 14.42   188.88 
1 1 1 1   5   22 o 15 306.40  32.57  2850.79   564.04   2898.67  797.90   2802.96   797.44   299.95  47.95  294.24  48.93  5.72    68.51  
1 1 1 1   5   23 o 2  201.57  21.38  1204.13   243.67   1333.79  345.74   1076.16   343.47   209.42  29.58  186.33  33.33  23.09   44.57  
1 1 1 1   5   24 o 10 307.41  32.79  2872.92   569.77   3139.54  806.66   2607.46   804.90   313.38  46.23  281.63  51.69  31.75   69.34  
1 1 1 1   5   25 o 4  281.89  30.16  2418.03   480.48   2571.52  680.32   2265.28   678.67   282.81  43.28  262.91  46.68  19.90   63.65  
1 1 1 1   5   26 o 3  335.63  38.04  3630.41   719.96   3391.23  1018.10  3869.67   1018.25  300.14  61.17  327.10  56.25  -26.96  83.10  
1 1 1 1   5   27 o 4  208.65  35.29  1429.55   407.61   0.00     0.00     1429.55   407.61   ?       ?      208.65  35.29  0.00    35.29  
1 1 1 1   5   28 o 2  145.48  25.44  670.98    204.71   0.00     0.00     670.98    204.71   ?       ?      145.48  25.44  0.00    25.44  
1 1 1 1   5   29 o 12 156.89  28.11  811.15    243.86   811.15   243.86   0.00      0.00     156.89  28.11  ?       ?      0.00    28.11  
1 1 1 1   5   30 o 14 59.28   17.33  109.21    62.68    131.72   94.67    91.65     83.64    65.46   21.66  57.08   20.30  8.39    29.68  
1 1 1 1   5   31 o 2  127.22  26.02  549.63    183.64   549.63   183.64   0.00      0.00     127.22  26.02  ?       ?      0.00    26.02  
1 1 1 1   5   32 f 0  61.86   22.95  112.92    108.42   112.92   108.42   0.00      0.00     61.86   22.95  ?       ?      0.00    22.95  
1 1 1 1   5   33 o 8  47.84   20.98  6.58      110.35   6.58     110.35   0.00      0.00     47.84   20.98  ?       ?      0.00    20.98  
1 1 1 1   6   0  o 19 801.74  88.96  21144.73  4025.42  19657.43 5692.48  22632.38  5693.12  703.19  145.81 774.28  132.87 -71.09  197.26 
1 1 1 1   6   1  o 2  929.18  112.42 30393.12  5874.75  29191.62 8307.86  31594.79  8308.43  791.19  186.06 841.47  177.58 -50.28  257.20 
1 1 1 1   6   2  o 2  1223.10 189.64 69500.66  12884.51 60313.40 18221.11 78688.59  18221.78 746.40  292.38 979.22  297.75 -232.82 417.30 
1 1 1 1   6   3  o 14 739.14  152.03 22391.78  6235.35  22391.78 6235.35  0.00      0.00     739.14  152.03 ?       ?      0.00    152.03 
1 1 1 1   6   4  o 8  784.11  183.75 29180.84  8125.72  29180.84 8125.72  0.00      0.00     784.11  183.75 ?       ?      0.00    183.75 
1 1 1 1   6   5  o 12 235.96  24.09  1632.70   321.71   1704.13  455.01   1561.30   454.93   238.66  34.19  227.76  35.99  10.91   49.64  
1 1 1 1   6   6  o 17 185.32  18.87  1003.35   198.00   981.19   279.98   1025.51   280.03   181.42  27.76  185.72  27.06  -4.30   38.77  
1 1 1 1   6   7  o 9  527.31  92.81  9719.73   2706.90  0.00     0.00     9719.73   2706.90  ?       ?      527.31  92.81  0.00    92.81  
1 1 1 1   6   8  o 17 191.75  19.60  1076.90   212.71   1098.07  300.81   1055.71   300.84   191.68  28.18  187.70  28.84  3.98    40.32  
1 1 1 1   6   9  o 12 96.60   14.53  275.48    78.07    275.48   78.07    0.00      0.00     96.60   14.53  ?       ?      0.00    14.53  
1 1 1 1   6   10 o 13 230.99  35.48  1633.13   455.39   1633.13  455.39   0.00      0.00     230.99  35.48  ?       ?      0.00    35.48  
1 1 1 1   6   11 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   6   12 o 18 161.90  24.50  789.21    220.64   789.21   220.64   0.00      0.00     161.90  24.50  ?       ?      0.00    24.50  
1 1 1 1   6   13 o 16 134.41  20.29  540.44    151.66   540.44   151.66   0.00      0.00     134.41  20.29  ?       ?      0.00    20.29  
1 1 1 1   6   14 o 16 222.71  34.79  1542.00   430.23   1542.00  430.23   0.00      0.00     222.71  34.79  ?       ?      0.00    34.79  
1 1 1 1   6   15 o 9  70.20   11.51  146.02    44.78    146.02   44.78    0.00      0.00     70.20   11.51  ?       ?      0.00    11.51  
1 1 1 1   6   16 o 16 39.56   7.39   46.49     16.17    37.70    23.69    54.15     22.12    35.93   10.69  42.53   9.32   -6.60   14.18  
1 1 1 1   6   17 o 12 79.42   8.78   183.74    39.36    183.65   55.09    183.84    56.27    78.79   12.60  78.79   12.89  0.01    18.02  
1 1 1 1   6   18 o 13 422.20  45.61  5488.76   1088.02  5792.61  1538.84  5185.02   1538.54  419.20  66.13  392.57  70.88  26.63   96.94  
1 1 1 1   6   19 o 18 309.86  32.71  2868.08   573.11   3210.21  811.10   2526.96   809.90   322.71  45.00  282.56  51.84  40.15   68.65  
1 1 1 1   6   20 o 13 79.91   11.52  187.79    51.30    180.37   81.41    192.68    66.07    77.32   18.57  80.40   14.86  -3.07   23.79  
1 1 1 1   6   21 o 6  531.98  62.81  9514.59   1881.08  9983.37  2660.48  9045.97   2660.03  500.24  96.14  466.43  102.18 33.81   140.29 
1 1 1 1   6   22 o 13 227.84  24.04  1548.11   309.74   1562.33  439.16   1534.04   436.92   224.27  35.27  222.11  35.46  2.16    50.02  
1 1 1 1   6   23 o 1  152.66  16.89  685.93    145.51   617.42   205.67   754.59    205.90   142.33  26.14  158.55  23.32  -16.22  35.03  
1 1 1 1   6   24 o 5  137.49  16.44  557.30    127.20   545.74   180.43   568.73    179.36   134.03  24.35  137.09  23.64  -3.06   33.94  
1 1 1 1   6   25 o 1  248.03  26.65  1866.00   373.53   1848.14  529.31   1883.72   527.19   239.28  39.94  242.03  39.29  -2.75   56.03  
1 1 1 1   6   26 o 16 301.54  33.93  2905.83   577.12   2929.83  817.25   2881.95   815.09   284.89  51.88  282.09  52.26  2.80    73.64  
1 1 1 1   6   27 o 18 200.31  34.19  1323.61   379.09   0.00     0.00     1323.61   379.09   ?       ?      200.31  34.19  0.00    34.19  
1 1 1 1   6   28 o 8  108.67  22.54  374.32    135.98   0.00     0.00     374.32    135.98   ?       ?      108.67  22.54  0.00    22.54  
1 1 1 1   6   29 o 16 198.08  38.14  1436.60   417.95   1436.60  417.95   0.00      0.00     198.08  38.14  ?       ?      0.00    38.14  
1 1 1 1   6   30 o 18 153.51  19.25  738.22    165.95   786.79   235.32   690.17    234.07   151.95  28.01  140.50  29.94  11.45   41.00  
1 1 1 1   6   31 o 9  47.07   19.39  33.87     84.50    65.13    121.42   4.50      117.68   57.21   23.36  49.86   21.77  7.35    31.93  
1 1 1 1   6   32 o 2  74.44   26.11  191.71    137.94   191.71   137.94   0.00      0.00     74.44   26.11  ?       ?      0.00    26.11  
1 1 1 1   7   0  o 15 301.25  21.08  2643.81   362.23   2599.13  512.31   2688.49   512.24   296.31  30.56  301.57  29.99  -5.27   42.81  
1 1 1 1   7   1  o 11 653.37  58.29  13272.91  2163.39  13214.93 2649.67  13388.87  3746.90  637.79  73.72  598.52  113.20 39.27   135.09 
1 1 1 1   7   2  o 18 564.41  61.98  10029.05  1975.09  10045.44 2793.19  10012.65  2793.20  536.16  94.19  535.07  94.38  1.09    133.34 
1 1 1 1   7   3  o 12 412.02  35.42  5049.18   829.61   5194.54  1436.67  4976.46   1016.15  402.79  64.29  405.04  44.43  -2.25   78.15  
1 1 1 1   7   4  o 10 373.37  39.12  4191.08   826.09   4344.47  1168.27  4037.68   1168.25  371.53  56.56  356.52  59.15  15.02   81.84  
1 1 1 1   7   5  o 10 492.14  53.37  7534.92   1483.61  7371.73  2098.13  7698.12   2098.16  464.23  81.71  476.58  79.49  -12.35  114.00 
1 1 1 1   7   6  o 11 305.37  47.71  2903.41   809.07   2903.41  809.07   0.00      0.00     305.37  47.71  ?       ?      0.00    47.71  
1 1 1 1   7   7  o 1  531.01  103.72 10945.77  3048.36  10945.77 3048.36  0.00      0.00     531.01  103.72 ?       ?      0.00    103.72 
1 1 1 1   7   8  o 6  172.04  25.93  887.99    248.13   887.99   248.13   0.00      0.00     172.04  25.93  ?       ?      0.00    25.93  
1 1 1 1   7   9  o 5  139.64  20.97  581.35    162.91   581.35   162.91   0.00      0.00     139.64  20.97  ?       ?      0.00    20.97  
1 1 1 1   7   10 o 7  223.01  34.51  1532.62   427.50   1532.62  427.50   0.00      0.00     223.01  34.51  ?       ?      0.00    34.51  
1 1 1 1   7   11 o 10 221.74  34.44  1520.13   424.17   0.00     0.00     1520.13   424.17   ?       ?      221.74  34.44  0.00    34.44  
1 1 1 1   7   12 o 17 185.25  19.09  1013.51   200.09   999.74   282.87   1027.31   283.07   181.10  28.12  183.78  27.69  -2.68   39.46  
1 1 1 1   7   13 o 19 259.36  27.26  2025.08   399.83   2047.38  565.36   2002.76   565.53   254.31  40.05  251.16  40.61  3.15    57.03  
1 1 1 1   7   14 o 12 219.81  22.80  1436.79   283.55   1431.69  400.90   1441.89   401.11   215.26  33.53  216.09  33.41  -0.83   47.34  
1 1 1 1   7   15 o 10 167.40  17.33  823.54    164.11   867.70   232.01   779.32    232.17   170.00  24.48  160.46  26.10  9.53    35.78  
1 1 1 1   7   16 o 1  288.81  30.27  2502.00   494.47   2545.75  699.19   2458.23   699.38   284.77  44.20  279.23  45.17  5.54    63.20  
1 1 1 1   7   17 o 3  329.77  34.41  3267.99   641.77   3178.91  907.46   3357.13   907.75   316.70  51.70  326.56  50.01  -9.86   71.93  
1 1 1 1   7   18 o 12 72.68   11.17  155.68    45.11    183.63   65.49    130.45    62.22    78.43   15.09  65.88   16.49  12.55   22.36  
1 1 1 1   7   19 o 17 435.25  47.27  5863.19   1162.10  6095.17  1643.49  5631.21   1643.44  427.15  69.40  407.36  72.96  19.79   100.70 
1 1 1 1   7   20 o 2  220.57  22.93  1439.28   286.16   1418.83  404.98   1459.68   404.39   215.32  33.88  218.70  33.26  -3.38   47.48  
1 1 1 1   7   21 o 6  129.69  14.81  494.07    108.28   554.00   155.80   438.07    150.59   136.10  20.58  120.21  22.65  15.89   30.61  
1 1 1 1   7   22 o 1  111.13  14.44  364.02    89.95    451.96   134.35   292.57    121.10   122.83  19.72  97.89   22.08  24.93   29.60  
1 1 1 1   7   23 o 3  259.05  27.73  2018.30   405.92   2137.79  575.52   1900.01   572.61   260.80  39.69  244.16  42.39  16.65   58.07  
1 1 1 1   7   24 o 11 433.83  50.57  6232.74   1235.84  6540.94  1748.28  5924.92   1747.20  411.82  76.77  384.77  81.63  27.05   112.06 
1 1 1 1   7   25 o 16 143.98  17.48  617.70    141.49   637.31   207.99   600.82    193.04   143.19  26.27  139.40  25.04  3.79    36.29  
1 1 1 1   7   26 o 13 90.42   21.96  255.68    112.83   0.00     0.00     255.68    112.83   ?       ?      90.42   21.96  0.00    21.96  
1 1 1 1   7   27 o 6  122.37  23.59  472.79    159.73   0.00     0.00     472.79    159.73   ?       ?      122.37  23.59  0.00    23.59  
1 1 1 1   7   28 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   7   29 f 0  219.59  26.29  1587.85   324.81   1649.11  463.43   1528.70   455.38   207.17  40.42  197.95  41.41  9.22    57.86  
1 1 1 1   7   30 o 18 88.30   19.80  252.58    97.90    211.23   137.40   295.23    139.53   79.30   26.08  92.79   25.44  -13.49  36.43  
1 1 1 1   7   31 o 15 96.96   27.18  338.93    157.30   0.00     0.00     338.93    157.30   ?       ?      96.96   27.18  0.00    27.18  
1 1 1 1   7   32 o 18 87.71   27.58  291.04    154.84   291.04   154.84   0.00      0.00     87.71   27.58  ?       ?      0.00    27.58  
1 1 1 1   8   0  o 8  519.67  38.27  8158.50   1133.74  7742.76  1603.35  8574.25   1603.35  490.87  58.02  519.91  54.53  -29.05  79.62  
1 1 1 1   8   1  o 9  366.06  29.20  3975.25   608.55   4021.64  745.51   3882.62   1053.48  365.16  36.03  348.47  54.44  16.69   65.29  
1 1 1 1   8   2  o 10 326.07  28.65  3155.73   530.76   3007.72  650.17   3451.38   918.93   315.03  36.63  330.73  49.96  -15.70  61.95  
1 1 1 1   8   3  o 19 139.98  14.32  572.09    113.49   549.17   160.49   595.03    160.51   135.74  21.30  141.63  20.32  -5.89   29.44  
1 1 1 1   8   4  o 18 421.11  36.64  5361.56   876.93   5636.72  1518.51  5223.88   1074.15  409.48  66.91  409.46  46.52  0.02    81.49  
1 1 1 1   8   5  o 6  95.67   8.07   265.21    43.92    271.28   73.04    261.77    54.98    95.95   13.64  94.77   10.27  1.19    17.08  
1 1 1 1   8   6  o 7  232.67  24.04  1604.26   316.51   1616.97  447.58   1591.54   447.65   229.71  35.05  227.72  35.39  1.98    49.81  
1 1 1 1   8   7  o 14 149.69  15.39  656.18    130.36   738.73   184.45   573.80    184.27   157.70  20.89  137.84  24.17  19.86   31.94  
1 1 1 1   8   8  o 3  519.14  128.33 13653.74  3802.51  0.00     0.00     13653.74  3802.51  ?       ?      519.14  128.33 0.00    128.33 
1 1 1 1   8   9  o 8  115.49  11.97  389.49    78.23    432.32   110.64   346.67    110.63   120.91  16.36  107.56  18.59  13.35   24.76  
1 1 1 1   8   10 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   8   11 o 17 301.38  49.81  2984.33   831.77   2984.33  831.77   0.00      0.00     301.38  49.81  ?       ?      0.00    49.81  
1 1 1 1   8   12 o 19 89.61   9.49   234.10    48.08    234.78   67.84    233.42    68.16    89.01   13.72  88.72   13.83  0.29    19.48  
1 1 1 1   8   13 o 5  312.25  33.26  2973.86   587.06   3015.34  830.18   2932.37   830.29   304.44  49.18  299.54  50.05  4.90    70.17  
1 1 1 1   8   14 o 18 313.64  33.08  2983.92   586.70   2909.19  829.60   3058.70   829.84   299.91  49.94  308.66  48.43  -8.74   69.56  
1 1 1 1   8   15 f 0  192.10  19.91  1085.57   216.39   1149.11  305.98   1021.99   306.07   195.46  28.07  183.51  30.10  11.95   41.16  
1 1 1 1   8   16 o 14 299.56  30.84  2677.04   522.81   2493.61  739.16   2860.67   739.57   282.04  47.33  304.33  43.57  -22.29  64.33  
1 1 1 1   8   17 o 6  201.47  21.11  1192.51   240.52   1278.94  339.94   1105.89   340.34   206.58  29.50  191.07  32.17  15.52   43.65  
1 1 1 1   8   18 o 11 245.44  25.55  1781.59   354.77   1837.72  501.73   1725.45   501.70   245.64  36.70  237.36  38.11  8.28    52.91  
1 1 1 1   8   19 o 10 205.06  21.43  1240.58   248.57   1257.15  351.74   1224.05   351.31   203.51  31.09  200.61  31.55  2.90    44.29  
1 1 1 1   8   20 o 2  254.63  26.89  1944.02   387.10   1983.71  547.72   1904.43   547.15   251.49  39.22  245.84  40.16  5.66    56.13  
1 1 1 1   8   21 o 12 69.56   14.85  145.74    57.49    162.52   83.88    130.87    78.95    73.24   19.57  66.27   19.47  6.97    27.61  
1 1 1 1   8   22 o 9  275.94  29.42  2301.51   458.83   2329.60  649.61   2273.53   648.17   270.11  43.36  266.46  43.90  3.66    61.70  
1 1 1 1   8   23 o 6  129.22  16.16  493.23    117.26   528.98   169.28   460.26    162.57   132.09  23.17  122.81  23.92  9.28    33.30  
1 1 1 1   8   24 o 3  218.10  35.98  1521.25   434.76   1521.25  434.76   0.00      0.00     218.10  35.98  ?       ?      0.00    35.98  
1 1 1 1   8   25 o 12 148.68  25.12  688.72    206.81   0.00     0.00     688.72    206.81   ?       ?      148.68  25.12  0.00    25.12  
1 1 1 1   8   26 o 13 117.19  22.26  429.03    144.27   0.00     0.00     429.03    144.27   ?       ?      117.19  22.26  0.00    22.26  
1 1 1 1   8   27 o 14 57.80   21.36  85.61     93.76    0.00     0.00     85.61     93.76    ?       ?      57.80   21.36  0.00    21.36  
1 1 1 1   8   28 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   8   29 o 9  110.21  17.40  379.47    106.42   369.42   150.41   389.54    150.58   104.32  25.37  107.48  24.90  -3.16   35.54  
1 1 1 1   8   30 o 14 186.74  23.71  1161.76   248.48   1131.59  352.44   1191.57   350.37   167.82  37.53  174.23  36.21  -6.41   52.15  
1 1 1 1   8   31 o 4  113.97  21.50  437.76    135.53   413.28   201.99   457.81    182.79   101.84  31.42  110.29  28.63  -8.45   42.51  
1 1 1 1   8   32 o 12 100.86  32.06  433.45    208.66   433.45   208.66   0.00      0.00     100.86  32.06  ?       ?      0.00    32.06  
1 1 1 1   9   0  o 1  304.63  25.97  2754.06   449.77   2980.19  776.75   2639.99   551.67   307.25  45.40  295.22  33.12  12.03   56.20  
1 1 1 1   9   1  o 18 608.39  49.33  11721.75  1707.94  11294.44 2415.21  12149.20  2415.59  562.14  76.85  588.48  73.07  -26.34  106.05 
1 1 1 1   9   2  o 19 153.76  11.68  686.20    102.29   641.54   144.59   730.95    144.73   147.61  17.40  157.94  16.19  -10.33  23.77  
1 1 1 1   9   3  o 2  188.88  19.50  1050.74   208.44   1111.80  294.85   989.73    294.71   192.04  27.53  180.37  29.48  11.67   40.34  
1 1 1 1   9   4  o 19 348.03  37.23  3717.54   732.33   3687.82  1035.65  3747.26   1035.69  333.80  56.03  336.96  55.47  -3.16   78.84  
1 1 1 1   9   5  o 7  75.87   7.34   167.15    31.59    179.48   49.94    158.93    40.78    78.03   11.49  73.60   9.90   4.43    15.17  
1 1 1 1   9   6  o 12 153.13  15.75  687.69    136.49   700.05   192.98   675.32    193.08   152.82  22.68  149.91  23.18  2.91    32.44  
1 1 1 1   9   7  o 1  219.02  22.69  1424.56   281.18   1415.92  397.60   1433.20   397.71   214.34  33.40  215.77  33.17  -1.43   47.07  
1 1 1 1   9   8  o 19 438.43  49.69  6224.35   1228.58  6604.88  1737.50  5843.85   1737.45  424.90  73.91  391.98  79.92  32.92   108.86 
1 1 1 1   9   9  o 16 134.00  20.30  536.92    151.26   536.92   151.26   0.00      0.00     134.00  20.30  ?       ?      0.00    20.30  
1 1 1 1   9   10 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   9   11 o 5  135.58  14.00  537.95    107.40   549.59   151.80   526.29    151.96   135.73  20.09  132.63  20.63  3.10    28.79  
1 1 1 1   9   12 o 18 258.18  27.04  1992.61   394.81   2091.47  558.33   1893.73   558.36   259.46  38.66  245.50  41.07  13.96   56.41  
1 1 1 1   9   13 o 7  183.80  18.98  993.02    197.44   1029.45  279.14   956.55    279.29   185.02  27.08  177.86  28.30  7.16    39.17  
1 1 1 1   9   14 o 14 105.01  11.05  321.27    65.62    326.51   92.61    316.00    92.99    105.08  15.84  103.27  16.22  1.81    22.68  
1 1 1 1   9   15 o 11 209.60  21.45  1291.04   254.42   1250.15  359.53   1332.06   360.07   203.44  31.83  210.48  30.70  -7.03   44.22  
1 1 1 1   9   16 o 18 127.29  13.28  472.46    95.61    480.22   134.62   464.57    135.81   127.33  19.00  125.09  19.55  2.25    27.26  
1 1 1 1   9   17 o 5  218.32  22.88  1405.19   282.54   1502.83  399.84   1307.82   399.30   223.15  32.14  207.02  34.84  16.13   47.40  
1 1 1 1   9   18 f 0  329.82  35.36  3306.89   659.13   3487.45  932.21   3126.37   932.10   329.53  50.92  309.40  54.47  20.13   74.56  
1 1 1 1   9   19 o 13 73.19   13.85  160.17    56.04    171.56   77.04    147.37    81.67    75.24   18.07  70.00   19.57  5.24    26.63  
1 1 1 1   9   20 o 2  192.60  20.42  1099.52   222.37   1084.14  315.39   1114.73   313.58   187.81  30.28  190.76  29.59  -2.96   42.34  
1 1 1 1   9   21 o 19 193.61  20.95  1111.57   229.18   1127.21  326.38   1096.36   321.89   191.62  30.71  188.92  30.74  2.70    43.45  
1 1 1 1   9   22 o 9  311.02  33.40  2969.13   587.01   2904.08  830.64   3034.02   829.67   295.78  50.75  303.56  49.30  -7.78   70.75  
1 1 1 1   9   23 o 4  69.17   20.98  142.82    90.52    0.00     0.00     142.82    90.52    ?       ?      69.17   20.98  0.00    20.98  
1 1 1 1   9   24 o 9  187.11  31.28  1118.18   324.11   0.00     0.00     1118.18   324.11   ?       ?      187.11  31.28  0.00    31.28  
1 1 1 1   9   25 o 17 143.25  25.46  647.87    201.66   0.00     0.00     647.87    201.66   ?       ?      143.25  25.46  0.00    25.46  
1 1 1 1   9   26 o 19 86.18   20.64  234.40    100.77   0.00     0.00     234.40    100.77   ?       ?      86.18   20.64  0.00    20.64  
1 1 1 1   9   27 o 16 191.54  36.13  1317.65   382.75   1317.65  382.75   0.00      0.00     191.54  36.13  ?       ?      0.00    36.13  
1 1 1 1   9   28 o 1  87.77   17.81  243.45    86.65    290.74   127.20   202.50    118.37   93.37   23.70  78.32   24.03  15.05   33.75  
1 1 1 1   9   29 o 2  159.73  20.19  818.00    181.04   768.20   253.68   869.70    258.45   144.52  31.47  155.63  30.02  -11.11  43.49  
1 1 1 1   9   30 o 17 93.21   24.95  308.07    136.17   0.00     0.00     308.07    136.17   ?       ?      93.21   24.95  0.00    24.95  
1 1 1 1   9   31 o 4  42.99   19.66  -36.88    108.58   -36.88   108.58   0.00      0.00     42.99   19.66  ?       ?      0.00    19.66  
1 1 1 1   10  0  o 9  155.51  16.23  708.71    142.73   779.87   202.53   638.50    201.17   161.80  22.41  145.45  24.99  16.34   33.57  
1 1 1 1   10  1  o 7  423.49  44.81  5617.75   1072.76  5916.69  1518.70  5320.05   1515.52  416.03  65.77  389.85  70.30  26.18   96.27  
1 1 1 1   10  2  o 15 124.97  13.98  457.42    98.55    432.48   146.94   477.80    132.85   119.71  22.20  126.76  18.83  -7.06   29.11  
1 1 1 1   10  3  o 11 176.87  26.91  944.72    264.60   0.00     0.00     944.72    264.60   ?       ?      176.87  26.91  0.00    26.91  
1 1 1 1   10  4  o 7  368.26  63.53  4645.86   1294.63  0.00     0.00     4645.86   1294.63  ?       ?      368.26  63.53  0.00    63.53  
1 1 1 1   10  5  o 16 464.28  93.63  8649.22   2409.28  0.00     0.00     8649.22   2409.28  ?       ?      464.28  93.63  0.00    93.63  
1 1 1 1   10  6  o 9  158.27  19.86  742.27    176.44   0.00     0.00     742.27    176.44   ?       ?      158.27  19.86  0.00    19.86  
1 1 1 1   10  7  o 3  314.53  26.59  2946.29   475.61   3266.95  821.10   2784.39   583.46   320.55  45.93  302.17  34.24  18.38   57.29  
1 1 1 1   10  8  o 9  565.71  62.00  10764.19  1980.49  0.00     0.00     10764.19  1980.49  ?       ?      565.71  62.00  0.00    62.00  
1 1 1 1   10  9  x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   10  10 o 17 359.63  38.76  3964.08   787.69   4444.03  1114.15  3484.47   1113.76  370.68  53.94  321.40  62.62  49.28   82.65  
1 1 1 1   10  11 o 13 361.46  38.89  3987.42   794.33   4573.11  1123.58  3402.20   1123.13  378.14  53.23  318.43  63.67  59.71   82.99  
1 1 1 1   10  12 f 0  176.11  18.41  909.13    183.37   1059.56  260.11   760.50    258.56   188.85  24.57  158.25  29.55  30.61   38.43  
1 1 1 1   10  13 o 2  148.88  15.85  647.98    133.42   796.92   190.18   503.61    187.23   164.38  20.61  128.95  26.19  35.42   33.32  
1 1 1 1   10  14 o 7  193.34  20.42  1097.13   223.22   1307.16  316.42   889.06    314.94   209.67  26.91  170.63  33.35  39.04   42.85  
1 1 1 1   10  15 o 13 242.83  37.21  1797.03   502.16   0.00     0.00     1797.03   502.16   ?       ?      242.83  37.21  0.00    37.21  
1 1 1 1   10  16 o 8  179.56  19.14  947.15    194.26   1045.20  275.30   849.92    274.14   186.92  26.39  167.32  29.62  19.60   39.67  
1 1 1 1   10  17 o 12 153.42  16.74  691.45    145.05   765.35   204.86   617.15    205.42   160.00  22.96  142.54  26.06  17.46   34.73  
1 1 1 1   10  18 o 11 150.82  16.31  669.04    138.98   653.13   196.40   685.00    196.71   146.96  24.11  150.76  23.49  -3.80   33.67  
1 1 1 1   10  19 o 5  89.39   19.81  242.93    98.96    0.00     0.00     242.93    98.96    ?       ?      89.39   19.81  0.00    19.81  
1 1 1 1   10  20 o 3  201.07  32.47  1247.75   362.08   0.00     0.00     1247.75   362.08   ?       ?      201.07  32.47  0.00    32.47  
1 1 1 1   10  21 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   10  22 o 1  65.47   20.62  125.70    86.51    0.00     0.00     125.70    86.51    ?       ?      65.47   20.62  0.00    20.62  
1 1 1 1   10  23 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   10  24 o 8  86.91   21.51  236.91    106.73   0.00     0.00     236.91    106.73   ?       ?      86.91   21.51  0.00    21.51  
1 1 1 1   10  25 o 14 59.25   18.55  105.59    70.15    119.34   105.63   94.74     93.82    64.95   22.84  59.48   21.46  5.47    31.34  
1 1 1 1   10  26 o 15 159.05  19.06  780.97    170.54   816.31   241.70   745.93    240.66   156.81  27.87  148.77  29.22  8.05    40.38  
1 1 1 1   10  27 o 15 64.95   19.13  133.71    76.11    95.32    107.23   172.69    108.04   60.11   22.71  73.08   23.05  -12.96  32.36  
1 1 1 1   10  28 o 13 61.67   20.45  119.00    84.40    139.30   110.63   90.74     130.55   66.72   23.38  61.53   24.54  5.19    33.90  
1 1 1 1   10  29 o 14 134.20  19.22  581.71    143.82   559.99   196.20   606.93    211.44   124.00  28.20  128.06  29.39  -4.06   40.73  
1 1 1 1   10  30 o 14 72.42   25.02  186.44    126.39   186.44   126.39   0.00      0.00     72.42   25.02  ?       ?      0.00    25.02  
1 1 1 1   10  31 o 11 66.29   25.07  152.83    130.68   152.83   130.68   0.00      0.00     66.29   25.07  ?       ?      0.00    25.07  
1 1 1 1   11  0  o 1  99.72   14.58  293.10    80.97    288.67   91.50    309.09    173.87   98.55   16.77  101.21  28.64  -2.67   33.19  
1 1 1 1   11  1  o 3  164.98  14.62  792.34    137.02   754.24   163.04   883.97    252.82   160.33  18.03  171.80  26.48  -11.46  32.04  
1 1 1 1   11  2  o 6  366.38  26.69  3959.36   557.46   3947.39  788.67   3971.31   788.06   360.60  38.70  361.78  38.54  -1.18   54.62  
1 1 1 1   11  3  o 1  124.68  12.86  453.31    90.72    367.06   101.12   809.40    205.45   111.46  16.28  165.19  22.23  -53.73  27.56  
1 1 1 1   11  4  o 17 95.71   10.71  267.22    57.83    225.46   89.38    297.28    75.84    86.52   18.55  100.59  13.47  -14.07  22.93  
1 1 1 1   11  5  o 14 244.18  25.55  1766.17   352.81   1969.31  499.38   1563.73   498.52   254.69  35.09  224.59  40.14  30.10   53.31  
1 1 1 1   11  6  o 13 471.76  37.49  6718.24   1006.97  6437.21  1741.20  6859.46   1234.32  434.73  72.31  470.81  46.27  -36.08  85.84  
1 1 1 1   11  7  o 2  270.23  28.27  2170.80   432.11   2394.41  611.60   1947.93   610.58   279.79  39.15  249.80  44.20  29.99   59.04  
1 1 1 1   11  8  x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   11  9  o 14 233.38  35.59  1652.50   461.75   0.00     0.00     1652.50   461.75   ?       ?      233.38  35.59  0.00    35.59  
1 1 1 1   11  10 o 17 246.64  37.71  1850.61   516.97   0.00     0.00     1850.61   516.97   ?       ?      246.64  37.71  0.00    37.71  
1 1 1 1   11  11 o 19 201.32  30.44  1216.84   340.80   0.00     0.00     1216.84   340.80   ?       ?      201.32  30.44  0.00    30.44  
1 1 1 1   11  12 o 7  240.75  36.75  1759.58   491.81   0.00     0.00     1759.58   491.81   ?       ?      240.75  36.75  0.00    36.75  
1 1 1 1   11  13 o 16 354.11  56.86  4004.75   1116.67  0.00     0.00     4004.75   1116.67  ?       ?      354.11  56.86  0.00    56.86  
1 1 1 1   11  14 o 11 149.01  22.63  661.87    187.49   0.00     0.00     661.87    187.49   ?       ?      149.01  22.63  0.00    22.63  
1 1 1 1   11  15 o 2  120.47  18.89  432.23    126.37   0.00     0.00     432.23    126.37   ?       ?      120.47  18.89  0.00    18.89  
1 1 1 1   11  16 o 8  248.24  39.49  1934.08   543.91   0.00     0.00     1934.08   543.91   ?       ?      248.24  39.49  0.00    39.49  
1 1 1 1   11  17 o 14 244.61  39.25  1888.98   532.59   0.00     0.00     1888.98   532.59   ?       ?      244.61  39.25  0.00    39.25  
1 1 1 1   11  18 o 11 71.59   21.54  152.19    95.72    0.00     0.00     152.19    95.72    ?       ?      71.59   21.54  0.00    21.54  
1 1 1 1   11  19 o 1  142.38  25.71  617.89    202.44   0.00     0.00     617.89    202.44   ?       ?      142.38  25.71  0.00    25.71  
1 1 1 1   11  20 o 7  166.95  27.28  852.49    252.41   0.00     0.00     852.49    252.41   ?       ?      166.95  27.28  0.00    27.28  
1 1 1 1   11  21 o 14 169.51  18.83  855.85    180.16   854.15   255.26   857.55    254.31   165.96  27.77  166.37  27.59  -0.41   39.15  
1 1 1 1   11  22 o 15 297.85  33.86  2852.70   568.68   2892.03  803.48   2813.23   804.98   281.49  51.62  276.35  52.66  5.14    73.75  
1 1 1 1   11  23 o 13 88.79   16.89  240.93    82.97    288.61   112.83   184.79    122.43   96.11   21.03  77.54   24.54  18.57   32.32  
1 1 1 1   11  24 o 10 83.46   17.29  215.34    80.13    260.70   109.72   163.48    117.32   90.73   21.41  73.20   24.10  17.52   32.24  
1 1 1 1   11  25 o 17 98.24   17.21  298.59    93.53    238.51   123.25   380.13    143.60   85.48   24.09  108.08  23.79  -22.60  33.86  
1 1 1 1   11  26 o 4  70.41   23.93  155.92    115.55   155.92   115.55   0.00      0.00     70.41   23.93  ?       ?      0.00    23.93  
1 1 1 1   11  27 o 10 96.93   25.92  326.57    146.99   326.57   146.99   0.00      0.00     96.93   25.92  ?       ?      0.00    25.92  
1 1 1 1   11  28 o 11 87.57   26.29  274.72    142.74   274.72   142.74   0.00      0.00     87.57   26.29  ?       ?      0.00    26.29  
1 1 1 1   11  29 o 1  59.47   24.06  92.12     127.38   92.12    127.38   0.00      0.00     59.47   24.06  ?       ?      0.00    24.06  
1 1 1 1   11  30 o 11 80.08   26.90  250.93    145.97   250.93   145.97   0.00      0.00     80.08   26.90  ?       ?      0.00    26.90  
1 1 1 1   12  0  o 17 338.30  23.12  3335.19   446.27   2224.18  762.07   3915.04   550.54   267.42  51.51  365.86  26.39  -98.44  57.88  
1 1 1 1   12  1  o 4  363.18  23.76  3846.29   492.66   3747.52  699.87   3943.32   693.62   355.31  34.76  364.98  33.48  -9.67   48.26  
1 1 1 1   12  2  o 15 369.84  41.37  4115.66   863.23   4439.85  1210.88  3780.62   1230.96  376.50  57.87  343.32  64.83  33.18   86.91  
1 1 1 1   12  3  o 8  373.05  32.43  4116.63   687.70   3143.39  958.36   5149.73   987.39   316.90  54.65  413.57  42.18  -96.67  69.04  
1 1 1 1   12  4  o 9  631.97  65.52  12677.82  2342.72  11554.56 3307.40  13808.86  3318.83  562.42  106.33 629.22  94.82  -66.80  142.47 
1 1 1 1   12  5  o 11 871.21  101.35 27089.03  4974.22  24535.17 7030.31  29649.13  7038.92  697.98  175.63 813.08  156.48 -115.10 235.23 
1 1 1 1   12  6  o 4  412.90  67.03  5502.55   1534.26  5502.55  1534.26  0.00      0.00     412.90  67.03  ?       ?      0.00    67.03  
1 1 1 1   12  7  o 8  425.48  69.71  5895.22   1643.72  5895.22  1643.72  0.00      0.00     425.48  69.71  ?       ?      0.00    69.71  
1 1 1 1   12  8  x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   12  9  o 15 286.17  23.13  2397.88   376.78   2359.57  633.08   2418.90   468.85   278.24  40.85  285.86  28.97  -7.62   50.08  
1 1 1 1   12  10 o 10 289.24  23.34  2452.16   384.28   2275.02  648.89   2547.84   476.90   271.93  43.00  293.35  28.69  -21.42  51.69  
1 1 1 1   12  11 o 7  455.65  49.66  6460.89   1277.97  0.00     0.00     6460.89   1277.97  ?       ?      455.65  49.66  0.00    49.66  
1 1 1 1   12  12 o 16 279.91  29.13  2338.40   461.26   2270.81  652.00   2406.12   652.65   269.67  43.60  278.45  42.15  -8.77   60.64  
1 1 1 1   12  13 o 13 87.17   12.48  223.83    60.66    248.15   82.89    195.78    89.01    91.13   16.45  80.39   19.49  10.73   25.51  
1 1 1 1   12  14 o 14 266.54  28.44  2136.55   428.38   2297.48  605.20   1974.97   606.43   270.71  40.16  248.53  44.12  22.18   59.66  
1 1 1 1   12  15 o 17 187.11  20.51  1037.39   216.71   1094.24  306.84   980.81    306.10   189.35  29.16  178.40  31.01  10.96   42.57  
1 1 1 1   12  16 o 18 137.88  17.11  561.66    132.56   591.04   188.81   533.10    186.17   139.59  24.45  132.13  25.47  7.45    35.31  
1 1 1 1   12  17 o 5  145.51  17.92  626.07    146.53   572.61   203.89   683.18    210.73   136.67  26.94  150.08  25.36  -13.40  37.00  
1 1 1 1   12  18 o 4  351.12  38.25  3843.38   758.54   3726.27  1072.20  3960.72   1073.28  328.99  58.94  341.37  56.76  -12.38  81.83  
1 1 1 1   12  19 o 14 347.18  64.55  4427.53   1239.14  4427.53  1239.14  0.00      0.00     347.18  64.55  ?       ?      0.00    64.55  
1 1 1 1   12  20 o 10 274.70  49.02  2632.47   744.69   0.00     0.00     2632.47   744.69   ?       ?      274.70  49.02  0.00    49.02  
1 1 1 1   12  21 o 4  340.42  40.29  3916.22   772.16   3815.71  1090.49  4017.29   1093.51  302.76  64.71  313.80  62.90  -11.04  90.24  
1 1 1 1   12  22 o 4  211.43  37.08  1522.14   433.71   1522.14  433.71   0.00      0.00     211.43  37.08  ?       ?      0.00    37.08  
1 1 1 1   12  23 o 11 111.37  23.06  395.47    142.57   395.47   142.57   0.00      0.00     111.37  23.06  ?       ?      0.00    23.06  
1 1 1 1   12  24 o 16 88.67   22.63  255.48    115.59   255.48   115.59   0.00      0.00     88.67   22.63  ?       ?      0.00    22.63  
1 1 1 1   12  25 o 7  53.10   21.28  56.02     98.60    56.02    98.60    0.00      0.00     53.10   21.28  ?       ?      0.00    21.28  
1 1 1 1   12  26 o 13 192.90  41.64  1556.98   447.60   1556.98  447.60   0.00      0.00     192.90  41.64  ?       ?      0.00    41.64  
1 1 1 1   12  27 o 4  94.66   24.65  314.67    135.25   314.67   135.25   0.00      0.00     94.66   24.65  ?       ?      0.00    24.65  
1 1 1 1   12  28 o 8  60.92   23.08  113.50    110.83   113.50   110.83   0.00      0.00     60.92   23.08  ?       ?      0.00    23.08  
1 1 1 1   12  29 o 5  74.25   21.65  196.91    97.96    191.90   123.13   205.55    161.69   72.01   24.70  73.40   27.86  -1.39   37.23  
1 1 1 1   13  0  o 13 345.57  36.77  3576.29   718.25   0.00     0.00     3576.29   718.25   ?       ?      345.57  36.77  0.00    36.77  
1 1 1 1   13  1  o 11 340.55  27.38  3409.23   530.68   3776.71  967.19   3250.95   634.75   349.75  49.56  330.42  33.95  19.33   60.07  
1 1 1 1   13  2  o 6  221.30  18.88  1427.80   237.56   1437.51  304.50   1412.69   379.73   220.93  24.42  217.23  31.36  3.70    39.74  
1 1 1 1   13  3  o 1  281.29  19.44  2302.75   311.92   2220.66  443.62   2383.01   438.65   274.02  28.62  284.35  27.20  -10.33  39.49  
1 1 1 1   13  4  o 4  495.47  44.31  7444.69   1247.06  8059.73  2151.81  7133.66   1530.23  489.06  79.36  476.81  57.04  12.25   97.73  
1 1 1 1   13  5  o 17 437.13  46.97  5857.50   1160.22  6023.15  1640.75  5691.83   1640.85  428.51  69.05  414.50  71.54  14.00   99.43  
1 1 1 1   13  6  o 1  595.51  50.43  10963.97  1707.87  10401.41 2948.59  11247.99  2095.09  528.27  100.91 592.14  62.58  -63.88  118.74 
1 1 1 1   13  7  o 9  121.52  20.70  440.90    139.24   440.90   139.24   0.00      0.00     121.52  20.70  ?       ?      0.00    20.70  
1 1 1 1   13  8  o 13 380.46  43.34  4458.31   929.64   0.00     0.00     4458.31   929.64   ?       ?      380.46  43.34  0.00    43.34  
1 1 1 1   13  9  o 16 162.95  17.63  779.35    162.32   834.54   229.87   724.48    229.23   166.99  24.72  154.83  26.76  12.16   36.43  
1 1 1 1   13  10 o 9  81.13   18.82  199.14    85.97    193.75   88.62    285.20    354.24   79.99   19.48  109.09  41.27  -29.10  45.64  
1 1 1 1   13  11 o 16 44.34   17.77  27.86     68.77    27.86    68.77    0.00      0.00     44.34   17.77  ?       ?      0.00    17.77  
1 1 1 1   13  12 o 16 170.84  24.40  876.51    232.49   972.25   270.20   603.55    456.25   179.22  27.11  140.15  47.56  39.08   54.74  
1 1 1 1   13  13 o 13 255.43  40.84  2056.08   578.65   2056.08  578.65   0.00      0.00     255.43  40.84  ?       ?      0.00    40.84  
1 1 1 1   13  14 o 19 214.70  33.92  1420.65   404.24   1420.65  404.24   0.00      0.00     214.70  33.92  ?       ?      0.00    33.92  
1 1 1 1   13  15 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   13  16 o 18 160.44  28.09  788.05    249.28   788.05   249.28   0.00      0.00     160.44  28.09  ?       ?      0.00    28.09  
1 1 1 1   13  17 o 17 224.19  36.70  1590.47   456.00   1590.47  456.00   0.00      0.00     224.19  36.70  ?       ?      0.00    36.70  
1 1 1 1   13  18 o 4  325.04  61.57  3952.18   1106.76  3952.18  1106.76  0.00      0.00     325.04  61.57  ?       ?      0.00    61.57  
1 1 1 1   13  19 o 2  287.96  54.32  3080.73   864.96   3080.73  864.96   0.00      0.00     287.96  54.32  ?       ?      0.00    54.32  
1 1 1 1   13  20 o 13 203.56  35.35  1379.73   398.11   1379.73  398.11   0.00      0.00     203.56  35.35  ?       ?      0.00    35.35  
1 1 1 1   13  21 o 8  152.74  27.52  752.32    232.40   752.32   232.40   0.00      0.00     152.74  27.52  ?       ?      0.00    27.52  
1 1 1 1   13  22 o 9  258.42  57.37  2944.10   828.98   2944.10  828.98   0.00      0.00     258.42  57.37  ?       ?      0.00    57.37  
1 1 1 1   13  23 o 15 178.66  33.89  1135.65   334.90   1135.65  334.90   0.00      0.00     178.66  33.89  ?       ?      0.00    33.89  
1 1 1 1   13  24 o 10 89.49   20.08  259.14    100.60   247.52   126.16   279.43    166.73   85.73   24.44  89.56   28.68  -3.83   37.68  
1 1 1 1   13  25 o 13 128.76  18.82  528.01    135.03   465.50   174.77   620.57    212.68   115.02  26.94  131.55  28.95  -16.53  39.55  
1 1 1 1   13  26 o 6  81.27   20.82  222.44    97.59    195.96   117.66   280.79    174.67   75.31   24.09  86.67   29.42  -11.37  38.03  
1 1 1 1   13  27 o 11 67.93   20.97  157.95    89.94    154.99   114.84   162.64    144.64   67.33   23.81  69.26   26.33  -1.93   35.50  
1 1 1 1   13  28 o 6  66.35   21.76  155.43    95.64    180.45   119.28   110.40    160.04   70.15   24.30  62.68   26.32  7.47    35.82  
1 1 1 1   14  0  o 10 440.13  76.73  6696.28   1868.24  0.00     0.00     6696.28   1868.24  ?       ?      440.13  76.73  0.00    76.73  
1 1 1 1   14  1  o 8  217.83  18.09  1385.88   224.13   1387.34  322.04   1384.51   312.14   215.84  26.55  215.86  25.69  -0.02   36.95  
1 1 1 1   14  2  o 17 426.54  34.55  5465.03   838.75   5154.73  1434.94  5626.07   1033.73  392.55  66.02  427.96  42.64  -35.42  78.59  
1 1 1 1   14  3  o 10 650.46  51.96  13350.50  1924.22  13339.82 2721.94  13361.18  2720.58  616.34  78.73  617.02  78.59  -0.68   111.24 
1 1 1 1   14  4  o 13 149.03  17.11  652.42    143.70   739.76   200.42   560.01    206.15   157.53  22.83  135.57  27.43  21.96   35.69  
1 1 1 1   14  5  o 5  130.88  14.81  501.84    109.31   518.88   156.55   485.63    152.69   131.72  21.44  127.28  21.67  4.44    30.49  
1 1 1 1   14  6  o 13 372.69  35.41  4211.09   748.56   4929.40  1267.11  3826.00   927.77   386.67  58.94  347.78  47.73  38.89   75.84  
1 1 1 1   14  7  x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   14  8  o 13 113.13  15.69  377.89    99.19    363.65   138.95   392.69    141.64   109.46  22.85  113.92  22.46  -4.46   32.04  
1 1 1 1   14  9  o 5  128.64  16.66  488.07    120.13   552.02   170.22   424.62    169.56   135.55  22.68  117.86  25.78  17.68   34.33  
1 1 1 1   14  10 o 12 132.74  17.23  520.07    128.20   622.80   182.39   419.75    180.24   144.13  22.80  116.91  27.35  27.22   35.60  
1 1 1 1   14  11 o 12 32.54   15.59  -117.41   83.39    -185.68  119.82   -53.28    116.13   37.94   18.31  46.44   20.87  -8.50   27.76  
1 1 1 1   14  12 o 9  366.05  27.87  3995.65   581.27   3436.07  949.04   4331.60   735.34   324.28  52.79  377.67  34.29  -53.38  62.95  
1 1 1 1   14  13 o 16 250.93  25.36  1878.51   360.27   2002.21  563.77   1793.13   468.39   252.33  40.27  241.17  34.84  11.16   53.25  
1 1 1 1   14  14 o 4  265.68  28.49  2133.67   427.77   2056.13  602.37   2212.55   607.58   253.01  43.01  263.55  41.53  -10.53  59.79  
1 1 1 1   14  15 o 17 242.88  26.68  1788.48   365.86   1884.01  515.39   1691.43   519.45   242.96  38.21  228.18  41.17  14.78   56.17  
1 1 1 1   14  16 o 13 89.13   18.26  241.95    90.28    233.92   121.32   251.92    135.13   86.93   23.68  90.09   25.16  -3.16   34.55  
1 1 1 1   14  17 o 3  305.69  35.45  3023.33   610.56   3226.94  862.33   2818.66   864.58   297.67  52.38  272.20  57.15  25.47   77.52  
1 1 1 1   14  18 o 2  232.28  26.42  1681.64   346.01   1806.40  487.55   1555.04   491.14   231.76  37.96  211.33  41.96  20.42   56.58  
1 1 1 1   14  19 o 4  96.15   17.08  282.27    90.80    258.23   121.40   312.80    136.80   90.18   23.29  98.98   24.26  -8.80   33.63  
1 1 1 1   14  20 o 17 118.69  17.82  431.16    117.69   456.04   156.66   398.94    178.31   119.53  23.67  109.64  28.18  9.89    36.80  
1 1 1 1   14  21 o 4  214.27  25.56  1482.47   308.16   1538.74  430.53   1423.36   441.27   205.77  37.84  194.25  40.87  11.51   55.70  
1 1 1 1   14  22 o 17 247.13  31.60  2131.11   438.02   2281.33  615.30   1976.76   623.71   231.21  47.93  206.26  52.54  24.96   71.12  
1 1 1 1   14  23 o 4  68.40   21.31  151.05    92.67    167.65   118.33   124.72    149.02   71.96   24.22  67.84   26.48  4.12    35.89  
1 1 1 1   14  24 o 5  47.19   19.64  31.35     88.03    27.49    109.48   38.40     148.05   50.60   21.53  57.62   24.79  -7.02   32.83  
1 1 1 1   14  25 o 4  115.38  20.39  441.36    130.14   446.42   170.73   434.34    201.06   110.44  27.13  104.96  31.13  5.48    41.30  
1 1 1 1   14  26 o 9  88.11   30.55  319.21    188.59   0.00     0.00     319.21    188.59   ?       ?      88.11   30.55  0.00    30.55  
1 1 1 1   14  27 o 8  70.79   28.60  185.05    179.56   0.00     0.00     185.05    179.56   ?       ?      70.79   28.60  0.00    28.60  
1 1 1 1   15  0  o 4  47.21   22.97  -346.99   198.94   -4514.64 1061.22  -195.19   202.53   ?       ?      54.95   25.72  0.00    25.72  
1 1 1 1   15  1  o 5  386.99  27.80  4422.33   613.41   12409.49 1183.40  1487.88   717.30   646.66  31.98  213.23  57.36  433.42  65.67  
1 1 1 1   15  2  o 10 666.90  45.33  13644.37  1725.16  21032.91 2518.72  7114.89   2367.77  817.93  53.94  432.00  97.76  385.93  111.66 
1 1 1 1   15  3  o 10 600.61  39.16  10908.24  1342.86  17644.32 1988.18  5257.40   1821.00  757.40  45.94  380.42  85.47  376.98  97.04  
1 1 1 1   15  4  o 9  237.76  38.14  1737.31   503.00   0.00     0.00     1737.31   503.00   ?       ?      237.76  38.14  0.00    38.14  
1 1 1 1   15  5  o 2  580.14  67.32  11254.70  2200.49  10852.19 3111.39  11657.50  3112.53  515.76  108.53 542.37  103.75 -26.60  150.14 
1 1 1 1   15  6  o 2  247.68  39.32  1896.30   540.35   1896.30  540.35   0.00      0.00     247.68  39.32  ?       ?      0.00    39.32  
1 1 1 1   15  7  o 2  205.61  29.53  1276.09   338.55   0.00     0.00     1276.09   338.55   ?       ?      205.61  29.53  0.00    29.53  
1 1 1 1   15  8  o 16 195.89  16.39  1120.86   182.67   1081.83  257.33   1160.50   259.34   190.54  24.06  197.66  23.30  -7.12   33.50  
1 1 1 1   15  9  o 18 211.08  23.77  1325.45   283.03   1579.52  422.04   1117.79   381.56   227.10  33.37  189.22  36.45  37.88   49.41  
1 1 1 1   15  10 o 17 357.21  33.56  3889.18   680.05   4145.86  1127.58  3742.44   852.56   350.06  58.15  343.20  44.31  6.86    73.11  
1 1 1 1   15  11 o 17 275.75  31.15  2323.59   484.53   2800.73  685.27   1846.57   685.19   296.63  41.37  232.98  52.49  63.64   66.83  
1 1 1 1   15  12 o 17 303.80  33.85  2868.64   580.25   3121.20  820.06   2615.40   821.15   305.72  48.33  274.70  54.00  31.02   72.47  
1 1 1 1   15  13 o 9  193.38  20.23  1116.65   221.29   1019.97  322.39   1202.78   304.29   179.46  32.49  197.67  27.56  -18.21  42.61  
1 1 1 1   15  14 o 2  59.09   20.18  96.63     82.17    138.12   104.45   29.26     133.09   69.00   22.74  57.71   24.10  11.29   33.13  
1 1 1 1   15  15 o 12 125.32  17.35  471.87    121.45   516.94   165.02   418.60    179.40   129.23  23.09  114.49  27.62  14.74   36.00  
1 1 1 1   15  16 o 17 214.74  23.88  1419.08   289.37   1388.68  406.54   1450.30   411.98   204.21  35.99  209.09  35.60  -4.87   50.62  
1 1 1 1   15  17 o 6  129.88  17.59  510.65    127.75   519.32   172.90   500.22    189.58   128.13  24.40  124.36  27.30  3.77    36.62  
1 1 1 1   15  18 o 8  69.47   19.22  150.54    79.24    148.27   102.15   153.98    125.56   69.69   22.46  72.13   24.93  -2.44   33.56  
1 1 1 1   15  19 o 4  87.55   18.43  240.28    89.69    299.77   118.17   159.42    137.76   96.69   21.81  73.22   26.05  23.47   33.98  
1 1 1 1   15  20 o 1  253.44  31.88  2228.54   453.55   2331.30  638.60   2123.94   644.26   233.62  49.17  217.00  52.33  16.62   71.81  
1 1 1 1   15  21 o 12 129.66  18.69  528.44    135.08   529.78   178.94   526.68    205.98   125.23  25.75  121.84  29.72  3.39    39.32  
1 1 1 1   15  22 o 15 128.74  19.36  529.66    138.64   535.37   182.53   521.87    213.16   124.29  26.40  118.73  30.96  5.56    40.69  
1 1 1 1   15  23 o 15 179.96  24.23  1100.44   243.92   1232.33  335.53   952.62    355.21   178.06  34.07  145.68  40.84  32.38   53.18  
1 1 1 1   15  24 o 2  144.59  20.67  696.61    166.67   677.47   222.98   720.85    250.90   132.81  29.96  133.23  32.98  -0.42   44.56  
1 1 1 1   15  25 o 18 124.20  20.96  529.31    144.13   570.09   184.44   465.35    231.00   122.60  26.94  101.06  33.84  21.54   43.25  
1 1 1 1   16  0  o 5  119.30  47.13  319.75    477.03   0.00     0.00     319.75    477.03   ?       ?      119.30  47.13  0.00    47.13  
1 1 1 1   16  1  o 9  336.88  33.43  3468.17   637.90   3084.27  1259.88  3600.51   739.72   283.55  75.90  339.97  38.58  -56.42  85.14  
1 1 1 1   16  2  o 4  239.41  24.30  1709.77   329.37   2484.47  827.00   1563.73   359.07   270.93  55.05  227.41  28.10  43.52   61.81  
1 1 1 1   16  3  o 2  502.50  42.08  7944.12   1202.81  7781.40  1706.28  8104.84   1695.83  470.80  64.85  483.48  62.57  -12.68  90.11  
1 1 1 1   16  4  o 14 275.49  26.04  2273.95   406.94   2359.32  654.39   2220.12   519.64   271.10  43.52  268.02  34.58  3.08    55.58  
1 1 1 1   16  5  o 15 273.45  29.23  2268.28   451.72   2268.49  637.22   2268.08   640.44   265.41  43.32  265.22  43.58  0.19    61.44  
1 1 1 1   16  6  x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   16  7  o 13 132.62  24.53  538.43    179.85   0.00     0.00     538.43    179.85   ?       ?      132.62  24.53  0.00    24.53  
1 1 1 1   16  8  o 4  175.08  29.25  950.29    283.65   0.00     0.00     950.29    283.65   ?       ?      175.08  29.25  0.00    29.25  
1 1 1 1   16  9  o 9  372.90  78.10  5794.45   1618.31  0.00     0.00     5794.45   1618.31  ?       ?      372.90  78.10  0.00    78.10  
1 1 1 1   16  10 o 3  154.40  26.62  739.46    227.41   0.00     0.00     739.46    227.41   ?       ?      154.40  26.62  0.00    26.62  
1 1 1 1   16  11 o 18 297.60  55.27  3241.39   909.44   0.00     0.00     3241.39   909.44   ?       ?      297.60  55.27  0.00    55.27  
1 1 1 1   16  12 o 2  309.36  41.58  3217.33   719.81   0.00     0.00     3217.33   719.81   ?       ?      309.36  41.58  0.00    41.58  
1 1 1 1   16  13 o 15 217.40  25.24  1460.53   309.11   1611.30  432.33   1302.85   442.13   221.55  35.17  194.55  40.89  27.00   53.93  
1 1 1 1   16  14 o 12 114.86  18.40  402.03    117.22   444.89   158.90   350.87    173.61   118.75  24.13  104.02  28.32  14.73   37.21  
1 1 1 1   16  15 o 13 64.71   20.06  127.11    82.22    123.45   100.67   134.43    142.50   65.34   22.34  71.06   26.32  -5.72   34.52  
1 1 1 1   16  16 o 12 135.53  18.53  562.82    140.38   614.69   185.31   492.95    215.07   138.89  24.11  120.47  30.94  18.42   39.23  
1 1 1 1   16  17 o 3  106.07  18.16  349.17    106.62   418.48   142.38   260.69    160.88   114.27  22.51  88.76   28.14  25.52   36.03  
1 1 1 1   16  18 o 5  41.31   17.92  -2.58     78.63    28.52    96.91    -62.53    134.54   49.35   20.58  47.91   21.90  1.44    30.05  
1 1 1 1   16  19 o 19 160.84  20.90  822.97    188.45   952.40   259.99   679.68    273.55   167.08  28.10  134.29  35.10  32.78   44.96  
1 1 1 1   16  20 o 1  115.63  18.57  424.21    119.11   513.18   158.42   308.52    180.66   124.45  23.02  92.51   29.87  31.94   37.71  
1 1 1 1   16  21 o 15 77.69   19.68  198.98    87.86    178.90   110.21   234.00    145.56   72.94   23.31  81.55   26.85  -8.61   35.55  
1 1 1 1   16  22 o 4  109.86  19.35  396.07    117.57   332.28   148.23   504.28    193.05   95.47   26.24  115.53  29.12  -20.06  39.20  
1 1 1 1   16  23 o 16 84.01   23.98  256.46    121.32   256.46   121.32   0.00      0.00     84.01   23.98  ?       ?      0.00    23.98  
1 1 1 1   16  24 o 14 51.12   20.07  70.19     86.05    50.48    101.10   122.01    163.94   50.29   21.00  64.20   26.77  -13.90  34.02  
1 1 1 1   17  0  o 3  214.76  25.49  1400.72   308.16   1946.94  937.83   1334.61   326.28   221.36  67.60  208.43  27.97  12.93   73.16  
1 1 1 1   17  1  o 9  190.18  26.24  1105.71   278.86   0.00     0.00     1105.71   278.86   ?       ?      190.18  26.24  0.00    26.24  
1 1 1 1   17  2  o 12 294.65  65.71  3321.94   1083.09  0.00     0.00     3321.94   1083.09  ?       ?      294.65  65.71  0.00    65.71  
1 1 1 1   17  3  o 1  199.33  27.56  1222.13   306.94   1223.38  347.14   1217.65   657.07   197.39  31.71  182.07  56.75  15.32   65.01  
1 1 1 1   17  4  o 13 274.73  47.26  2567.23   718.54   2567.23  718.54   0.00      0.00     274.73  47.26  ?       ?      0.00    47.26  
1 1 1 1   17  5  o 1  264.37  45.26  2362.20   662.25   2362.20  662.25   0.00      0.00     264.37  45.26  ?       ?      0.00    45.26  
1 1 1 1   17  6  x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   17  7  o 9  214.38  23.65  1397.21   286.28   1470.86  401.91   1321.36   407.87   214.16  33.81  200.95  36.71  13.21   49.91  
1 1 1 1   17  8  o 7  109.43  14.44  355.98    88.48    377.22   117.39   328.05    134.62   111.37  19.05  102.46  23.40  8.92    30.17  
1 1 1 1   17  9  o 10 175.66  19.23  927.99    190.75   902.43   264.98   955.49    274.79   168.91  28.33  173.80  28.53  -4.88   40.21  
1 1 1 1   17  10 o 15 94.48   14.40  267.48    75.63    302.17   98.35    217.28    118.31   99.53   17.87  83.30   23.64  16.23   29.64  
1 1 1 1   17  11 f 0  120.23  15.43  432.96    104.01   477.09   143.11   383.54    151.43   124.34  20.78  109.78  24.64  14.56   32.23  
1 1 1 1   17  12 o 17 284.28  32.83  2667.19   525.93   2574.95  738.18   2762.27   749.49   256.11  51.99  267.32  50.69  -11.21  72.61  
1 1 1 1   17  13 o 6  127.62  18.22  498.42    129.70   512.60   171.50   479.49    198.24   126.51  24.50  119.92  29.10  6.58    38.04  
1 1 1 1   17  14 f 0  164.95  33.11  938.67    302.57   0.00     0.00     938.67    302.57   ?       ?      164.95  33.11  0.00    33.11  
1 1 1 1   17  15 o 7  118.69  29.91  485.00    203.73   0.00     0.00     485.00    203.73   ?       ?      118.69  29.91  0.00    29.91  
1 1 1 1   17  16 f 0  123.16  30.31  530.95    212.87   0.00     0.00     530.95    212.87   ?       ?      123.16  30.31  0.00    30.31  
1 1 1 1   17  17 o 10 80.01   27.83  210.61    156.54   0.00     0.00     210.61    156.54   ?       ?      80.01   27.83  0.00    27.83  
1 1 1 1   17  18 o 19 52.57   23.39  -13.14    142.00   0.00     0.00     -13.14    142.00   ?       ?      52.57   23.39  0.00    23.39  
1 1 1 1   17  19 o 11 69.75   26.81  146.64    151.07   0.00     0.00     146.64    151.07   ?       ?      69.75   26.81  0.00    26.81  
1 1 1 1   17  20 o 13 148.65  34.32  889.51    286.93   0.00     0.00     889.51    286.93   ?       ?      148.65  34.32  0.00    34.32  
1 1 1 1   17  21 o 9  152.13  37.47  1029.86   325.09   0.00     0.00     1029.86   325.09   ?       ?      152.13  37.47  0.00    37.47  
1 1 1 1   17  22 o 3  113.13  31.14  533.53    208.63   0.00     0.00     533.53    208.63   ?       ?      113.13  31.14  0.00    31.14  
1 1 1 1   18  0  f 0  106.55  22.88  354.29    135.75   929.92   961.07   342.57    137.13   155.85  64.89  104.57  23.42  51.28   68.99  
1 1 1 1   18  1  o 16 101.66  21.42  320.74    121.08   -13.64   866.72   327.39    122.28   119.54  54.98  102.73  21.43  16.81   59.01  
1 1 1 1   18  2  o 4  240.27  28.71  1815.14   388.12   2558.52  1023.01  1690.16   419.48   236.50  70.25  228.78  32.88  7.73    77.56  
1 1 1 1   18  3  o 12 192.72  27.21  1165.61   292.61   867.73   883.56   1202.30   310.11   150.65  62.43  194.96  28.56  -44.31  68.65  
1 1 1 1   18  4  o 6  174.17  17.96  909.65    176.99   892.23   255.52   925.71    245.40   167.92  27.45  172.10  25.62  -4.17   37.55  
1 1 1 1   18  5  x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   18  6  o 19 193.00  21.25  1137.32   231.51   1337.97  342.70   968.88    313.99   203.70  30.22  170.92  33.20  32.79   44.89  
1 1 1 1   18  7  o 16 139.52  16.89  585.93    132.54   649.85   180.77   511.62    194.90   144.59  22.51  125.56  27.78  19.03   35.75  
1 1 1 1   18  8  o 19 75.28   17.63  175.67    74.86    178.50   75.25    -100.06   742.54   75.89   17.61  105.85  49.44  -29.96  52.48  
1 1 1 1   18  9  o 19 159.59  24.75  807.19    219.44   765.12   229.07   1276.39   764.97   154.04  26.88  162.55  60.83  -8.51   66.50  
1 1 1 1   18  10 o 4  91.95   19.26  264.46    98.40    264.46   98.40    0.00      0.00     91.95   19.26  ?       ?      0.00    19.26  
1 1 1 1   18  11 o 19 116.32  21.19  426.61    136.31   426.61   136.31   0.00      0.00     116.32  21.19  ?       ?      0.00    21.19  
1 1 1 1   18  12 o 5  134.52  24.79  587.70    184.38   578.30   187.74   842.96    978.31   132.96  25.52  131.06  59.57  1.90    64.81  
1 1 1 1   18  13 o 9  166.87  30.72  957.90    283.47   957.90   283.47   0.00      0.00     166.87  30.72  ?       ?      0.00    30.72  
1 1 1 1   18  14 o 16 224.18  49.65  2201.86   622.06   2201.86  622.06   0.00      0.00     224.18  49.65  ?       ?      0.00    49.65  
1 1 1 1   18  15 o 7  84.13   23.91  237.28    120.90   237.28   120.90   0.00      0.00     84.13   23.91  ?       ?      0.00    23.91  
1 1 1 1   18  16 o 1  66.98   21.38  144.84    92.73    111.26   111.51   220.13    166.97   62.34   23.25  80.48   28.68  -18.14  36.92  
1 1 1 1   18  17 o 9  123.72  20.31  499.44    139.23   538.63   178.83   439.14    221.85   124.07  25.94  105.49  32.99  18.58   41.97  
1 1 1 1   18  18 o 12 163.94  22.58  907.42    206.86   1024.69  287.56   781.65    297.80   163.11  31.85  134.00  37.33  29.11   49.07  
1 1 1 1   18  19 o 6  42.04   18.19  8.49      80.69    8.52     93.84    8.40      158.02   44.73   19.49  54.89   24.53  -10.16  31.33  
1 1 1 1   19  0  o 19 65.16   21.70  124.73    95.06    -776.37  1073.08  131.86    95.43    107.62  52.58  66.52   21.73  41.10   56.90  
1 1 1 1   19  1  f 0  96.40   23.56  296.19    129.25   1728.57  1096.95  276.03    130.15   175.54  70.76  92.92   24.17  82.62   74.77  
1 1 1 1   19  2  o 7  99.52   23.32  315.39    130.90   597.09   1008.06  310.56    132.02   134.95  60.99  98.64   23.63  36.31   65.41  
1 1 1 1   19  3  o 12 116.57  23.66  431.81    152.92   744.68   1028.33  424.73    154.64   138.61  62.21  115.39  24.12  23.22   66.72  
1 1 1 1   19  4  x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   19  5  o 3  99.26   23.68  316.67    133.02   0.00     0.00     316.67    133.02   ?       ?      99.26   23.68  0.00    23.68  
1 1 1 1   19  6  o 9  107.10  14.57  345.43    87.25    324.83   112.38   376.66    138.41   101.84  19.94  108.57  22.93  -6.73   30.38  
1 1 1 1   19  7  o 11 206.99  21.93  1335.55   256.60   1339.36  376.77   1332.26   350.44   196.47  34.67  198.60  31.81  -2.13   47.05  
1 1 1 1   19  8  o 12 153.43  17.01  716.13    147.34   675.65   205.27   759.15    211.63   143.99  25.78  153.40  24.88  -9.41   35.83  
1 1 1 1   19  9  o 16 186.93  20.74  1090.90   218.80   1107.48  313.58   1075.18   305.43   179.51  31.58  177.20  31.16  2.31    44.37  
1 1 1 1   19  10 o 4  44.74   16.30  51.32     54.32    47.97    63.54    60.41     104.69   45.77   17.44  55.00   21.97  -9.23   28.05  
1 1 1 1   19  11 o 13 43.34   17.57  29.61     68.12    20.40    80.64    52.57     127.28   44.74   18.73  57.29   23.71  -12.55  30.21  
1 1 1 1   19  12 o 14 52.46   19.32  73.43     76.61    78.87    88.93    57.78     150.87   55.06   20.71  60.85   25.55  -5.78   32.89  
1 1 1 1   19  13 o 4  161.84  20.46  839.57    185.86   801.48   248.97   887.52    279.32   149.61  30.03  155.09  32.42  -5.49   44.19  
1 1 1 1   19  14 o 12 88.47   19.85  256.98    98.31    279.19   119.72   211.01    172.25   90.57   22.99  78.72   28.98  11.84   36.99  
1 1 1 1   19  15 o 5  70.30   20.42  164.63    87.24    162.11   102.52   171.23    166.14   69.58   22.51  72.92   28.10  -3.34   36.00  
1 1 1 1   19  16 o 6  43.28   18.64  10.86     83.98    -25.27   95.47    134.46    176.60   41.77   18.83  68.83   28.15  -27.06  33.87  
1 1 1 1   20  0  o 17 190.32  33.91  1252.20   356.92   837.07   1444.68  1279.19   368.34   134.56  64.59  191.59  34.77  -57.03  73.35  
1 1 1 1   20  1  o 2  173.76  31.77  1030.28   305.25   0.00     0.00     1030.28   305.25   ?       ?      173.76  31.77  0.00    31.77  
1 1 1 1   20  2  o 5  83.78   23.52  227.82    117.70   568.92   1247.96  224.76    118.23   126.10  60.40  83.22   23.64  42.88   64.86  
1 1 1 1   20  3  o 18 45.53   19.87  -6.62     97.98    -197.55  1266.12  -5.47     98.27    112.81  55.53  45.72   19.93  67.09   58.99  
1 1 1 1   20  4  x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 1   20  5  o 10 111.37  23.76  406.34    147.27   0.00     0.00     406.34    147.27   ?       ?      111.37  23.76  0.00    23.76  
1 1 1 1   20  6  o 6  132.78  16.04  538.84    119.79   541.13   162.53   536.11    177.23   129.34  22.72  127.16  25.17  2.18    33.91  
1 1 1 1   20  7  o 8  93.83   14.62  269.51    76.17    261.86   95.10    283.19    127.21   90.71   18.88  92.19   23.86  -1.48   30.42  
1 1 1 1   20  8  o 5  105.48  15.18  341.58    89.30    385.58   114.42   273.02    142.82   110.46  18.71  89.37   26.17  21.09   32.17  
1 1 1 1   20  9  o 11 87.10   14.97  234.76    72.18    214.99   88.08    275.18    125.93   81.61   19.13  90.29   23.92  -8.68   30.63  
1 1 1 1   20  10 o 1  97.07   15.38  292.18    82.84    326.65   103.83   231.81    137.42   101.15  18.57  82.18   26.00  18.97   31.95  
1 1 1 2   -19 0  x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   -19 1  o 6  161.07  26.29  831.45    234.69   836.04   243.06   768.25    901.94   160.90  27.29  137.11  60.05  23.79   65.96  
1 1 1 2   -19 2  o 7  60.67   18.64  111.63    71.19    111.63   71.19    0.00      0.00     60.67   18.64  ?       ?      0.00    18.64  
1 1 1 2   -19 3  o 14 124.27  21.56  483.06    148.21   471.48   150.32   886.06    887.08   122.44  22.20  141.32  60.73  -18.87  64.66  
1 1 1 2   -19 4  o 4  108.26  19.91  364.69    119.19   363.82   120.44   405.86    826.67   108.03  20.16  123.02  55.45  -15.00  59.00  
1 1 1 2   -19 5  o 1  105.48  19.91  346.67    116.14   351.01   117.13   92.50     895.66   106.14  19.96  115.76  54.14  -9.62   57.70  
1 1 1 2   -19 6  o 7  114.82  19.26  407.28    122.47   397.93   123.73   859.07    860.14   113.27  19.75  140.13  60.00  -26.85  63.17  
1 1 1 2   -18 0  x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   -18 1  o 15 148.95  21.94  681.67    181.96   681.67   181.96   0.00      0.00     148.95  21.94  ?       ?      0.00    21.94  
1 1 1 2   -18 2  f 0  80.35   18.08  198.92    81.40    196.13   82.01    385.75    671.20   79.74   18.30  124.09  53.06  -44.35  56.13  
1 1 1 2   -18 3  o 7  215.95  31.27  1498.93   376.38   1513.81  427.12   1447.21   796.20   213.37  36.16  181.84  62.79  31.53   72.46  
1 1 1 2   -18 4  o 14 139.00  19.40  586.63    150.60   593.27   154.26   451.90    695.07   139.64  19.80  127.83  54.31  11.81   57.81  
1 1 1 2   -18 5  f 0  251.42  37.53  2116.17   525.17   1918.10  636.25   2539.57   930.26   226.73  50.21  240.82  65.55  -14.09  82.57  
1 1 1 2   -18 6  f 0  99.49   36.52  296.61    273.28   412.16   294.29   -426.87   736.38   111.85  38.19  99.34   47.25  12.52   60.75  
1 1 1 2   -18 7  o 18 93.89   45.11  -559.54   708.70   0.00     0.00     -559.54   708.70   ?       ?      93.89   45.11  0.00    45.11  
1 1 1 2   -18 8  o 2  154.26  59.93  1016.95   760.63   0.00     0.00     1016.95   760.63   ?       ?      154.26  59.93  0.00    59.93  
1 1 1 2   -18 9  o 9  97.44   35.80  288.94    262.67   347.39   282.18   -90.35    718.79   104.06  37.26  106.04  49.23  -1.98   61.74  
1 1 1 2   -18 10 o 14 91.13   33.85  242.15    236.04   267.61   249.51   25.23     728.22   94.51   34.86  109.83  50.48  -15.33  61.34  
1 1 1 2   -17 0  o 9  124.94  40.38  508.57    330.05   508.57   330.05   0.00      0.00     124.94  40.38  ?       ?      0.00    40.38  
1 1 1 2   -17 1  o 4  92.62   17.68  260.18    90.56    269.61   91.76    -93.52    561.78   94.35   17.59  100.93  45.58  -6.59   48.86  
1 1 1 2   -17 2  o 2  183.67  20.65  1012.69   214.00   967.20   226.75   1383.57   647.44   178.69  22.61  192.80  55.50  -14.11  59.93  
1 1 1 2   -17 3  o 12 258.96  23.62  2026.79   347.26   1856.12  389.41   2689.67   767.45   245.17  28.18  276.96  50.11  -31.79  57.49  
1 1 1 2   -17 4  o 17 161.66  34.27  848.11    308.16   812.15   351.04   968.90    643.40   155.61  39.30  161.83  56.41  -6.22   68.75  
1 1 1 2   -17 5  o 13 87.19   33.62  182.53    237.96   129.59   259.49   462.48    596.68   84.47   34.28  128.86  52.10  -44.39  62.37  
1 1 1 2   -17 6  o 14 115.70  49.02  252.72    563.39   0.00     0.00     252.72    563.39   ?       ?      115.70  49.02  0.00    49.02  
1 1 1 2   -17 7  o 3  127.41  34.52  533.51    258.71   576.53   285.28   334.32    613.85   131.76  36.47  122.23  51.44  9.53    63.06  
1 1 1 2   -17 8  o 17 66.77   29.73  -51.13    229.99   -35.88   251.01   -130.92   574.15   70.77   31.31  99.06   45.26  -28.29  55.03  
1 1 1 2   -17 9  o 3  89.92   33.00  224.78    223.19   224.68   239.58   225.43    613.98   91.09   34.05  116.09  50.21  -25.00  60.67  
1 1 1 2   -17 10 o 17 118.83  50.23  321.62    589.43   0.00     0.00     321.62    589.43   ?       ?      118.83  50.23  0.00    50.23  
1 1 1 2   -17 11 o 12 133.19  54.88  562.55    677.49   0.00     0.00     562.55    677.49   ?       ?      133.19  54.88  0.00    54.88  
1 1 1 2   -17 12 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   -17 13 o 11 78.85   29.13  169.14    174.37   169.14   174.37   0.00      0.00     78.85   29.13  ?       ?      0.00    29.13  
1 1 1 2   -16 0  o 5  335.15  32.86  3450.10   624.03   3523.21  738.91   3268.25   1165.31  334.18  39.27  294.38  69.99  39.80   80.25  
1 1 1 2   -16 1  o 6  179.58  22.88  967.33    230.55   967.33   230.55   0.00      0.00     179.58  22.88  ?       ?      0.00    22.88  
1 1 1 2   -16 2  f 0  301.52  54.54  3106.28   909.34   3106.28  909.34   0.00      0.00     301.52  54.54  ?       ?      0.00    54.54  
1 1 1 2   -16 3  o 1  94.25   35.04  225.59    253.04   225.59   253.04   0.00      0.00     94.25   35.04  ?       ?      0.00    35.04  
1 1 1 2   -16 4  o 16 224.00  42.05  1627.03   520.94   1627.03  520.94   0.00      0.00     224.00  42.05  ?       ?      0.00    42.05  
1 1 1 2   -16 5  o 5  141.11  31.94  628.32    252.71   732.28   292.73   324.16    500.71   151.68  34.41  119.72  47.96  31.96   59.03  
1 1 1 2   -16 6  o 3  148.86  32.29  700.70    268.01   700.26   315.33   701.85    508.67   147.08  37.30  146.32  50.20  0.77    62.54  
1 1 1 2   -16 7  o 19 101.53  33.65  310.68    228.53   181.44   256.79   802.91    501.14   89.78   34.84  153.73  49.76  -63.95  60.75  
1 1 1 2   -16 8  o 5  156.67  31.87  778.20    276.88   873.05   321.30   504.58    545.73   164.70  35.06  131.85  50.89  32.85   61.80  
1 1 1 2   -16 9  o 11 100.30  32.94  307.58    219.21   285.01   242.62   407.93    511.51   98.77   34.63  123.43  48.79  -24.66  59.83  
1 1 1 2   -16 10 o 19 94.31   32.24  263.74    209.71   275.87   227.07   193.36    546.83   96.69   33.53  112.72  48.04  -16.03  58.58  
1 1 1 2   -16 11 o 3  38.23   16.28  1.53      62.72    -7.88    63.06    852.31    599.62   36.96   16.04  154.06  54.40  -117.10 56.72  
1 1 1 2   -16 12 o 14 65.94   25.93  85.64     143.86   82.96    148.79   123.97    563.51   66.33   26.28  109.36  47.69  -43.03  54.46  
1 1 1 2   -16 13 o 3  137.97  54.15  630.15    626.17   0.00     0.00     630.15    626.17   ?       ?      137.97  54.15  0.00    54.15  
1 1 1 2   -16 14 f 0  152.64  55.82  891.25    637.55   0.00     0.00     891.25    637.55   ?       ?      152.64  55.82  0.00    55.82  
1 1 1 2   -16 15 o 2  138.37  54.30  691.06    629.61   0.00     0.00     691.06    629.61   ?       ?      138.37  54.30  0.00    54.30  
1 1 1 2   -16 16 o 2  85.48   29.17  221.28    171.65   267.74   177.92   -402.86   652.16   92.09   29.64  93.93   44.62  -1.84   53.56  
1 1 1 2   -15 0  o 1  203.63  32.12  1258.60   363.05   1258.60  363.05   0.00      0.00     203.63  32.12  ?       ?      0.00    32.12  
1 1 1 2   -15 1  o 12 147.84  25.09  657.54    205.34   821.24   218.88   -543.34   592.86   165.99  23.64  92.57   43.53  73.42   49.54  
1 1 1 2   -15 2  x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   -15 3  o 6  121.39  47.46  323.85    479.33   0.00     0.00     323.85    479.33   ?       ?      121.39  47.46  0.00    47.46  
1 1 1 2   -15 4  o 2  224.91  40.37  1585.71   502.11   1585.71  502.11   0.00      0.00     224.91  40.37  ?       ?      0.00    40.37  
1 1 1 2   -15 5  o 15 137.69  31.71  589.06    245.48   510.26   284.91   816.10    483.61   127.87  36.82  159.05  48.54  -31.18  60.92  
1 1 1 2   -15 6  o 16 74.05   30.80  51.09     216.19   51.09    216.19   0.00      0.00     74.05   30.80  ?       ?      0.00    30.80  
1 1 1 2   -15 7  o 11 117.65  35.21  429.47    256.26   429.47   256.26   0.00      0.00     117.65  35.21  ?       ?      0.00    35.21  
1 1 1 2   -15 8  o 15 319.14  38.35  3179.74   688.54   3287.54  927.01   3047.10   1028.33  313.47  53.43  293.60  62.90  19.86   82.53  
1 1 1 2   -15 9  o 11 284.61  32.78  2488.42   525.76   2110.99  692.46   3002.17   807.89   251.61  49.70  302.35  48.16  -50.74  69.21  
1 1 1 2   -15 10 o 11 ?       ?      -680.18   160.21   -912.76  170.13   1141.59   476.15   ?       ?      185.19  45.19  0.00    45.19  
1 1 1 2   -15 11 o 3  182.01  26.18  1010.60   265.70   979.48   305.21   1108.00   539.96   177.06  31.17  178.85  50.43  -1.79   59.28  
1 1 1 2   -15 12 o 15 74.65   27.17  143.61    150.78   139.26   159.25   181.21    468.57   75.01   27.82  107.56  45.08  -32.56  52.97  
1 1 1 2   -15 13 o 7  204.62  28.90  1298.13   329.99   1297.49  396.56   1299.59   595.04   200.85  35.70  189.79  52.73  11.06   63.68  
1 1 1 2   -15 14 o 12 65.60   26.33  72.22     151.26   74.80    159.46   49.06     477.88   67.10   27.00  100.15  43.79  -33.05  51.45  
1 1 1 2   -15 15 o 11 128.96  27.29  524.72    195.71   567.74   212.18   279.40    506.63   133.79  28.50  113.88  47.24  19.91   55.17  
1 1 1 2   -15 16 o 7  103.35  44.25  151.23    467.87   0.00     0.00     151.23    467.87   ?       ?      103.35  44.25  0.00    44.25  
1 1 1 2   -15 17 o 12 96.78   41.17  141.39    400.21   0.00     0.00     141.39    400.21   ?       ?      96.78   41.17  0.00    41.17  
1 1 1 2   -15 18 o 3  132.26  46.95  625.79    447.11   0.00     0.00     625.79    447.11   ?       ?      132.26  46.95  0.00    46.95  
1 1 1 2   -14 0  o 7  369.56  41.67  4188.20   868.56   4188.20  868.56   0.00      0.00     369.56  41.67  ?       ?      0.00    41.67  
1 1 1 2   -14 1  o 12 260.56  44.22  2115.12   637.84   2115.12  637.84   0.00      0.00     260.56  44.22  ?       ?      0.00    44.22  
1 1 1 2   -14 2  o 1  370.97  40.62  4186.54   850.99   3859.43  1172.62  4550.47   1236.90  344.02  61.64  375.72  59.31  -31.71  85.54  
1 1 1 2   -14 3  o 15 264.97  53.92  2245.75   792.17   0.00     0.00     2245.75   792.17   ?       ?      264.97  53.92  0.00    53.92  
1 1 1 2   -14 4  o 17 369.68  66.20  4487.36   1353.36  0.00     0.00     4487.36   1353.36  ?       ?      369.68  66.20  0.00    66.20  
1 1 1 2   -14 5  o 4  551.85  108.14 11685.98  3303.38  0.00     0.00     11685.98  3303.38  ?       ?      551.85  108.14 0.00    108.14 
1 1 1 2   -14 6  o 11 155.28  31.06  734.72    267.20   1081.64  307.46   -335.94   540.12   189.79  29.15  94.70   43.50  95.09   52.36  
1 1 1 2   -14 7  o 13 346.37  38.78  3644.74   757.91   3588.54  1036.91  3709.21   1110.57  334.17  56.03  337.68  59.46  -3.50   81.70  
1 1 1 2   -14 8  o 11 151.44  28.53  697.78    238.93   747.75   273.37   536.09    491.75   156.07  31.60  137.73  49.20  18.33   58.47  
1 1 1 2   -14 9  o 6  200.99  36.19  1252.42   402.20   1252.42  402.20   0.00      0.00     200.99  36.19  ?       ?      0.00    36.19  
1 1 1 2   -14 10 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   -14 11 o 9  82.61   27.26  195.60    150.07   195.60   150.07   0.00      0.00     82.61   27.26  ?       ?      0.00    27.26  
1 1 1 2   -14 12 o 12 59.62   24.48  39.32     134.28   47.47    142.82   -22.73    394.14   62.06   25.34  90.93   39.77  -28.87  47.15  
1 1 1 2   -14 13 o 2  227.31  28.79  1575.34   367.22   1787.62  483.82   1286.86   564.00   238.37  36.52  194.37  50.20  44.00   62.08  
1 1 1 2   -14 14 o 9  215.19  28.07  1417.22   338.45   1649.44  443.23   1092.49   524.15   228.81  34.84  177.98  49.51  50.83   60.54  
1 1 1 2   -14 15 o 17 135.35  24.82  564.26    185.72   701.04   217.98   202.05    354.72   150.73  26.14  99.81   40.24  50.92   47.98  
1 1 1 2   -14 16 o 5  131.92  24.82  538.29    181.10   659.62   209.78   183.33    358.80   145.92  26.00  98.35   40.16  47.57   47.84  
1 1 1 2   -14 17 o 16 106.99  25.10  358.89    151.48   378.15   168.58   278.18    345.12   109.38  27.01  103.93  40.37  5.45    48.58  
1 1 1 2   -14 18 o 15 146.50  25.44  668.39    206.19   709.09   238.47   547.82    410.43   149.44  28.84  128.05  45.03  21.39   53.47  
1 1 1 2   -14 19 o 13 89.62   38.83  65.33     368.53   0.00     0.00     65.33     368.53   ?       ?      89.62   38.83  0.00    38.83  
1 1 1 2   -14 20 o 1  105.69  42.17  302.15    385.47   0.00     0.00     302.15    385.47   ?       ?      105.69  42.17  0.00    42.17  
1 1 1 2   -13 0  o 16 316.78  33.80  3002.55   605.19   2783.85  842.42   3235.80   869.98   297.38  51.19  322.45  48.50  -25.08  70.52  
1 1 1 2   -13 1  f 0  142.81  23.85  610.09    188.68   480.28   240.43   818.15    304.40   125.18  33.00  163.46  33.56  -38.28  47.07  
1 1 1 2   -13 2  o 12 438.09  75.70  6514.31   1834.91  0.00     0.00     6514.31   1834.91  ?       ?      438.09  75.70  0.00    75.70  
1 1 1 2   -13 3  o 12 178.38  32.08  967.32    316.47   967.32   316.47   0.00      0.00     178.38  32.08  ?       ?      0.00    32.08  
1 1 1 2   -13 4  o 17 358.80  58.99  4156.03   1172.84  4156.03  1172.84  0.00      0.00     358.80  58.99  ?       ?      0.00    58.99  
1 1 1 2   -13 5  f 0  223.62  28.18  1490.98   353.79   1434.44  459.32   1573.46   554.77   215.96  38.46  224.08  44.69  -8.13   58.96  
1 1 1 2   -13 6  o 14 254.77  30.31  1936.62   434.67   1813.87  572.92   2103.11   667.22   242.04  42.80  259.49  46.50  -17.45  63.20  
1 1 1 2   -13 7  o 9  75.04   35.62  -478.82   414.00   0.00     0.00     -478.82   414.00   ?       ?      75.04   35.62  0.00    35.62  
1 1 1 2   -13 8  o 17 78.18   39.28  -2232.54  781.93   0.00     0.00     -2232.54  781.93   ?       ?      78.18   39.28  0.00    39.28  
1 1 1 2   -13 9  o 11 102.44  44.39  -24.52    481.86   0.00     0.00     -24.52    481.86   ?       ?      102.44  44.39  0.00    44.39  
1 1 1 2   -13 10 o 6  167.84  43.49  883.20    422.39   0.00     0.00     883.20    422.39   ?       ?      167.84  43.49  0.00    43.49  
1 1 1 2   -13 11 o 19 103.36  23.97  324.75    139.43   373.79   157.46   146.59    300.10   110.79  25.31  93.14   37.19  17.66   44.99  
1 1 1 2   -13 12 o 17 242.78  39.51  1833.85   531.74   1833.85  531.74   0.00      0.00     242.78  39.51  ?       ?      0.00    39.51  
1 1 1 2   -13 13 o 12 234.25  38.55  1715.11   500.43   1715.11  500.43   0.00      0.00     234.25  38.55  ?       ?      0.00    38.55  
1 1 1 2   -13 14 o 19 264.97  47.98  2289.35   703.02   0.00     0.00     2289.35   703.02   ?       ?      264.97  47.98  0.00    47.98  
1 1 1 2   -13 15 o 3  123.20  23.48  462.61    159.97   549.82   188.96   241.90    300.60   133.99  25.50  99.88   37.96  34.11   45.73  
1 1 1 2   -13 16 o 13 132.44  23.30  534.46    170.72   579.42   203.97   429.28    311.96   136.86  26.92  117.95  39.32  18.92   47.65  
1 1 1 2   -13 17 f 0  190.50  25.57  1106.77   272.60   1300.42  347.96   799.03    438.64   204.32  30.61  153.26  46.11  51.06   55.34  
1 1 1 2   -13 18 o 14 190.48  24.57  1105.67   262.44   1066.54  336.50   1166.42   419.31   182.82  33.29  187.37  40.19  -4.55   52.18  
1 1 1 2   -13 19 o 8  261.35  31.54  2150.35   463.59   2274.42  630.04   2003.87   684.59   258.83  43.97  235.31  52.06  23.52   68.15  
1 1 1 2   -13 20 o 2  78.45   24.46  187.40    122.03   217.37   133.27   31.86     303.61   83.86   25.46  81.54   35.29  2.32    43.51  
1 1 1 2   -13 21 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   -13 22 o 3  113.70  42.65  414.83    376.59   0.00     0.00     414.83    376.59   ?       ?      113.70  42.65  0.00    42.65  
1 1 1 2   -12 0  o 8  205.68  33.59  1272.59   382.88   1272.59  382.88   0.00      0.00     205.68  33.59  ?       ?      0.00    33.59  
1 1 1 2   -12 1  o 5  213.30  24.27  1338.08   291.93   1242.36  393.46   1455.30   435.41   202.82  35.06  219.70  35.75  -16.89  50.07  
1 1 1 2   -12 2  o 17 539.51  93.41  9969.22   2788.36  0.00     0.00     9969.22   2788.36  ?       ?      539.51  93.41  0.00    93.41  
1 1 1 2   -12 3  o 18 450.62  47.31  6150.23   1205.71  5799.18  1698.18  6507.09   1712.16  423.29  72.49  451.69  68.15  -28.40  99.49  
1 1 1 2   -12 4  o 8  354.10  37.50  3742.18   750.65   3747.09  1053.96  3737.12   1069.36  347.20  54.69  346.26  55.68  0.94    78.05  
1 1 1 2   -12 5  o 18 411.83  42.83  5115.56   997.74   4690.19  1404.82  5548.52   1417.29  381.71  66.53  419.48  60.61  -37.77  90.00  
1 1 1 2   -12 6  o 7  500.88  55.07  7807.45   1557.29  8035.19  2197.21  7577.57   2207.52  487.32  81.41  469.89  84.96  17.42   117.67 
1 1 1 2   -12 7  o 7  277.83  30.30  2294.53   475.41   2354.63  660.85   2230.07   684.43   276.91  42.96  268.05  46.14  8.86    63.05  
1 1 1 2   -12 8  o 16 42.45   19.79  -109.68   118.03   60.16    143.20   -469.50   208.43   64.08   25.66  44.61   22.06  19.47   33.84  
1 1 1 2   -12 9  o 1  82.43   22.34  204.26    108.35   20.67    118.48   1141.88   267.76   54.79   22.80  196.44  24.26  -141.65 33.29  
1 1 1 2   -12 10 o 19 73.76   32.70  -82.65    274.92   0.00     0.00     -82.65    274.92   ?       ?      73.76   32.70  0.00    32.70  
1 1 1 2   -12 11 o 19 254.90  46.70  2016.94   658.18   0.00     0.00     2016.94   658.18   ?       ?      254.90  46.70  0.00    46.70  
1 1 1 2   -12 12 o 4  150.19  21.12  667.19    177.07   1163.48  205.37   -770.60   349.55   199.69  18.11  57.95   28.64  141.74  33.89  
1 1 1 2   -12 13 o 3  51.87   22.42  -12.93    122.27   1.94     139.17   -63.23    255.95   56.92   24.25  71.95   31.74  -15.03  39.94  
1 1 1 2   -12 14 o 4  276.69  31.73  2305.79   494.83   2662.68  685.02   1916.35   715.58   292.77  41.96  242.24  52.94  50.53   67.55  
1 1 1 2   -12 15 o 15 110.16  26.64  372.95    166.62   372.95   166.62   0.00      0.00     110.16  26.64  ?       ?      0.00    26.64  
1 1 1 2   -12 16 o 14 254.63  41.78  2056.81   589.56   2056.81  589.56   0.00      0.00     254.63  41.78  ?       ?      0.00    41.78  
1 1 1 2   -12 17 o 18 233.94  27.72  1657.49   365.06   1807.65  492.21   1473.91   544.23   239.87  36.93  211.18  46.18  28.69   59.13  
1 1 1 2   -12 18 o 13 67.90   25.12  111.51    129.68   111.51   129.68   0.00      0.00     67.90   25.12  ?       ?      0.00    25.12  
1 1 1 2   -12 19 o 3  108.99  21.42  363.58    129.21   424.49   144.67   123.35    287.32   117.74  22.22  87.52   35.86  30.22   42.19  
1 1 1 2   -12 20 o 7  189.44  32.04  1138.77   336.02   1138.77  336.02   0.00      0.00     189.44  32.04  ?       ?      0.00    32.04  
1 1 1 2   -12 21 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   -12 22 o 12 68.59   23.10  135.96    107.68   120.09   114.82   251.84    310.26   66.66   23.78  98.09   38.23  -31.44  45.02  
1 1 1 2   -12 23 o 19 57.94   22.66  68.40     109.27   67.48    116.39   75.28     317.20   58.96   23.28  84.68   36.35  -25.72  43.17  
1 1 1 2   -11 0  o 6  172.10  20.12  870.81    194.99   876.86   268.63   864.07    283.48   170.78  28.40  169.00  30.33  1.78    41.55  
1 1 1 2   -11 1  x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   -11 2  o 9  230.13  36.15  1600.77   461.83   1600.77  461.83   0.00      0.00     230.13  36.15  ?       ?      0.00    36.15  
1 1 1 2   -11 3  o 3  238.57  37.21  1718.61   493.00   1718.61  493.00   0.00      0.00     238.57  37.21  ?       ?      0.00    37.21  
1 1 1 2   -11 4  o 4  323.74  33.84  3108.91   619.70   3049.03  871.87   3170.06   880.99   314.82  49.91  321.36  49.33  -6.54   70.17  
1 1 1 2   -11 5  o 4  361.11  38.31  3886.49   782.12   4101.59  1103.18  3669.11   1109.01  364.62  54.36  342.68  58.47  21.94   79.84  
1 1 1 2   -11 6  o 1  230.72  25.50  1564.37   332.11   1827.29  465.71   1292.32   473.74   247.61  33.63  205.49  41.59  42.12   53.49  
1 1 1 2   -11 7  o 10 195.86  22.32  1125.34   246.53   1286.38  340.92   948.83    356.93   208.08  29.35  176.57  36.42  31.52   46.78  
1 1 1 2   -11 8  o 11 ?       ?      -301.96   58.87    -437.23  63.94    449.51    150.72   ?       ?      122.70  22.21  0.00    22.21  
1 1 1 2   -11 9  o 10 231.30  21.88  1565.86   287.07   534.39   392.15   2756.82   421.38   135.12  44.04  306.96  24.11  -171.84 50.21  
1 1 1 2   -11 10 o 8  136.31  18.43  547.46    140.56   480.11   180.47   651.30    224.09   126.04  25.81  146.94  27.58  -20.89  37.77  
1 1 1 2   -11 11 o 15 242.80  27.75  1748.76   379.85   2155.18  525.15   1302.85   550.08   267.50  35.04  202.97  47.97  64.53   59.41  
1 1 1 2   -11 12 o 2  354.13  58.02  3991.03   1138.74  0.00     0.00     3991.03   1138.74  ?       ?      354.13  58.02  0.00    58.02  
1 1 1 2   -11 13 o 18 65.78   33.14  -1760.32  575.20   0.00     0.00     -1760.32  575.20   ?       ?      65.78   33.14  0.00    33.14  
1 1 1 2   -11 14 o 18 69.15   34.85  -1977.83  641.85   0.00     0.00     -1977.83  641.85   ?       ?      69.15   34.85  0.00    34.85  
1 1 1 2   -11 15 o 19 277.27  31.40  2298.27   491.01   2664.35  675.73   1888.77   714.70   294.91  41.02  242.55  52.83  52.36   66.88  
1 1 1 2   -11 16 o 18 436.58  48.86  6014.25   1203.61  6177.09  1694.11  5848.28   1710.33  421.12  72.70  406.13  76.16  14.99   105.29 
1 1 1 2   -11 17 o 2  99.81   25.49  305.34    146.52   305.34   146.52   0.00      0.00     99.81   25.49  ?       ?      0.00    25.49  
1 1 1 2   -11 18 f 0  109.37  23.81  366.02    145.23   366.02   145.23   0.00      0.00     109.37  23.81  ?       ?      0.00    23.81  
1 1 1 2   -11 19 o 1  74.86   23.56  165.04    112.98   165.04   112.98   0.00      0.00     74.86   23.56  ?       ?      0.00    23.56  
1 1 1 2   -11 20 o 3  221.59  36.89  1571.90   452.81   1571.90  452.81   0.00      0.00     221.59  36.89  ?       ?      0.00    36.89  
1 1 1 2   -11 21 o 10 80.26   33.44  79.53     255.47   0.00     0.00     79.53     255.47   ?       ?      80.26   33.44  0.00    33.44  
1 1 1 2   -11 22 o 9  60.48   22.27  90.08     101.76   102.66   110.51   19.89     260.97   63.66   23.25  76.04   32.81  -12.38  40.21  
1 1 1 2   -11 23 o 3  149.47  39.78  768.56    347.36   0.00     0.00     768.56    347.36   ?       ?      149.47  39.78  0.00    39.78  
1 1 1 2   -11 24 o 11 84.54   23.93  225.15    121.31   227.39   135.79   216.31    269.99   85.05   25.67  91.41   35.65  -6.37   43.93  
1 1 1 2   -10 0  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   -10 1  o 1  296.43  47.53  2785.02   781.49   0.00     0.00     2785.02   781.49   ?       ?      296.43  47.53  0.00    47.53  
1 1 1 2   -10 2  o 6  227.53  24.20  1532.65   311.28   1580.47  441.55   1485.40   438.88   227.52  34.92  220.04  35.99  7.48    50.15  
1 1 1 2   -10 3  o 14 483.01  53.62  7391.57   1461.73  7482.32  2066.22  7300.64   2068.17  460.14  81.19  452.98  82.57  7.17    115.80 
1 1 1 2   -10 4  o 12 218.27  23.51  1405.27   289.95   1527.53  408.44   1281.07   411.68   225.05  32.56  204.51  36.40  20.53   48.84  
1 1 1 2   -10 5  o 19 396.06  64.84  5093.35   1423.27  5093.35  1423.27  0.00      0.00     396.06  64.84  ?       ?      0.00    64.84  
1 1 1 2   -10 6  o 17 351.11  55.48  3861.91   1081.17  3861.91  1081.17  0.00      0.00     351.11  55.48  ?       ?      0.00    55.48  
1 1 1 2   -10 7  o 18 75.16   16.14  169.24    67.57    168.38   81.00    171.21    122.52   74.88   18.86  77.40   24.56  -2.53   30.96  
1 1 1 2   -10 8  o 10 181.25  17.94  957.66    184.23   1.69     246.45   2168.48   277.36   75.56   32.23  273.49  17.76  -197.93 36.80  
1 1 1 2   -10 9  o 2  71.96   17.21  155.41    70.15    181.25   81.65    82.55     137.09   77.68   18.56  66.04   25.50  11.64   31.54  
1 1 1 2   -10 10 o 17 258.50  27.69  1966.23   404.51   2213.24  566.69   1709.61   577.59   271.90  37.29  236.38  44.19  35.52   57.82  
1 1 1 2   -10 11 o 17 363.55  38.73  3951.87   795.82   4269.07  1122.28  3631.05   1128.67  371.26  54.26  339.09  60.19  32.17   81.03  
1 1 1 2   -10 12 o 7  249.15  27.24  1834.34   383.30   2124.29  535.00   1528.55   549.42   265.69  36.00  221.89  44.68  43.80   57.38  
1 1 1 2   -10 13 o 6  110.19  19.18  361.87    116.94   448.54   144.03   194.17    200.34   122.56  21.24  87.54   31.39  35.02   37.90  
1 1 1 2   -10 14 o 2  292.40  31.45  2544.44   519.64   2652.29  724.98   2430.50   745.21   293.69  44.38  279.28  48.22  14.41   65.54  
1 1 1 2   -10 15 o 1  122.30  37.06  448.13    282.61   0.00     0.00     448.13    282.61   ?       ?      122.30  37.06  0.00    37.06  
1 1 1 2   -10 16 o 1  57.28   27.97  -549.64   301.90   0.00     0.00     -549.64   301.90   ?       ?      57.28   27.97  0.00    27.97  
1 1 1 2   -10 17 f 0  340.33  37.23  3508.21   715.59   3848.32  1003.01  3155.64   1021.23  348.69  51.67  310.62  59.44  38.07   78.75  
1 1 1 2   -10 18 o 5  69.24   29.49  10.60     205.80   0.00     0.00     10.60     205.80   ?       ?      69.24   29.49  0.00    29.49  
1 1 1 2   -10 19 o 3  264.39  30.48  2119.14   454.12   2675.39  628.53   1511.61   656.86   293.27  38.24  211.36  53.96  81.91   66.14  
1 1 1 2   -10 20 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   -10 21 o 3  225.60  37.37  1626.14   467.10   1626.14  467.10   0.00      0.00     225.60  37.37  ?       ?      0.00    37.37  
1 1 1 2   -10 22 o 12 255.43  29.63  2021.03   426.42   2279.11  589.76   1738.28   617.29   263.83  40.21  222.73  49.56  41.10   63.82  
1 1 1 2   -10 23 o 2  99.18   21.23  303.69    117.23   394.77   134.23   10.89     240.67   113.36  21.41  72.78   31.46  40.58   38.05  
1 1 1 2   -10 24 o 15 148.83  21.76  677.42    180.39   609.37   224.01   802.93    304.24   137.81  29.22  155.61  34.92  -17.81  45.53  
1 1 1 2   -10 25 o 11 200.12  25.04  1247.44   281.44   1323.77  371.98   1145.24   430.41   200.41  33.52  179.13  42.50  21.28   54.13  
1 1 1 2   -10 26 o 7  60.97   22.84  91.60     107.94   104.25   120.73   41.20     240.96   64.49   24.16  73.52   31.62  -9.04   39.80  
1 1 1 2   -9  0  o 18 179.96  18.96  953.88    192.92   982.01   270.19   924.63    275.56   180.39  26.91  174.43  28.50  5.96    39.20  
1 1 1 2   -9  1  o 1  360.81  39.18  4015.51   798.57   4250.69  1129.59  3780.54   1129.09  358.55  56.77  334.43  61.06  24.12   83.37  
1 1 1 2   -9  2  o 2  267.42  42.40  2245.21   629.18   0.00     0.00     2245.21   629.18   ?       ?      267.42  42.40  0.00    42.40  
1 1 1 2   -9  3  o 13 156.03  24.76  732.27    214.38   0.00     0.00     732.27    214.38   ?       ?      156.03  24.76  0.00    24.76  
1 1 1 2   -9  4  o 9  51.31   17.39  71.00     61.03    0.00     0.00     71.00     61.03    ?       ?      51.31   17.39  0.00    17.39  
1 1 1 2   -9  5  o 4  136.92  15.64  549.83    120.76   603.79   173.46   499.08    168.22   142.21  21.95  128.63  23.65  13.58   32.27  
1 1 1 2   -9  6  o 19 493.97  54.89  7784.89   1530.36  7634.75  2163.30  7935.30   2165.23  459.18  85.20  470.54  83.20  -11.37  119.09 
1 1 1 2   -9  7  o 10 84.71   15.26  213.66    71.46    213.66   71.46    0.00      0.00     84.71   15.26  ?       ?      0.00    15.26  
1 1 1 2   -9  8  o 19 21.89   10.79  -105.40   48.44    -105.40  48.44    0.00      0.00     21.89   10.79  ?       ?      0.00    10.79  
1 1 1 2   -9  9  x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   -9  10 o 11 469.92  49.38  6695.41   1312.25  6354.38  1854.58  7037.33   1857.02  442.58  75.71  469.19  71.18  -26.62  103.92 
1 1 1 2   -9  11 o 4  209.88  22.21  1289.25   263.54   1237.05  367.08   1344.77   378.58   203.31  32.55  212.28  32.06  -8.97   45.69  
1 1 1 2   -9  12 o 6  579.18  62.91  10410.63  2058.05  10588.79 2908.87  10232.06  2912.17  560.22  93.76  548.66  95.95  11.57   134.16 
1 1 1 2   -9  13 o 8  615.82  114.66 14003.14  3904.32  0.00     0.00     14003.14  3904.32  ?       ?      615.82  114.66 0.00    114.66 
1 1 1 2   -9  14 o 5  356.65  37.92  3819.25   764.58   4045.37  1078.05  3590.40   1084.53  359.54  53.89  336.02  58.34  23.51   79.42  
1 1 1 2   -9  15 o 11 44.75   18.22  22.29     73.57    47.91    83.50    -66.62    155.57   51.17   19.86  54.19   24.27  -3.02   31.36  
1 1 1 2   -9  16 o 10 259.77  42.11  2069.34   606.47   0.00     0.00     2069.34   606.47   ?       ?      259.77  42.11  0.00    42.11  
1 1 1 2   -9  17 o 8  413.10  43.32  5174.80   1011.98  4562.43  1424.41  5798.90   1438.01  372.97  69.07  427.49  60.27  -54.52  91.67  
1 1 1 2   -9  18 o 14 190.38  35.37  1108.64   372.28   0.00     0.00     1108.64   372.28   ?       ?      190.38  35.37  0.00    35.37  
1 1 1 2   -9  19 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   -9  20 o 13 58.75   26.48  -85.74    188.41   0.00     0.00     -85.74    188.41   ?       ?      58.75   26.48  0.00    26.48  
1 1 1 2   -9  21 o 5  67.69   21.60  132.60    94.69    137.13   111.52   120.92    179.25   70.01   23.51  75.71   29.18  -5.70   37.47  
1 1 1 2   -9  22 o 5  304.22  53.33  3192.97   897.50   3192.97  897.50   0.00      0.00     304.22  53.33  ?       ?      0.00    53.33  
1 1 1 2   -9  23 o 5  300.38  54.81  3234.40   910.29   3234.40  910.29   0.00      0.00     300.38  54.81  ?       ?      0.00    54.81  
1 1 1 2   -9  24 o 18 108.04  20.57  357.96    122.93   356.93   148.92   360.15    217.82   106.67  24.79  106.24  32.60  0.43    40.96  
1 1 1 2   -9  25 o 1  169.80  21.76  878.98    207.23   963.94   269.93   757.02    323.41   174.89  27.82  149.31  37.72  25.58   46.87  
1 1 1 2   -9  26 o 16 144.05  18.54  628.60    149.76   681.85   201.26   562.55    224.16   147.33  24.67  130.77  30.43  16.57   39.17  
1 1 1 2   -9  27 f 0  68.19   20.42  143.33    86.17    173.05   107.50   89.90     144.13   74.62   22.90  65.49   25.90  9.12    34.57  
1 1 1 2   -8  0  o 3  200.43  20.78  1183.16   235.58   1178.80  331.93   1187.58   334.41   197.34  30.26  198.05  30.38  -0.71   42.88  
1 1 1 2   -8  1  o 8  436.89  78.44  6800.32   1895.02  6800.32  1895.02  0.00      0.00     436.89  78.44  ?       ?      0.00    78.44  
1 1 1 2   -8  2  o 1  303.95  32.04  2781.50   550.65   2831.92  778.26   2730.96   779.22   299.21  46.85  293.09  47.97  6.11    67.05  
1 1 1 2   -8  3  o 15 144.62  15.35  612.36    125.51   635.94   176.23   588.08    178.79   146.05  21.68  140.00  23.05  6.05    31.64  
1 1 1 2   -8  4  o 12 147.20  15.84  635.00    131.73   698.36   187.88   573.72    184.76   153.08  22.01  137.93  24.22  15.15   32.73  
1 1 1 2   -8  5  o 10 207.16  31.99  1307.76   368.16   0.00     0.00     1307.76   368.16   ?       ?      207.16  31.99  0.00    31.99  
1 1 1 2   -8  6  o 18 215.18  33.24  1414.11   397.38   0.00     0.00     1414.11   397.38   ?       ?      215.18  33.24  0.00    33.24  
1 1 1 2   -8  7  o 5  73.63   15.24  162.70    62.29    0.00     0.00     162.70    62.29    ?       ?      73.63   15.24  0.00    15.24  
1 1 1 2   -8  8  o 17 97.37   11.72  277.38    64.22    265.72   90.22    289.34    91.43    94.27   17.31  98.58   16.76  -4.31   24.09  
1 1 1 2   -8  9  o 8  258.29  27.08  1979.64   395.57   2076.90  557.70   1881.16   561.17   260.52  38.44  246.65  41.08  13.87   56.26  
1 1 1 2   -8  10 o 7  145.80  23.02  633.38    186.32   633.38   186.32   0.00      0.00     145.80  23.02  ?       ?      0.00    23.02  
1 1 1 2   -8  11 o 3  128.63  21.01  491.64    149.76   491.64   149.76   0.00      0.00     128.63  21.01  ?       ?      0.00    21.01  
1 1 1 2   -8  12 f 0  189.05  29.04  1065.21   305.10   1065.21  305.10   0.00      0.00     189.05  29.04  ?       ?      0.00    29.04  
1 1 1 2   -8  13 o 7  52.41   15.90  79.57     51.99    84.05    60.53    66.96     101.54   54.45   17.26  57.80   22.04  -3.35   28.00  
1 1 1 2   -8  14 o 15 167.35  27.72  836.16    257.01   0.00     0.00     836.16    257.01   ?       ?      167.35  27.72  0.00    27.72  
1 1 1 2   -8  15 o 12 671.22  77.70  14829.00  2938.84  15911.31 4155.56  13746.08  4156.73  649.23  115.74 587.66  126.93 61.57   171.78 
1 1 1 2   -8  16 o 4  305.57  32.45  2784.50   560.51   3197.12  788.82   2363.70   796.60   323.05  43.65  273.09  52.72  49.96   68.45  
1 1 1 2   -8  17 o 15 377.12  40.20  4305.72   856.81   4545.10  1208.33  4063.64   1215.13  377.90  57.51  354.22  62.01  23.67   84.58  
1 1 1 2   -8  18 o 17 392.20  42.04  4658.33   931.82   5227.80  1313.67  4081.66   1321.96  406.79  57.89  352.84  67.73  53.95   89.09  
1 1 1 2   -8  19 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   -8  20 o 16 220.67  36.68  1498.40   448.39   0.00     0.00     1498.40   448.39   ?       ?      220.67  36.68  0.00    36.68  
1 1 1 2   -8  21 o 3  320.11  54.26  3398.55   961.56   0.00     0.00     3398.55   961.56   ?       ?      320.11  54.26  0.00    54.26  
1 1 1 2   -8  22 o 1  149.75  18.91  665.85    158.93   688.35   212.68   637.40    239.17   150.35  25.56  143.14  30.06  7.21    39.46  
1 1 1 2   -8  23 o 7  218.51  24.27  1438.66   299.28   1589.06  416.78   1278.57   430.01   225.40  33.20  198.68  39.09  26.72   51.29  
1 1 1 2   -8  24 o 5  221.61  37.02  1591.76   454.40   1591.76  454.40   0.00      0.00     221.61  37.02  ?       ?      0.00    37.02  
1 1 1 2   -8  25 o 10 292.94  55.16  3181.91   893.58   3181.91  893.58   0.00      0.00     292.94  55.16  ?       ?      0.00    55.16  
1 1 1 2   -8  26 o 14 78.90   19.70  192.98    88.95    203.28   103.55   164.02    173.72   80.76   21.82  78.54   29.07  2.22    36.35  
1 1 1 2   -8  27 o 3  150.58  19.16  689.69    161.90   853.26   213.07   466.20    249.05   165.80  23.01  117.13  34.63  48.67   41.57  
1 1 1 2   -8  28 o 11 68.91   20.33  147.33    85.90    204.47   99.20    -23.91    171.73   80.42   21.19  58.45   25.88  21.97   33.45  
1 1 1 2   -7  0  o 11 464.43  50.15  6663.51   1315.78  6818.25  1860.69  6508.73   1860.90  451.99  74.29  439.61  76.52  12.37   106.65 
1 1 1 2   -7  1  o 13 311.52  32.33  2892.37   569.82   2853.45  805.56   2931.35   806.13   302.99  47.90  307.52  47.17  -4.53   67.23  
1 1 1 2   -7  2  o 4  258.66  26.99  1979.81   394.90   2147.11  558.39   1812.40   558.55   265.91  37.63  242.45  41.63  23.46   56.12  
1 1 1 2   -7  3  o 1  202.04  20.92  1199.38   239.08   1262.00  338.07   1136.72   338.15   205.04  29.58  193.85  31.46  11.19   43.18  
1 1 1 2   -7  4  o 15 269.32  28.07  2155.71   427.59   2271.71  604.63   2039.66   604.77   272.03  39.90  256.38  42.58  15.65   58.36  
1 1 1 2   -7  5  o 2  448.66  49.17  6308.01   1245.60  6514.16  1761.46  6101.83   1761.64  435.50  73.04  418.32  76.16  17.18   105.53 
1 1 1 2   -7  6  o 1  148.11  15.09  641.25    126.53   -6.61    175.76   1338.17   182.29   62.87   27.03  214.55  14.89  -151.68 30.86  
1 1 1 2   -7  7  o 14 87.56   11.20  224.68    55.02    -44.98   72.80    583.79    84.02    35.64   16.22  141.95  10.38  -106.31 19.26  
1 1 1 2   -7  8  o 15 87.20   16.00  227.19    77.14    0.00     0.00     227.19    77.14    ?       ?      87.20   16.00  0.00    16.00  
1 1 1 2   -7  9  o 2  104.64  17.59  326.37    101.94   0.00     0.00     326.37    101.94   ?       ?      104.64  17.59  0.00    17.59  
1 1 1 2   -7  10 o 14 171.37  18.07  861.92    175.05   979.38   247.95   745.19    247.18   181.26  24.45  156.61  28.54  24.65   37.58  
1 1 1 2   -7  11 o 6  80.96   12.11  193.15    54.56    203.66   71.07    178.06    85.15    82.59   15.56  76.83   19.33  5.77    24.81  
1 1 1 2   -7  12 o 11 80.58   18.81  195.62    85.41    0.00     0.00     195.62    85.41    ?       ?      80.58   18.81  0.00    18.81  
1 1 1 2   -7  13 o 12 384.27  60.91  4655.52   1298.86  4655.52  1298.86  0.00      0.00     384.27  60.91  ?       ?      0.00    60.91  
1 1 1 2   -7  14 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   -7  15 o 11 609.06  66.78  11616.82  2296.72  12706.03 3247.86  10527.35  3248.24  612.43  95.49  545.60  107.53 66.83   143.81 
1 1 1 2   -7  16 o 10 294.78  30.74  2569.87   512.64   2970.25  724.50   2168.42   725.46   313.70  41.23  264.33  49.63  49.37   64.52  
1 1 1 2   -7  17 o 3  423.59  45.43  5482.17   1087.50  6136.78  1537.81  4827.32   1538.11  436.85  63.15  379.81  73.20  57.04   96.67  
1 1 1 2   -7  18 o 14 315.46  49.99  3119.83   875.07   3119.83  875.07   0.00      0.00     315.46  49.99  ?       ?      0.00    49.99  
1 1 1 2   -7  19 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   -7  20 o 3  284.52  30.14  2406.10   484.80   2612.93  682.80   2195.83   688.45   292.21  41.90  265.40  46.90  26.82   62.89  
1 1 1 2   -7  21 o 4  117.23  16.32  405.63    106.84   423.75   138.94   379.42    167.11   118.85  21.14  111.41  26.51  7.45    33.91  
1 1 1 2   -7  22 o 3  256.51  41.89  2084.70   595.64   0.00     0.00     2084.70   595.64   ?       ?      256.51  41.89  0.00    41.89  
1 1 1 2   -7  23 o 18 145.44  27.34  650.76    219.93   0.00     0.00     650.76    219.93   ?       ?      145.44  27.34  0.00    27.34  
1 1 1 2   -7  24 o 15 116.34  16.64  403.31    107.95   455.63   141.45   330.33    167.06   122.63  20.84  102.83  27.69  19.81   34.65  
1 1 1 2   -7  25 o 5  89.58   19.15  245.85    95.49    225.47   114.76   291.74    172.20   85.29   22.94  96.53   28.86  -11.25  36.86  
1 1 1 2   -7  26 o 16 168.48  28.56  897.30    266.40   897.30   266.40   0.00      0.00     168.48  28.56  ?       ?      0.00    28.56  
1 1 1 2   -7  27 o 11 64.67   21.66  121.06    94.69    121.06   94.69    0.00      0.00     64.67   21.66  ?       ?      0.00    21.66  
1 1 1 2   -7  28 o 12 153.26  19.82  719.10    170.29   796.37   222.44   609.68    264.69   158.48  25.30  133.18  34.38  25.30   42.69  
1 1 1 2   -7  29 o 18 82.00   30.22  196.74    187.53   0.00     0.00     196.74    187.53   ?       ?      82.00   30.22  0.00    30.22  
1 1 1 2   -6  0  o 16 680.02  133.86 18095.55  5039.38  18095.55 5039.38  0.00      0.00     680.02  133.86 ?       ?      0.00    133.86 
1 1 1 2   -6  1  o 5  720.33  152.64 21960.27  6115.53  21960.27 6115.53  0.00      0.00     720.33  152.64 ?       ?      0.00    152.64 
1 1 1 2   -6  2  o 16 562.60  61.09  9868.44   1941.43  9664.03  2745.53  10072.87  2745.65  530.28  93.61  543.82  91.17  -13.54  130.67 
1 1 1 2   -6  3  o 1  525.91  56.92  8571.52   1690.97  8948.33  2391.40  8194.72   2391.39  517.04  83.41  490.42  88.18  26.63   121.38 
1 1 1 2   -6  4  o 1  486.25  52.25  7283.26   1435.55  7518.33  2030.18  7048.21   2030.16  476.44  76.84  458.54  80.04  17.91   110.95 
1 1 1 2   -6  5  o 11 562.42  62.44  10070.87  1982.11  9631.00  2802.99  10510.82  2803.26  515.10  98.38  544.55  93.01  -29.45  135.39 
1 1 1 2   -6  6  o 9  12.21   4.48   3.40      4.10     3.40     4.10     0.00      0.00     12.21   4.48   ?       ?      0.00    4.48   
1 1 1 2   -6  7  o 19 216.94  33.04  1426.15   398.46   1426.15  398.46   0.00      0.00     216.94  33.04  ?       ?      0.00    33.04  
1 1 1 2   -6  8  o 8  47.73   9.85   68.04     26.09    97.27    33.76    24.67     41.12    57.18   10.68  36.23   13.97  20.95   17.59  
1 1 1 2   -6  9  o 8  302.90  31.92  2760.64   546.64   3002.11  773.11   2519.23   773.03   309.47  44.82  280.31  49.87  29.16   67.05  
1 1 1 2   -6  10 o 10 212.77  32.80  1381.01   387.76   0.00     0.00     1381.01   387.76   ?       ?      212.77  32.80  0.00    32.80  
1 1 1 2   -6  11 o 15 205.29  31.63  1281.51   360.77   0.00     0.00     1281.51   360.77   ?       ?      205.29  31.63  0.00    31.63  
1 1 1 2   -6  12 o 19 242.60  37.60  1806.94   506.71   0.00     0.00     1806.94   506.71   ?       ?      242.60  37.60  0.00    37.60  
1 1 1 2   -6  13 o 19 53.13   12.93  84.67     39.07    98.51    58.24    73.34     52.69    57.73   16.66  50.79   16.10  6.93    23.17  
1 1 1 2   -6  14 o 8  105.13  12.89  323.18    76.18    308.31   106.50   338.75    109.01   101.61  18.96  106.72  18.46  -5.11   26.46  
1 1 1 2   -6  15 o 11 271.44  41.43  2230.09   625.20   2230.09  625.20   0.00      0.00     271.44  41.43  ?       ?      0.00    41.43  
1 1 1 2   -6  16 o 4  340.38  52.69  3564.85   996.24   3564.85  996.24   0.00      0.00     340.38  52.69  ?       ?      0.00    52.69  
1 1 1 2   -6  17 o 11 395.27  41.42  4689.29   926.01   4746.62  1309.46  4631.95   1309.69  388.46  60.70  383.16  61.63  5.30    86.51  
1 1 1 2   -6  18 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   -6  19 o 9  421.50  71.38  5964.96   1665.50  0.00     0.00     5964.96   1665.50  ?       ?      421.50  71.38  0.00    71.38  
1 1 1 2   -6  20 o 3  117.92  15.66  408.74    103.40   468.05   137.77   332.24    156.46   125.55  19.77  104.59  26.14  20.96   32.77  
1 1 1 2   -6  21 o 11 234.97  37.22  1682.48   485.35   0.00     0.00     1682.48   485.35   ?       ?      234.97  37.22  0.00    37.22  
1 1 1 2   -6  22 o 9  118.95  15.71  416.77    104.67   462.10   139.81   358.96    157.90   124.39  20.28  108.38  25.76  16.02   32.78  
1 1 1 2   -6  23 o 9  224.37  24.00  1502.05   304.33   1669.78  427.48   1329.68   433.36   233.05  32.86  205.18  38.20  27.87   50.39  
1 1 1 2   -6  24 o 12 161.71  28.06  805.04    251.04   0.00     0.00     805.04    251.04   ?       ?      161.71  28.06  0.00    28.06  
1 1 1 2   -6  25 o 8  112.24  27.16  395.35    173.10   0.00     0.00     395.35    173.10   ?       ?      112.24  27.16  0.00    27.16  
1 1 1 2   -6  26 o 19 193.68  32.36  1200.63   347.08   1200.63  347.08   0.00      0.00     193.68  32.36  ?       ?      0.00    32.36  
1 1 1 2   -6  27 o 18 159.75  27.77  808.71    245.40   808.71   245.40   0.00      0.00     159.75  27.77  ?       ?      0.00    27.77  
1 1 1 2   -6  28 o 13 162.80  28.74  854.53    258.77   854.53   258.77   0.00      0.00     162.80  28.74  ?       ?      0.00    28.74  
1 1 1 2   -6  29 o 16 76.44   22.63  184.28    106.34   184.28   106.34   0.00      0.00     76.44   22.63  ?       ?      0.00    22.63  
1 1 1 2   -5  0  o 11 642.56  70.03  12911.17  2541.53  12768.46 3594.24  13053.90  3594.29  608.16  106.85 616.45  105.35 -8.29   150.05 
1 1 1 2   -5  1  o 19 297.38  30.48  2602.81   513.07   2562.35  725.59   2643.26   725.59   290.96  44.88  295.87  44.06  -4.91   62.90  
1 1 1 2   -5  2  o 2  493.90  80.23  7886.66   2196.75  7886.66  2196.75  0.00      0.00     493.90  80.23  ?       ?      0.00    80.23  
1 1 1 2   -5  3  o 16 462.08  74.22  6828.56   1902.18  6828.56  1902.18  0.00      0.00     462.08  74.22  ?       ?      0.00    74.22  
1 1 1 2   -5  4  o 4  338.08  52.06  3509.12   978.02   3509.12  978.02   0.00      0.00     338.08  52.06  ?       ?      0.00    52.06  
1 1 1 2   -5  5  o 14 506.39  52.50  7825.31   1504.03  -7.95    2126.02  15673.33  2128.03  204.92  90.87  718.64  51.93  -513.71 104.67 
1 1 1 2   -5  6  o 1  315.71  31.97  2951.90   571.43   0.59     806.97   5920.20   809.29   132.83  57.51  448.27  31.65  -315.44 65.64  
1 1 1 2   -5  7  o 6  419.38  44.42  5342.73   1053.08  5464.92  1489.14  5220.48   1489.42  411.89  65.14  401.17  67.04  10.72   93.48  
1 1 1 2   -5  8  o 12 388.41  41.15  4584.96   903.55   4998.44  1277.88  4171.56   1277.74  395.53  58.00  356.37  64.84  39.15   87.00  
1 1 1 2   -5  9  o 12 41.60   10.23  51.82     24.26    49.22    32.91    54.92     35.92    41.31   12.67  43.52   13.22  -2.21   18.31  
1 1 1 2   -5  10 o 3  157.04  16.28  722.14    144.66   701.02   204.11   743.44    205.04   152.95  24.04  157.78  23.34  -4.83   33.51  
1 1 1 2   -5  11 o 15 227.51  23.55  1532.99   303.17   1698.90  429.00   1367.49   428.48   236.54  32.45  210.14  36.86  26.40   49.11  
1 1 1 2   -5  12 o 19 108.01  17.53  347.27    105.00   0.00     0.00     347.27    105.00   ?       ?      108.01  17.53  0.00    17.53  
1 1 1 2   -5  13 o 13 107.45  17.54  343.50    104.47   0.00     0.00     343.50    104.47   ?       ?      107.45  17.54  0.00    17.54  
1 1 1 2   -5  14 o 17 70.80   15.67  150.63    62.02    0.00     0.00     150.63    62.02    ?       ?      70.80   15.67  0.00    15.67  
1 1 1 2   -5  15 o 11 230.77  23.79  1566.11   310.59   1641.48  439.27   1490.75   439.21   233.61  33.73  221.82  35.70  11.79   49.12  
1 1 1 2   -5  16 o 15 500.35  53.45  7674.55   1511.63  7923.61  2137.75  7425.48   2137.79  491.63  78.37  473.24  81.64  18.39   113.17 
1 1 1 2   -5  17 o 10 455.67  73.86  6693.72   1865.98  6693.72  1865.98  0.00      0.00     455.67  73.86  ?       ?      0.00    73.86  
1 1 1 2   -5  18 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   -5  19 o 14 119.22  14.00  415.72    94.00    438.97   129.88   390.14    136.22   121.61  19.24  114.04  21.60  7.57    28.93  
1 1 1 2   -5  20 o 6  230.98  24.10  1574.94   314.90   1654.96  444.30   1494.16   446.39   233.75  34.12  221.09  36.44  12.66   49.92  
1 1 1 2   -5  21 o 7  501.77  55.06  7919.11   1560.09  8205.75  2205.92  7632.27   2206.69  487.06  81.79  465.63  85.71  21.44   118.47 
1 1 1 2   -5  22 o 1  190.12  20.43  1062.28   219.53   1066.06  306.36   1058.30   314.74   188.22  29.31  187.23  30.32  0.99    42.17  
1 1 1 2   -5  23 o 2  420.93  46.35  5584.85   1101.54  5796.10  1557.23  5373.29   1558.40  408.50  68.85  389.60  72.34  18.89   99.87  
1 1 1 2   -5  24 o 12 146.02  16.87  629.32    138.79   634.86   191.89   623.25    200.97   144.74  23.93  142.92  25.43  1.81    34.92  
1 1 1 2   -5  25 o 16 148.78  26.83  682.59    220.72   0.00     0.00     682.59    220.72   ?       ?      148.78  26.83  0.00    26.83  
1 1 1 2   -5  26 o 3  258.45  44.88  2264.90   641.77   0.00     0.00     2264.90   641.77   ?       ?      258.45  44.88  0.00    44.88  
1 1 1 2   -5  27 o 7  114.16  26.09  413.28    167.26   0.00     0.00     413.28    167.26   ?       ?      114.16  26.09  0.00    26.09  
1 1 1 2   -5  28 o 12 165.86  19.52  833.91    182.31   931.68   255.82   733.03    259.87   171.64  26.84  149.45  31.30  22.20   41.23  
1 1 1 2   -5  29 o 5  100.67  18.37  312.39    102.23   391.27   138.24   217.19    151.87   111.34  22.40  83.33   27.42  28.01   35.41  
1 1 1 2   -5  30 o 5  115.07  25.60  433.64    164.76   433.64   164.76   0.00      0.00     115.07  25.60  ?       ?      0.00    25.60  
1 1 1 2   -4  0  o 18 591.06  99.57  11701.36  3258.69  0.00     0.00     11701.36  3258.69  ?       ?      591.06  99.57  0.00    99.57  
1 1 1 2   -4  1  o 14 286.61  43.24  2473.01   689.39   0.00     0.00     2473.01   689.39   ?       ?      286.61  43.24  0.00    43.24  
1 1 1 2   -4  2  o 6  675.52  73.75  14281.81  2813.45  14688.75 3978.82  13874.87  3978.81  654.55  109.77 632.05  113.84 22.50   158.15 
1 1 1 2   -4  3  o 3  600.25  64.36  11087.40  2183.20  11350.20 3087.51  10824.60  3087.51  585.59  95.10  569.38  97.99  16.21   136.56 
1 1 1 2   -4  4  o 4  998.25  125.92 35850.52  7055.90  36645.48 9978.53  35055.56  9978.57  878.79  202.03 848.01  206.85 30.78   289.14 
1 1 1 2   -4  5  o 11 8.27    3.42   0.50      2.64     0.50     2.64     0.00      0.00     8.27    3.42   ?       ?      0.00    3.42   
1 1 1 2   -4  6  o 19 24.30   8.38   15.32     14.17    15.32    14.17    0.00      0.00     24.30   8.38   ?       ?      0.00    8.38   
1 1 1 2   -4  7  o 17 60.61   7.98   107.39    27.08    123.02   36.10    87.28     40.94    64.64   10.05  53.99   13.30  10.66   16.67  
1 1 1 2   -4  8  o 14 706.60  82.25  16627.90  3274.01  16718.00 4630.10  16537.80  4630.20  648.86  128.85 643.96  129.74 4.90    182.85 
1 1 1 2   -4  9  o 14 62.52   8.45   114.43    29.55    140.75   39.51    80.99     44.53    69.19   10.26  52.19   14.40  17.00   17.68  
1 1 1 2   -4  10 f 0  276.64  28.70  2276.08   449.19   2293.85  635.17   2258.30   635.32   272.57  41.93  270.23  42.34  2.34    59.59  
1 1 1 2   -4  11 o 2  194.31  20.04  1110.70   220.38   1115.54  311.48   1105.85   311.85   192.23  29.14  191.31  29.33  0.91    41.34  
1 1 1 2   -4  12 o 3  233.79  24.25  1621.08   320.70   1624.24  453.24   1617.91   453.83   229.97  35.47  229.46  35.61  0.51    50.26  
1 1 1 2   -4  13 o 12 212.17  32.70  1374.21   385.49   0.00     0.00     1374.21   385.49   ?       ?      212.17  32.70  0.00    32.70  
1 1 1 2   -4  14 o 16 92.67   15.85  255.63    81.29    0.00     0.00     255.63    81.29    ?       ?      92.67   15.85  0.00    15.85  
1 1 1 2   -4  15 o 11 139.94  21.65  583.38    168.28   0.00     0.00     583.38    168.28   ?       ?      139.94  21.65  0.00    21.65  
1 1 1 2   -4  16 o 5  55.87   15.77  92.54     52.76    0.00     0.00     92.54     52.76    ?       ?      55.87   15.77  0.00    15.77  
1 1 1 2   -4  17 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   -4  18 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   -4  19 o 2  447.83  74.04  6589.14   1836.96  6589.14  1836.96  0.00      0.00     447.83  74.04  ?       ?      0.00    74.04  
1 1 1 2   -4  20 o 16 204.82  31.42  1265.25   357.62   1265.25  357.62   0.00      0.00     204.82  31.42  ?       ?      0.00    31.42  
1 1 1 2   -4  21 o 8  139.46  15.70  569.59    123.53   571.35   170.95   567.67    178.72   138.33  22.28  137.60  23.47  0.73    32.36  
1 1 1 2   -4  22 o 18 180.68  19.59  958.35    199.94   920.36   279.69   998.05    285.93   174.78  28.88  182.34  28.23  -7.57   40.39  
1 1 1 2   -4  23 o 18 155.39  17.21  708.32    150.96   741.69   209.40   672.20    217.84   157.56  23.90  149.22  26.40  8.34    35.61  
1 1 1 2   -4  24 o 4  88.21   16.69  233.48    81.43    278.32   110.08   179.29    121.02   95.74   20.64  78.07   24.36  17.67   31.93  
1 1 1 2   -4  25 o 16 254.42  27.16  1959.62   390.57   2101.10  551.27   1817.03   553.45   257.19  38.52  236.59  42.30  20.60   57.21  
1 1 1 2   -4  26 f 0  257.53  27.86  2031.11   405.30   2159.61  572.50   1902.01   573.86   257.58  40.01  239.03  43.42  18.55   59.05  
1 1 1 2   -4  27 o 11 225.85  24.62  1561.07   314.03   1698.73  442.86   1421.86   445.36   229.08  34.77  206.28  39.04  22.80   52.28  
1 1 1 2   -4  28 o 2  60.78   23.59  78.66     117.76   0.00     0.00     78.66     117.76   ?       ?      60.78   23.59  0.00    23.59  
1 1 1 2   -4  29 o 3  251.06  48.78  2390.34   677.68   0.00     0.00     2390.34   677.68   ?       ?      251.06  48.78  0.00    48.78  
1 1 1 2   -4  30 o 11 165.28  31.20  920.08    285.20   0.00     0.00     920.08    285.20   ?       ?      165.28  31.20  0.00    31.20  
1 1 1 2   -4  31 o 7  156.82  19.52  763.56    171.94   836.02   244.65   692.84    241.70   158.38  27.93  141.92  30.57  16.46   41.41  
1 1 1 2   -3  0  o 14 673.81  73.56  14215.24  2799.24  14192.98 3958.72  14237.50  3958.72  641.00  111.63 642.24  111.41 -1.23   157.72 
1 1 1 2   -3  1  o 19 332.19  34.13  3254.61   641.63   3139.45  907.36   3369.79   907.44   321.07  50.93  333.61  48.83  -12.53  70.55  
1 1 1 2   -3  2  o 5  198.46  29.55  1169.13   326.39   0.00     0.00     1169.13   326.39   ?       ?      198.46  29.55  0.00    29.55  
1 1 1 2   -3  3  o 1  498.82  80.10  7957.30   2216.22  0.00     0.00     7957.30   2216.22  ?       ?      498.82  80.10  0.00    80.10  
1 1 1 2   -3  4  o 14 464.97  48.13  6478.56   1266.07  -3.40    1789.83  12970.25  1791.17  194.03  84.80  659.70  47.62  -465.67 97.25  
1 1 1 2   -3  5  o 9  220.43  22.37  1419.13   279.20   -0.14    393.83   2853.24   395.88   95.09   40.66  313.38  22.15  -218.29 46.30  
1 1 1 2   -3  6  o 3  358.40  36.95  3803.25   749.36   3806.48  1059.72  3800.02   1059.79  352.64  54.07  352.31  54.13  0.33    76.51  
1 1 1 2   -3  7  o 13 369.27  57.19  4210.69   1173.24  4210.69  1173.24  0.00      0.00     369.27  57.19  ?       ?      0.00    57.19  
1 1 1 2   -3  8  o 17 698.69  138.61 19258.68  5363.26  19258.68 5363.26  0.00      0.00     698.69  138.61 ?       ?      0.00    138.61 
1 1 1 2   -3  9  o 18 43.79   8.13   56.90     19.70    67.61    26.72    44.16     29.15    47.58   10.10  39.11   11.91  8.47    15.62  
1 1 1 2   -3  10 o 9  156.92  16.12  718.90    143.17   742.43   202.41   695.34    202.54   158.16  22.96  152.76  23.88  5.40    33.13  
1 1 1 2   -3  11 o 17 129.74  13.48  491.08    98.97    502.63   139.84   479.50    140.07   130.20  19.29  126.99  19.86  3.21    27.69  
1 1 1 2   -3  12 o 10 286.80  29.97  2463.49   486.16   2498.92  687.53   2428.06   687.54   282.53  43.81  278.03  44.58  4.51    62.50  
1 1 1 2   -3  13 o 16 223.04  23.10  1473.26   291.54   1501.32  412.28   1445.20   412.31   221.60  33.45  217.04  34.23  4.56    47.86  
1 1 1 2   -3  14 o 1  169.86  17.57  847.28    168.90   843.20   238.78   851.37    238.94   167.37  25.67  168.24  25.54  -0.86   36.21  
1 1 1 2   -3  15 o 19 147.10  15.32  633.21    127.46   656.26   180.12   610.10    180.39   148.38  21.80  142.72  22.78  5.66    31.53  
1 1 1 2   -3  16 o 4  324.71  51.86  3348.13   934.17   0.00     0.00     3348.13   934.17   ?       ?      324.71  51.86  0.00    51.86  
1 1 1 2   -3  17 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   -3  18 o 2  309.06  31.91  2827.84   557.99   2976.12  789.20   2679.62   789.04   312.54  45.31  295.16  48.23  17.38   66.17  
1 1 1 2   -3  19 o 13 460.57  48.86  6454.17   1272.18  6474.34  1799.06  6434.01   1799.22  446.89  72.62  445.28  72.91  1.62    102.90 
1 1 1 2   -3  20 o 5  239.12  36.61  1733.63   486.63   1733.63  486.63   0.00      0.00     239.12  36.61  ?       ?      0.00    36.61  
1 1 1 2   -3  21 o 8  430.14  74.63  6369.01   1776.00  6369.01  1776.00  0.00      0.00     430.14  74.63  ?       ?      0.00    74.63  
1 1 1 2   -3  22 o 18 249.28  38.74  1907.55   536.36   1907.55  536.36   0.00      0.00     249.28  38.74  ?       ?      0.00    38.74  
1 1 1 2   -3  23 o 4  265.86  27.84  2099.55   418.68   2115.03  591.42   2083.99   592.78   262.09  40.62  259.92  41.09  2.16    57.78  
1 1 1 2   -3  24 o 8  251.85  40.22  1978.35   561.97   0.00     0.00     1978.35   561.97   ?       ?      251.85  40.22  0.00    40.22  
1 1 1 2   -3  25 o 17 105.45  22.89  340.45    134.58   340.45   134.58   0.00      0.00     105.45  22.89  ?       ?      0.00    22.89  
1 1 1 2   -3  26 o 8  129.95  16.52  501.24    120.48   529.09   168.78   472.31    172.04   131.63  23.18  123.62  25.10  8.01    34.17  
1 1 1 2   -3  27 o 14 221.90  24.18  1498.63   303.01   1608.61  429.05   1389.19   428.00   223.79  34.51  205.67  37.64  18.12   51.06  
1 1 1 2   -3  28 o 15 243.58  26.88  1851.39   369.58   2031.61  522.90   1671.48   522.44   245.82  38.30  218.31  43.22  27.51   57.75  
1 1 1 2   -3  29 o 13 109.32  25.36  383.66    156.03   0.00     0.00     383.66    156.03   ?       ?      109.32  25.36  0.00    25.36  
1 1 1 2   -3  30 o 6  100.97  25.77  333.06    149.85   0.00     0.00     333.06    149.85   ?       ?      100.97  25.77  0.00    25.77  
1 1 1 2   -3  31 o 19 127.06  18.87  501.64    133.44   432.76   189.42   569.50    188.00   112.37  29.13  131.49  25.83  -19.11  38.93  
1 1 1 2   -2  0  o 7  96.78   9.93   272.05    54.41    292.74   76.79    251.19    77.09    99.92   13.75  92.21   15.09  7.71    20.41  
1 1 1 2   -2  1  o 4  534.37  56.48  8667.97   1706.50  8558.69  2413.32  8777.26   2413.38  514.50  84.65  522.01  83.33  -7.51   118.79 
1 1 1 2   -2  2  o 4  251.91  25.70  1857.93   366.41   1938.77  518.16   1777.08   518.19   254.97  36.44  243.41  38.35  11.56   52.90  
1 1 1 2   -2  3  o 7  572.66  61.02  10025.64  1975.20  10318.02 2793.29  9733.24   2793.41  562.47  89.50  543.63  92.84  18.84   128.96 
1 1 1 2   -2  4  o 17 725.35  134.29 19340.47  5385.81  0.00     0.00     19340.47  5385.81  ?       ?      725.35  134.29 0.00    134.29 
1 1 1 2   -2  5  o 2  333.55  50.81  3381.37   942.29   0.00     0.00     3381.37   942.29   ?       ?      333.55  50.81  0.00    50.81  
1 1 1 2   -2  6  o 3  700.02  76.91  15431.39  3039.84  15858.98 4298.98  15003.80  4298.98  675.57  114.96 652.68  119.12 22.89   165.55 
1 1 1 2   -2  7  o 8  665.33  72.77  13880.24  2734.19  14248.00 3866.73  13512.48  3866.73  643.23  108.58 622.56  112.32 20.67   156.22 
1 1 1 2   -2  8  o 3  410.81  64.57  5285.11   1472.51  5285.11  1472.51  0.00      0.00     410.81  64.57  ?       ?      0.00    64.57  
1 1 1 2   -2  9  o 9  377.96  59.20  4458.78   1242.38  4458.78  1242.38  0.00      0.00     377.96  59.20  ?       ?      0.00    59.20  
1 1 1 2   -2  10 o 1  239.82  36.29  1734.42   484.05   1734.42  484.05   0.00      0.00     239.82  36.29  ?       ?      0.00    36.29  
1 1 1 2   -2  11 o 3  70.47   8.43   144.86    33.44    152.17   47.07    137.42    47.51    71.74   11.84  67.96   12.64  3.77    17.32  
1 1 1 2   -2  12 o 15 380.56  40.56  4427.74   872.49   4552.71  1233.90  4302.78   1233.88  373.57  59.53  361.46  61.68  12.11   85.72  
1 1 1 2   -2  13 o 12 201.02  20.74  1191.05   235.86   1187.05  333.52   1195.06   333.59   197.82  30.33  198.54  30.22  -0.72   42.82  
1 1 1 2   -2  14 o 12 244.23  25.40  1776.34   350.92   1810.78  496.29   1741.91   496.25   241.98  36.89  236.86  37.76  5.12    52.79  
1 1 1 2   -2  15 o 3  338.51  36.08  3502.31   690.36   3593.40  976.34   3411.22   976.29   331.94  53.02  322.01  54.77  9.92    76.23  
1 1 1 2   -2  16 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   -2  17 o 6  187.04  28.44  1050.48   295.72   0.00     0.00     1050.48   295.72   ?       ?      187.04  28.44  0.00    28.44  
1 1 1 2   -2  18 f 0  333.51  52.17  3462.16   966.11   0.00     0.00     3462.16   966.11   ?       ?      333.51  52.17  0.00    52.17  
1 1 1 2   -2  19 o 14 455.38  74.75  6767.70   1886.28  0.00     0.00     6767.70   1886.28  ?       ?      455.38  74.75  0.00    74.75  
1 1 1 2   -2  20 o 5  415.58  43.82  5228.87   1029.80  5356.96  1456.43  5100.82   1456.28  409.27  64.09  397.97  66.06  11.30   92.04  
1 1 1 2   -2  21 o 8  347.20  36.50  3636.23   716.65   3758.20  1013.48  3514.25   1013.52  344.33  52.97  331.46  55.21  12.87   76.51  
1 1 1 2   -2  22 o 8  61.12   17.49  110.96    64.45    110.96   64.45    0.00      0.00     61.12   17.49  ?       ?      0.00    17.49  
1 1 1 2   -2  23 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   -2  24 o 11 202.17  32.02  1242.74   359.25   0.00     0.00     1242.74   359.25   ?       ?      202.17  32.02  0.00    32.02  
1 1 1 2   -2  25 o 14 262.04  27.88  2068.69   413.01   2133.61  584.47   2003.93   583.70   259.72  40.52  250.70  42.04  9.02    58.39  
1 1 1 2   -2  26 o 7  169.79  18.96  856.89    181.68   905.20   257.97   809.34    255.93   171.67  27.07  161.53  28.65  10.15   39.42  
1 1 1 2   -2  27 o 10 241.89  26.59  1792.87   363.16   1718.61  513.75   1867.05   513.44   227.60  40.82  238.95  38.76  -11.35  56.29  
1 1 1 2   -2  28 o 6  132.54  16.98  526.82    126.21   531.55   180.55   522.29    176.49   130.09  25.09  129.07  24.72  1.01    35.22  
1 1 1 2   -2  29 o 15 115.56  24.58  425.05    158.05   0.00     0.00     425.05    158.05   ?       ?      115.56  24.58  0.00    24.58  
1 1 1 2   -2  30 o 13 229.69  26.27  1682.31   340.19   1743.56  482.52   1621.78   479.69   221.08  39.47  211.42  41.00  9.65    56.91  
1 1 1 2   -2  31 o 19 172.55  32.73  1033.85   312.37   0.00     0.00     1033.85   312.37   ?       ?      172.55  32.73  0.00    32.73  
1 1 1 2   -2  32 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   -1  0  o 19 202.86  20.60  1200.76   236.60   1200.46  334.59   1201.05   334.61   201.07  29.90  201.12  29.89  -0.05   42.27  
1 1 1 2   -1  1  o 10 719.22  79.43  16386.75  3225.09  15773.99 4560.96  16999.51  4560.98  663.74  124.27 695.75  118.43 -32.02  171.66 
1 1 1 2   -1  2  o 7  503.73  81.12  8137.66   2266.20  0.00     0.00     8137.66   2266.20  ?       ?      503.73  81.12  0.00    81.12  
1 1 1 2   -1  3  o 16 275.15  27.77  2219.55   432.69   -2.85    611.54   4447.53   612.30   117.54  50.47  390.50  27.49  -272.96 57.47  
1 1 1 2   -1  4  o 18 209.15  21.01  1276.35   248.84   0.09     351.45   2559.30   352.37   89.96   38.43  296.93  20.80  -206.97 43.70  
1 1 1 2   -1  5  o 12 415.47  64.75  5363.79   1493.98  0.00     0.00     5363.79   1493.98  ?       ?      415.47  64.75  0.00    64.75  
1 1 1 2   -1  6  o 17 238.68  35.70  1700.68   474.17   0.00     0.00     1700.68   474.17   ?       ?      238.68  35.70  0.00    35.70  
1 1 1 2   -1  7  o 12 240.08  35.93  1721.24   480.02   1721.24  480.02   0.00      0.00     240.08  35.93  ?       ?      0.00    35.93  
1 1 1 2   -1  8  o 16 737.40  82.85  17484.85  3446.72  18429.25 4874.42  16540.47  4874.38  714.40  123.31 665.95  132.17 48.45   180.76 
1 1 1 2   -1  9  f 0  329.44  33.93  3210.96   632.59   3143.77  894.54   3278.17   894.70   320.43  50.28  327.81  49.05  -7.38   70.24  
1 1 1 2   -1  10 o 19 306.38  47.02  2872.49   800.65   2872.49  800.65   0.00      0.00     306.38  47.02  ?       ?      0.00    47.02  
1 1 1 2   -1  11 o 4  190.73  28.65  1087.57   304.02   1087.57  304.02   0.00      0.00     190.73  28.65  ?       ?      0.00    28.65  
1 1 1 2   -1  12 o 10 182.26  18.69  973.64    192.82   996.84   272.62   950.41    272.77   182.51  26.82  177.91  27.60  4.59    38.48  
1 1 1 2   -1  13 o 5  185.42  19.07  1010.21   200.13   979.11   282.85   1041.39   283.21   180.06  28.30  186.11  27.32  -6.05   39.33  
1 1 1 2   -1  14 o 11 324.79  34.45  3207.63   632.53   3130.57  894.49   3284.71   894.59   310.31  52.06  319.03  50.53  -8.72   72.55  
1 1 1 2   -1  15 o 6  244.10  25.41  1775.65   350.90   1744.09  496.15   1807.24   496.34   236.87  37.75  241.56  36.97  -4.70   52.84  
1 1 1 2   -1  16 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   -1  17 o 7  218.62  33.54  1455.08   407.56   0.00     0.00     1455.08   407.56   ?       ?      218.62  33.54  0.00    33.54  
1 1 1 2   -1  18 o 18 362.91  58.28  4207.00   1173.17  0.00     0.00     4207.00   1173.17  ?       ?      362.91  58.28  0.00    58.28  
1 1 1 2   -1  19 o 19 520.95  90.57  9368.63   2610.21  0.00     0.00     9368.63   2610.21  ?       ?      520.95  90.57  0.00    90.57  
1 1 1 2   -1  20 o 2  333.28  52.01  3448.99   962.66   0.00     0.00     3448.99   962.66   ?       ?      333.28  52.01  0.00    52.01  
1 1 1 2   -1  21 o 6  576.73  65.36  10806.28  2125.91  11131.84 3006.61  10480.77  3006.37  547.08  99.39  525.63  103.32 21.44   143.37 
1 1 1 2   -1  22 f 0  120.15  13.69  422.45    92.72    395.15   130.56   450.23    131.70   114.79  20.57  123.00  19.29  -8.21   28.19  
1 1 1 2   -1  23 o 8  243.65  38.36  1828.87   518.77   1828.87  518.77   0.00      0.00     243.65  38.36  ?       ?      0.00    38.36  
1 1 1 2   -1  24 o 19 431.23  76.26  6515.10   1818.76  6515.10  1818.76  0.00      0.00     431.23  76.26  ?       ?      0.00    76.26  
1 1 1 2   -1  25 o 8  128.34  16.66  486.59    119.88   520.66   167.65   450.93    171.50   131.27  23.09  121.40  25.42  9.87    34.34  
1 1 1 2   -1  26 o 5  325.11  36.05  3316.85   661.46   3184.35  935.31   3449.43   935.57   301.47  56.11  316.69  53.36  -15.22  77.43  
1 1 1 2   -1  27 o 2  145.35  17.99  630.51    146.92   545.12   207.39   716.55    208.17   131.51  28.31  152.77  24.57  -21.26  37.49  
1 1 1 2   -1  28 o 15 281.26  31.48  2516.24   499.53   2610.71  708.09   2422.65   704.80   271.32  47.17  259.05  49.19  12.28   68.16  
1 1 1 2   -1  29 o 1  86.80   17.86  232.30    86.05    258.18   128.43   211.22    115.92   90.01   24.29  81.86   23.46  8.15    33.77  
1 1 1 2   -1  30 o 11 88.47   18.17  243.16    89.19    344.67   132.19   158.34    120.84   103.94  22.78  72.45   24.47  31.49   33.44  
1 1 1 2   -1  31 o 11 80.20   18.91  203.29    85.65    229.68   128.60   182.26    114.81   83.88   24.90  75.65   23.74  8.23    34.41  
1 1 1 2   -1  32 o 9  140.36  28.07  674.33    218.25   0.00     0.00     674.33    218.25   ?       ?      140.36  28.07  0.00    28.07  
1 1 1 2   0   0  f 0  771.04  86.54  19128.57  3764.56  18818.40 5323.89  19438.74  5323.90  714.07  134.82 729.29  132.02 -15.23  188.70 
1 1 1 2   0   1  o 4  340.80  35.00  3428.42   674.96   3249.83  954.52   3607.01   954.55   326.12  52.79  345.08  49.61  -18.96  72.44  
1 1 1 2   0   2  o 6  65.39   6.72   124.11    24.88    131.57   35.04    116.52    35.34    67.01   9.36   62.87   10.14  4.14    13.80  
1 1 1 2   0   3  o 6  447.50  45.47  5980.79   1151.96  0.29     1628.79  11966.24  1629.46  185.97  81.09  634.65  45.02  -448.68 92.75  
1 1 1 2   0   4  o 3  339.81  35.02  3408.97   673.40   -12.13   951.96   6835.37   952.70   144.77  62.57  482.49  34.63  -337.72 71.51  
1 1 1 2   0   5  f 0  1046.09 134.69 40118.32  7901.11  38752.58 11173.84 41484.07  11173.86 866.68  223.23 916.91  215.88 -50.23  310.54 
1 1 1 2   0   6  o 4  488.42  78.24  7610.95   2119.66  0.00     0.00     7610.95   2119.66  ?       ?      488.42  78.24  0.00    78.24  
1 1 1 2   0   7  o 11 284.14  42.85  2430.16   677.21   0.00     0.00     2430.16   677.21   ?       ?      284.14  42.85  0.00    42.85  
1 1 1 2   0   8  o 8  184.67  27.47  1011.37   282.36   1011.37  282.36   0.00      0.00     184.67  27.47  ?       ?      0.00    27.47  
1 1 1 2   0   9  o 5  362.02  37.44  3891.66   766.78   3965.10  1084.37  3818.21   1084.40  359.14  54.29  351.78  55.54  7.36    77.67  
1 1 1 2   0   10 o 19 139.23  20.75  573.12    160.77   573.12   160.77   0.00      0.00     139.23  20.75  ?       ?      0.00    20.75  
1 1 1 2   0   11 o 15 415.18  67.44  5571.98   1552.23  5571.98  1552.23  0.00      0.00     415.18  67.44  ?       ?      0.00    67.44  
1 1 1 2   0   12 o 18 224.02  34.05  1519.46   424.09   1519.46  424.09   0.00      0.00     224.02  34.05  ?       ?      0.00    34.05  
1 1 1 2   0   13 o 5  61.14   7.52   109.12    25.83    118.85   36.15    98.97     36.93    63.43   10.28  57.57   11.58  5.86    15.48  
1 1 1 2   0   14 o 16 274.91  28.74  2265.26   446.83   2269.32  631.90   2261.19   631.92   268.81  42.35  268.27  42.44  0.54    59.96  
1 1 1 2   0   15 o 18 116.02  17.74  400.44    114.40   400.44   114.40   0.00      0.00     116.02  17.74  ?       ?      0.00    17.74  
1 1 1 2   0   16 o 2  393.69  70.37  5497.29   1531.96  0.00     0.00     5497.29   1531.96  ?       ?      393.69  70.37  0.00    70.37  
1 1 1 2   0   17 o 5  213.55  22.11  1347.32   267.15   1218.74  377.50   1476.33   378.12   199.09  34.27  220.91  30.64  -21.82  45.97  
1 1 1 2   0   18 o 15 287.67  29.90  2465.78   486.64   2507.15  688.09   2424.38   688.32   284.55  43.50  279.31  44.41  5.24    62.17  
1 1 1 2   0   19 o 12 377.06  39.49  4278.17   842.10   4498.49  1191.19  4058.05   1190.63  378.05  56.63  356.70  60.29  21.34   82.71  
1 1 1 2   0   20 o 11 318.75  49.53  3141.74   876.94   0.00     0.00     3141.74   876.94   ?       ?      318.75  49.53  0.00    49.53  
1 1 1 2   0   21 o 2  170.27  26.04  865.83    246.48   0.00     0.00     865.83    246.48   ?       ?      170.27  26.04  0.00    26.04  
1 1 1 2   0   22 o 9  339.94  35.89  3502.36   689.78   3662.86  976.17   3342.29   974.83   338.51  51.88  321.25  54.83  17.26   75.48  
1 1 1 2   0   23 o 6  200.45  21.17  1185.57   239.92   1235.57  338.61   1135.17   340.00   202.00  30.12  192.89  31.81  9.11    43.81  
1 1 1 2   0   24 o 17 414.21  72.33  5936.51   1657.33  5936.51  1657.33  0.00      0.00     414.21  72.33  ?       ?      0.00    72.33  
1 1 1 2   0   25 o 12 60.10   20.96  94.87     88.81    94.87    88.81    0.00      0.00     60.10   20.96  ?       ?      0.00    20.96  
1 1 1 2   0   26 o 18 336.26  60.90  4045.04   1132.34  4045.04  1132.34  0.00      0.00     336.26  60.90  ?       ?      0.00    60.90  
1 1 1 2   0   27 o 15 138.40  17.48  571.18    135.79   473.49   187.54   678.87    196.89   122.72  27.32  148.90  23.84  -26.18  36.26  
1 1 1 2   0   28 o 16 93.82   17.40  267.74    90.27    239.57   122.86   300.79    133.07   87.47   23.83  97.81   23.90  -10.35  33.75  
1 1 1 2   0   29 o 12 41.03   17.63  -0.81     74.81    9.57     100.80   -13.55    111.63   48.54   20.66  48.33   21.15  0.21    29.56  
1 1 1 2   0   30 o 17 151.37  19.54  704.31    165.87   577.42   233.16   834.34    236.01   130.29  31.52  160.83  26.48  -30.54  41.17  
1 1 1 2   0   31 o 5  186.52  22.56  1099.74   236.63   1015.45  336.74   1181.98   332.60   167.87  36.02  184.96  32.51  -17.08  48.52  
1 1 1 2   0   32 o 13 100.16  19.43  319.82    107.66   293.60   153.82   345.00    150.74   92.40   27.19  100.67  25.93  -8.27   37.57  
1 1 1 2   1   0  o 19 518.77  54.66  8144.89   1603.28  8066.65  2267.38  8223.13   2267.39  501.23  81.60  506.76  80.64  -5.53   114.73 
1 1 1 2   1   1  o 2  182.17  18.51  967.14    190.87   1028.22  269.93   906.07    269.92   186.61  25.89  174.57  27.87  12.04   38.04  
1 1 1 2   1   2  o 9  319.60  32.16  3005.92   582.00   -1.98    822.78   6018.09   823.37   135.49  58.36  453.39  31.84  -317.90 66.48  
1 1 1 2   1   3  o 12 211.59  21.26  1306.58   254.70   0.77     359.87   2617.27   360.54   91.04   38.89  300.24  21.05  -209.20 44.22  
1 1 1 2   1   4  o 5  385.67  39.83  4414.33   869.19   4378.95  1229.20  4449.72   1229.23  377.15  58.68  380.48  58.12  -3.33   82.59  
1 1 1 2   1   5  o 7  1051.40 136.24 40781.08  8029.99  41413.94 11356.13 40148.22  11356.12 903.59  220.83 880.46  224.13 23.13   314.64 
1 1 1 2   1   6  o 3  407.14  63.36  5144.39   1432.85  0.00     0.00     5144.39   1432.85  ?       ?      407.14  63.36  0.00    63.36  
1 1 1 2   1   7  o 1  483.52  77.43  7456.56   2076.70  0.00     0.00     7456.56   2076.70  ?       ?      483.52  77.43  0.00    77.43  
1 1 1 2   1   8  o 18 28.77   7.77   24.58     13.14    0.00     0.00     24.58     13.14    ?       ?      28.77   7.77   0.00    7.77   
1 1 1 2   1   9  o 18 263.15  26.90  2033.03   400.67   1985.37  566.60   2080.70   566.67   256.70  39.73  263.23  38.65  -6.53   55.43  
1 1 1 2   1   10 o 16 168.90  17.20  832.05    164.48   845.80   232.54   818.28    232.68   168.92  24.71  165.99  25.21  2.93    35.30  
1 1 1 2   1   11 o 6  128.20  19.15  486.01    136.64   486.01   136.64   0.00      0.00     128.20  19.15  ?       ?      0.00    19.15  
1 1 1 2   1   12 o 1  370.34  60.02  4423.18   1232.40  4423.18  1232.40  0.00      0.00     370.34  60.02  ?       ?      0.00    60.02  
1 1 1 2   1   13 o 5  196.41  29.83  1165.87   325.78   1165.87  325.78   0.00      0.00     196.41  29.83  ?       ?      0.00    29.83  
1 1 1 2   1   14 o 8  233.89  24.27  1624.92   321.17   1569.82  454.03   1680.10   454.36   225.30  36.34  233.85  34.91  -8.55   50.39  
1 1 1 2   1   15 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   1   16 o 11 149.13  15.44  652.09    130.28   649.30   184.00   654.90    184.50   147.12  22.50  147.77  22.45  -0.66   31.79  
1 1 1 2   1   17 o 7  264.36  27.53  2089.13   411.66   2215.13  582.28   1963.22   582.08   267.17  39.13  249.81  42.08  17.35   57.46  
1 1 1 2   1   18 o 2  461.14  83.36  7629.25   2125.67  7629.25  2125.67  0.00      0.00     461.14  83.36  ?       ?      0.00    83.36  
1 1 1 2   1   19 o 16 438.41  46.71  5886.49   1157.39  6319.83  1636.93  5453.30   1636.67  440.89  66.76  404.40  73.19  36.49   99.07  
1 1 1 2   1   20 o 6  359.89  37.56  3880.53   764.53   4004.32  1081.29  3756.77   1081.12  357.86  54.34  345.32  56.49  12.54   78.38  
1 1 1 2   1   21 o 2  129.88  20.34  500.98    146.70   0.00     0.00     500.98    146.70   ?       ?      129.88  20.34  0.00    20.34  
1 1 1 2   1   22 o 3  323.04  52.16  3343.60   934.36   0.00     0.00     3343.60   934.36   ?       ?      323.04  52.16  0.00    52.16  
1 1 1 2   1   23 o 7  328.77  34.97  3287.90   649.87   3370.65  919.67   3205.36   918.45   323.06  51.30  313.87  52.85  9.19    73.66  
1 1 1 2   1   24 o 16 117.84  16.20  409.81    106.69   462.35   150.58   356.84    151.19   124.05  21.95  108.16  24.87  15.89   33.17  
1 1 1 2   1   25 o 18 276.56  29.30  2299.08   458.05   2369.72  648.51   2228.76   647.05   274.33  42.56  265.08  44.07  9.25    61.26  
1 1 1 2   1   26 o 1  270.04  45.29  2396.98   677.20   2396.98  677.20   0.00      0.00     270.04  45.29  ?       ?      0.00    45.29  
1 1 1 2   1   27 f 0  157.04  27.61  769.00    239.85   769.00   239.85   0.00      0.00     157.04  27.61  ?       ?      0.00    27.61  
1 1 1 2   1   28 o 13 51.24   18.57  65.89     70.37    104.33   109.70   39.01     91.73    63.64   23.17  50.77   20.46  12.87   30.91  
1 1 1 2   1   29 o 2  163.87  19.23  816.25    177.45   852.42   256.39   782.99    245.85   162.43  28.54  155.50  28.60  6.93    40.40  
1 1 1 2   1   30 o 18 149.49  18.81  684.80    157.85   652.05   230.30   713.82    216.78   139.68  29.64  148.40  26.41  -8.72   39.70  
1 1 1 2   1   31 o 8  269.33  33.60  2524.48   508.27   2488.31  721.18   2560.17   716.44   235.99  54.36  241.90  53.06  -5.91   75.96  
1 1 1 2   1   32 o 6  96.13   20.48  298.77    109.56   229.91   163.26   355.17    147.77   82.75   28.44  102.36  25.29  -19.61  38.06  
1 1 1 2   1   33 o 13 97.39   21.37  313.35    116.20   298.74   179.39   323.92    152.53   90.82   29.80  95.90   26.72  -5.07   40.02  
1 1 1 2   2   0  o 7  414.54  42.91  5116.68   1006.50  4876.99  1423.39  5356.37   1423.43  395.80  64.89  416.82  61.32  -21.02  89.28  
1 1 1 2   2   1  f 0  307.56  31.50  2782.77   548.25   2927.94  775.35   2637.61   775.33   311.94  44.56  294.90  47.40  17.04   65.06  
1 1 1 2   2   2  o 16 246.92  24.31  1782.05   340.09   0.46     480.64   3568.41   481.28   104.78  44.86  350.26  24.08  -245.49 50.91  
1 1 1 2   2   3  o 13 486.02  49.10  7089.35   1351.24  -6.99    1910.60  14190.76  1911.28  199.41  87.37  689.42  48.60  -490.01 99.98  
1 1 1 2   2   4  o 8  558.23  59.44  9511.10   1875.68  9945.22  2652.61  9076.98   2652.60  553.86  86.23  525.19  91.29  28.66   125.58 
1 1 1 2   2   5  o 1  338.68  34.81  3386.34   667.15   3411.51  943.49   3361.16   943.51   334.95  50.65  332.26  51.10  2.69    71.95  
1 1 1 2   2   6  o 16 287.35  43.37  2487.87   693.18   0.00     0.00     2487.87   693.18   ?       ?      287.35  43.37  0.00    43.37  
1 1 1 2   2   7  o 15 62.74   9.79   115.85    34.11    0.00     0.00     115.85    34.11    ?       ?      62.74   9.79   0.00    9.79   
1 1 1 2   2   8  o 17 168.92  25.09  844.94    235.96   0.00     0.00     844.94    235.96   ?       ?      168.92  25.09  0.00    25.09  
1 1 1 2   2   9  o 17 275.92  28.26  2239.22   441.29   2236.85  624.08   2241.59   624.08   272.20  41.23  272.51  41.18  -0.31   58.27  
1 1 1 2   2   10 o 18 376.97  39.27  4250.02   837.28   4277.29  1184.10  4222.76   1184.09  370.01  57.62  367.38  58.07  2.64    81.81  
1 1 1 2   2   11 o 16 653.60  75.21  14071.33  2770.71  14024.57 3918.36  14118.09  3918.39  601.05  117.78 603.78  117.28 -2.73   166.21 
1 1 1 2   2   12 o 19 252.97  38.85  1958.69   546.21   1958.69  546.21   0.00      0.00     252.97  38.85  ?       ?      0.00    38.85  
1 1 1 2   2   13 f 0  215.33  32.93  1411.99   394.12   1411.99  394.12   0.00      0.00     215.33  32.93  ?       ?      0.00    32.93  
1 1 1 2   2   14 o 6  260.64  41.08  2130.94   594.35   2130.94  594.35   0.00      0.00     260.64  41.08  ?       ?      0.00    41.08  
1 1 1 2   2   15 o 1  50.17   10.79  75.42     30.14    0.00     0.00     75.42     30.14    ?       ?      50.17   10.79  0.00    10.79  
1 1 1 2   2   16 o 3  147.84  15.25  640.79    127.59   621.96   180.31   659.67    180.56   143.86  22.58  148.44  21.84  -4.59   31.41  
1 1 1 2   2   17 o 9  170.83  17.62  857.42    170.34   832.19   240.80   882.70    241.00   166.03  26.13  171.36  25.26  -5.33   36.34  
1 1 1 2   2   18 f 0  32.90   10.03  31.24     20.66    27.35    25.88    38.07     34.32    32.57   11.32  38.02   13.04  -5.45   17.27  
1 1 1 2   2   19 o 5  347.65  36.50  3630.35   717.63   3445.85  1014.72  3814.97   1015.06  329.36  55.65  348.75  52.31  -19.39  76.38  
1 1 1 2   2   20 o 18 120.01  12.99  419.92    88.10    335.84   123.20   507.89    126.02   105.77  21.03  131.46  17.10  -25.69  27.11  
1 1 1 2   2   21 o 19 410.20  43.66  5132.60   1012.23  5121.35  1431.50  5143.84   1431.53  396.21  65.20  397.22  65.03  -1.01   92.09  
1 1 1 2   2   22 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   2   23 o 19 246.64  38.92  1894.52   532.76   0.00     0.00     1894.52   532.76   ?       ?      246.64  38.92  0.00    38.92  
1 1 1 2   2   24 o 8  289.21  30.77  2515.66   503.03   2358.03  713.08   2671.80   709.73   271.78  47.43  291.75  43.72  -19.97  64.51  
1 1 1 2   2   25 o 9  194.97  31.68  1164.70   342.46   1164.70  342.46   0.00      0.00     194.97  31.68  ?       ?      0.00    31.68  
1 1 1 2   2   26 o 1  104.33  23.83  335.67    139.56   335.67   139.56   0.00      0.00     104.33  23.83  ?       ?      0.00    23.83  
1 1 1 2   2   27 o 4  72.77   23.70  155.49    113.60   155.49   113.60   0.00      0.00     72.77   23.70  ?       ?      0.00    23.70  
1 1 1 2   2   28 o 2  65.65   24.24  108.91    120.74   108.91   120.74   0.00      0.00     65.65   24.24  ?       ?      0.00    24.24  
1 1 1 2   2   29 o 15 120.65  17.80  443.18    119.60   350.26   174.23   525.96    164.46   103.29  28.47  129.40  22.98  -26.10  36.59  
1 1 1 2   2   30 o 16 233.49  27.37  1766.29   359.91   1754.47  512.84   1777.77   505.22   216.19  42.84  219.03  41.70  -2.84   59.78  
1 1 1 2   2   31 o 4  105.02  18.58  345.35    107.92   423.67   165.96   287.97    142.06   112.51  26.19  92.82   25.76  19.69   36.73  
1 1 1 2   2   32 f 0  88.49   20.07  253.79    99.59    289.49   157.99   230.25    128.29   91.15   27.73  82.62   24.95  8.53    37.30  
1 1 1 2   2   33 o 14 156.39  21.08  795.93    184.42   815.62   274.09   779.63    249.28   145.99  33.43  145.56  30.79  0.43    45.45  
1 1 1 2   3   0  o 14 191.86  19.48  1073.28   211.56   1080.61  299.18   1065.95   299.19   190.95  28.14  189.57  28.36  1.37    39.95  
1 1 1 2   3   1  o 15 342.78  35.07  3467.94   680.32   -8.48    961.79   6949.12   962.45   145.65  62.92  486.53  34.69  -340.88 71.85  
1 1 1 2   3   2  f 0  690.39  124.36 17049.16  4747.57  0.00     0.00     17049.16  4747.57  ?       ?      690.39  124.36 0.00    124.36 
1 1 1 2   3   3  o 5  393.40  60.93  4780.70   1331.51  0.00     0.00     4780.70   1331.51  ?       ?      393.40  60.93  0.00    60.93  
1 1 1 2   3   4  o 17 501.83  80.92  8086.36   2251.97  0.00     0.00     8086.36   2251.97  ?       ?      501.83  80.92  0.00    80.92  
1 1 1 2   3   5  o 12 366.49  56.38  4122.16   1148.21  0.00     0.00     4122.16   1148.21  ?       ?      366.49  56.38  0.00    56.38  
1 1 1 2   3   6  o 12 462.44  73.51  6772.97   1886.33  0.00     0.00     6772.97   1886.33  ?       ?      462.44  73.51  0.00    73.51  
1 1 1 2   3   7  o 14 250.34  37.58  1877.87   523.44   0.00     0.00     1877.87   523.44   ?       ?      250.34  37.58  0.00    37.58  
1 1 1 2   3   8  o 13 618.61  67.49  11973.65  2357.94  11986.36 3334.61  11960.94  3334.64  589.67  102.21 588.90  102.35 0.77    144.65 
1 1 1 2   3   9  o 14 456.95  48.27  6326.68   1247.19  6560.30  1763.80  6093.06   1763.79  452.94  70.10  434.17  73.38  18.77   101.48 
1 1 1 2   3   10 f 0  381.32  39.85  4364.42   859.44   4320.23  1215.41  4408.61   1215.46  370.07  59.21  374.30  58.48  -4.23   83.22  
1 1 1 2   3   11 o 16 138.07  20.62  565.19    158.42   565.19   158.42   0.00      0.00     138.07  20.62  ?       ?      0.00    20.62  
1 1 1 2   3   12 o 16 294.11  46.26  2709.73   755.25   2709.73  755.25   0.00      0.00     294.11  46.26  ?       ?      0.00    46.26  
1 1 1 2   3   13 o 10 203.27  31.03  1255.84   350.65   1255.84  350.65   0.00      0.00     203.27  31.03  ?       ?      0.00    31.03  
1 1 1 2   3   14 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   3   15 o 5  263.87  27.68  2093.43   412.99   2101.25  584.03   2085.62   584.09   257.85  40.81  256.77  41.00  1.09    57.85  
1 1 1 2   3   16 o 13 197.18  20.39  1149.94   227.48   1137.40  321.62   1162.48   321.79   192.90  30.02  195.19  29.65  -2.30   42.19  
1 1 1 2   3   17 o 6  350.99  37.63  3786.14   746.33   3752.61  1055.42  3819.68   1055.51  336.21  56.70  339.74  56.07  -3.53   79.74  
1 1 1 2   3   18 o 10 80.03   9.17   186.76    41.38    182.89   57.54    190.91    59.54    78.53   13.23  80.24   13.40  -1.72   18.83  
1 1 1 2   3   19 o 7  192.34  19.78  1084.39   215.30   1053.55  304.33   1115.29   304.64   187.30  29.26  193.07  28.33  -5.77   40.73  
1 1 1 2   3   20 o 18 422.97  45.01  5454.98   1076.22  5182.52  1521.94  5727.50   1522.08  397.13  69.28  420.86  65.10  -23.73  95.06  
1 1 1 2   3   21 o 5  59.27   13.73  105.44    45.78    98.80    71.11    110.14    59.82    58.89   18.71  60.75   16.66  -1.85   25.05  
1 1 1 2   3   22 o 5  149.10  16.26  652.03    136.95   642.04   195.09   661.73    192.28   146.13  24.10  148.61  23.30  -2.48   33.52  
1 1 1 2   3   23 f 0  410.34  75.20  6117.13   1706.27  0.00     0.00     6117.13   1706.27  ?       ?      410.34  75.20  0.00    75.20  
1 1 1 2   3   24 o 16 146.64  24.58  648.45    199.58   0.00     0.00     648.45    199.58   ?       ?      146.64  24.58  0.00    24.58  
1 1 1 2   3   25 o 10 69.01   17.23  143.98    68.06    163.94   106.66   130.27    88.39    74.50   22.80  66.83   20.81  7.67    30.87  
1 1 1 2   3   26 o 7  74.38   22.96  164.88    107.85   164.88   107.85   0.00      0.00     74.38   22.96  ?       ?      0.00    22.96  
1 1 1 2   3   27 o 13 87.11   23.82  236.13    122.50   236.13   122.50   0.00      0.00     87.11   23.82  ?       ?      0.00    23.82  
1 1 1 2   3   28 o 7  260.86  48.61  2478.34   701.16   2478.34  701.16   0.00      0.00     260.86  48.61  ?       ?      0.00    48.61  
1 1 1 2   3   29 o 16 161.58  29.91  859.49    267.25   859.49   267.25   0.00      0.00     161.58  29.91  ?       ?      0.00    29.91  
1 1 1 2   3   30 f 0  84.52   24.51  232.24    125.83   0.00     0.00     232.24    125.83   ?       ?      84.52   24.51  0.00    24.51  
1 1 1 2   3   31 o 11 81.09   20.66  212.32    96.46    193.02   145.91   227.30    128.56   77.73   26.88  82.86   24.97  -5.13   36.69  
1 1 1 2   3   32 o 17 148.52  30.87  795.02    254.58   0.00     0.00     795.02    254.58   ?       ?      148.52  30.87  0.00    30.87  
1 1 1 2   3   33 o 18 68.46   22.16  155.00    99.41    81.10    157.31   204.12    128.26   62.68   26.19  76.91   25.19  -14.23  36.34  
1 1 1 2   4   0  o 18 618.38  66.46  11797.36  2322.43  11886.93 3284.43  11707.79  3284.41  596.77  99.36  591.40  100.32 5.37    141.20 
1 1 1 2   4   1  o 11 342.53  52.28  3573.75   995.48   0.00     0.00     3573.75   995.48   ?       ?      342.53  52.28  0.00    52.28  
1 1 1 2   4   2  o 12 430.25  67.40  5781.25   1610.14  0.00     0.00     5781.25   1610.14  ?       ?      430.25  67.40  0.00    67.40  
1 1 1 2   4   3  o 16 749.30  143.27 21324.95  5938.20  0.00     0.00     21324.95  5938.20  ?       ?      749.30  143.27 0.00    143.27 
1 1 1 2   4   4  o 15 533.91  56.40  8661.25   1702.62  8334.44  2407.84  8988.08   2407.89  506.16  85.94  528.66  81.99  -22.51  118.78 
1 1 1 2   4   5  o 10 622.98  67.44  12048.17  2373.38  12247.40 3356.47  11848.93  3356.47  602.22  100.64 590.33  102.78 11.90   143.84 
1 1 1 2   4   6  o 12 348.45  36.00  3595.67   709.72   3843.81  1003.71  3347.54   1003.68  355.32  50.64  329.50  55.00  25.82   74.76  
1 1 1 2   4   7  o 7  469.25  49.46  6660.38   1312.41  6712.01  1856.01  6608.74   1856.06  458.06  73.03  454.02  73.74  4.04    103.79 
1 1 1 2   4   8  o 4  422.27  44.30  5366.40   1057.89  5441.34  1496.07  5291.46   1496.10  414.80  64.96  408.30  66.09  6.49    92.67  
1 1 1 2   4   9  o 17 336.07  34.86  3361.55   662.77   3407.58  937.29   3315.52   937.32   332.05  50.78  327.07  51.63  4.98    72.42  
1 1 1 2   4   10 o 18 133.21  19.86  525.43    147.27   525.43   147.27   0.00      0.00     133.21  19.86  ?       ?      0.00    19.86  
1 1 1 2   4   11 o 12 375.62  61.62  4603.91   1282.59  4603.91  1282.59  0.00      0.00     375.62  61.62  ?       ?      0.00    61.62  
1 1 1 2   4   12 o 9  95.68   14.51  270.71    77.21    270.71   77.21    0.00      0.00     95.68   14.51  ?       ?      0.00    14.51  
1 1 1 2   4   13 o 14 145.91  22.01  637.14    178.61   637.14   178.61   0.00      0.00     145.91  22.01  ?       ?      0.00    22.01  
1 1 1 2   4   14 o 18 220.97  34.35  1510.09   421.60   0.00     0.00     1510.09   421.60   ?       ?      220.97  34.35  0.00    34.35  
1 1 1 2   4   15 o 11 202.15  20.91  1210.44   239.20   1206.11  338.22   1214.78   338.33   198.38  30.69  199.16  30.57  -0.77   43.31  
1 1 1 2   4   16 o 19 62.71   7.58   114.81    26.72    104.56   37.48    125.40    38.11    59.18   11.45  65.11   10.56  -5.92   15.57  
1 1 1 2   4   17 o 3  441.17  49.06  6199.70   1221.63  6225.02  1727.62  6174.37   1727.69  416.70  74.98  414.54  75.38  2.17    106.32 
1 1 1 2   4   18 o 7  394.38  42.19  4774.40   940.33   4696.09  1329.77  4852.73   1329.88  376.32  63.83  383.66  62.53  -7.34   89.36  
1 1 1 2   4   19 o 19 375.07  39.51  4252.72   837.99   4195.44  1185.04  4310.00   1185.15  361.82  59.09  367.41  58.12  -5.60   82.88  
1 1 1 2   4   20 o 13 241.04  24.85  1712.52   338.92   1560.05  478.37   1866.18   480.24   225.94  38.24  248.85  34.55  -22.91  51.54  
1 1 1 2   4   21 f 0  346.47  36.58  3628.69   716.56   3589.32  1013.30  3668.06   1013.43  334.75  54.61  338.91  53.89  -4.16   76.72  
1 1 1 2   4   22 o 16 531.46  62.69  9516.98   1875.75  9425.16  2652.67  9608.81   2652.75  478.95  99.72  485.59  98.53  -6.64   140.19 
1 1 1 2   4   23 o 6  272.99  43.94  2370.94   665.27   0.00     0.00     2370.94   665.27   ?       ?      272.99  43.94  0.00    43.94  
1 1 1 2   4   24 o 18 147.49  24.68  656.77    201.57   0.00     0.00     656.77    201.57   ?       ?      147.49  24.68  0.00    24.68  
1 1 1 2   4   25 o 1  311.87  33.59  2979.86   591.96   2944.88  838.16   3014.67   836.16   298.73  50.68  302.97  49.80  -4.24   71.06  
1 1 1 2   4   26 o 18 164.76  19.08  809.52    177.17   719.58   251.06   898.73    250.05   151.23  29.98  171.03  26.31  -19.79  39.89  
1 1 1 2   4   27 o 11 68.03   19.05  141.39    77.35    146.89   113.68   136.66    105.55   71.11   23.74  68.69   22.87  2.42    32.96  
1 1 1 2   4   28 o 13 117.45  25.30  439.03    165.55   439.03   165.55   0.00      0.00     117.45  25.30  ?       ?      0.00    25.30  
1 1 1 2   4   29 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   4   30 o 14 82.30   26.22  220.60    139.50   220.60   139.50   0.00      0.00     82.30   26.22  ?       ?      0.00    26.22  
1 1 1 2   4   31 f 0  88.40   18.00  247.13    88.27    280.81   148.00   228.54    109.96   90.70   26.66  83.31   22.48  7.39    34.87  
1 1 1 2   4   32 o 12 196.51  25.13  1302.24   277.01   1143.07  398.97   1450.38   384.90   161.77  42.44  193.65  35.95  -31.88  55.62  
1 1 1 2   4   33 o 15 49.95   22.01  3.20      122.88   0.00     0.00     3.20      122.88   ?       ?      49.95   22.01  0.00    22.01  
1 1 1 2   5   0  o 11 9.15    4.59   -30.56    10.44    -30.56   10.44    0.00      0.00     9.15    4.59   ?       ?      0.00    4.59   
1 1 1 2   5   1  o 9  672.27  76.39  14307.81  2895.79  0.55     4094.82  28621.38  4095.72  271.55  122.81 953.97  75.40  -682.41 144.11 
1 1 1 2   5   2  o 5  527.55  55.94  8469.98   1668.23  8410.89  2359.23  8529.07   2359.23  508.82  83.68  512.94  82.95  -4.12   117.82 
1 1 1 2   5   3  o 3  313.94  47.79  2993.84   834.12   0.00     0.00     2993.84   834.12   ?       ?      313.94  47.79  0.00    47.79  
1 1 1 2   5   4  o 5  823.95  96.63  22754.27  4484.04  23838.13 6341.41  21670.42  6341.38  775.44  147.85 724.92  156.94 50.52   215.61 
1 1 1 2   5   5  o 8  1124.40 178.63 56607.97  11145.25 56528.32 15761.75 56687.62  15761.77 820.00  279.49 822.25  279.51 -2.25   395.27 
1 1 1 2   5   6  o 13 176.04  26.21  920.03    256.84   920.03   256.84   0.00      0.00     176.04  26.21  ?       ?      0.00    26.21  
1 1 1 2   5   7  o 8  108.38  16.17  346.33    97.52    346.33   97.52    0.00      0.00     108.38  16.17  ?       ?      0.00    16.17  
1 1 1 2   5   8  o 9  431.15  70.52  6049.83   1685.09  6049.83  1685.09  0.00      0.00     431.15  70.52  ?       ?      0.00    70.52  
1 1 1 2   5   9  o 16 359.06  57.27  4095.04   1140.84  4095.04  1140.84  0.00      0.00     359.06  57.27  ?       ?      0.00    57.27  
1 1 1 2   5   10 o 14 252.79  38.88  1959.10   546.23   1959.10  546.23   0.00      0.00     252.79  38.88  ?       ?      0.00    38.88  
1 1 1 2   5   11 o 16 126.26  18.97  473.55    133.22   473.55   133.22   0.00      0.00     126.26  18.97  ?       ?      0.00    18.97  
1 1 1 2   5   12 o 14 278.14  29.13  2323.77   458.26   2330.82  648.01   2316.72   648.14   271.84  42.95  270.90  43.12  0.93    60.86  
1 1 1 2   5   13 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   5   14 o 1  130.06  13.45  495.10    98.96    509.89   139.89   480.27    140.03   130.75  19.21  126.65  19.92  4.10    27.67  
1 1 1 2   5   15 o 13 80.62   8.77   189.49    39.96    190.08   56.14    188.88    56.87    80.11   12.63  79.81   12.85  0.30    18.02  
1 1 1 2   5   16 o 6  134.39  13.89  528.44    105.61   523.87   149.17   533.02    149.55   132.42  20.27  133.63  20.12  -1.21   28.56  
1 1 1 2   5   17 o 17 426.73  46.70  5717.11   1125.30  5621.97  1591.33  5812.27   1591.50  401.48  71.68  409.81  70.17  -8.33   100.31 
1 1 1 2   5   18 o 10 203.65  20.93  1218.73   241.18   1205.21  340.94   1232.28   341.21   199.92  30.69  202.31  30.31  -2.39   43.13  
1 1 1 2   5   19 o 11 184.45  18.95  996.24    197.81   995.35   279.63   997.13    279.87   182.41  27.56  182.58  27.56  -0.17   38.98  
1 1 1 2   5   20 o 16 130.78  14.50  499.82    107.01   530.92   151.98   469.25    150.69   133.72  20.45  125.28  21.74  8.44    29.85  
1 1 1 2   5   21 o 16 359.84  38.47  3958.50   782.34   4054.88  1106.52  3862.16   1106.29  352.47  56.60  342.61  58.34  9.87    81.28  
1 1 1 2   5   22 o 15 224.68  23.61  1501.36   299.92   1417.20  423.88   1585.74   424.43   213.53  35.85  227.14  33.56  -13.61  49.11  
1 1 1 2   5   23 o 12 247.13  39.36  1914.79   539.69   0.00     0.00     1914.79   539.69   ?       ?      247.13  39.36  0.00    39.36  
1 1 1 2   5   24 o 2  321.70  53.73  3417.65   957.22   0.00     0.00     3417.65   957.22   ?       ?      321.70  53.73  0.00    53.73  
1 1 1 2   5   25 o 19 36.65   15.73  -3.11     59.40    -16.12   87.15    8.17      81.17    42.85   18.72  44.37   18.69  -1.53   26.45  
1 1 1 2   5   26 o 2  127.85  15.61  485.10    112.18   469.21   158.01   501.25    159.30   123.41  23.15  127.87  22.52  -4.46   32.30  
1 1 1 2   5   27 o 10 216.20  24.05  1434.75   293.43   1259.18  412.37   1614.81   417.62   193.06  38.56  223.02  33.67  -29.96  51.19  
1 1 1 2   5   28 o 13 131.44  24.19  546.09    175.83   546.09   175.83   0.00      0.00     131.44  24.19  ?       ?      0.00    24.19  
1 1 1 2   5   29 o 14 127.93  24.66  529.05    174.52   529.05   174.52   0.00      0.00     127.93  24.66  ?       ?      0.00    24.66  
1 1 1 2   5   30 o 11 79.03   23.63  203.67    115.48   203.67   115.48   0.00      0.00     79.03   23.63  ?       ?      0.00    23.63  
1 1 1 2   5   31 o 4  84.41   24.25  240.14    123.72   240.14   123.72   0.00      0.00     84.41   24.25  ?       ?      0.00    24.25  
1 1 1 2   5   32 o 1  76.97   18.93  194.12    83.07    191.44   126.93   196.13    109.88   74.96   25.08  75.95   23.13  -0.99   34.12  
1 1 1 2   5   33 o 14 75.65   23.23  199.53    110.58   0.00     0.00     199.53    110.58   ?       ?      75.65   23.23  0.00    23.23  
1 1 1 2   6   0  o 16 190.41  83.82  0.66      1777.90  1.32     2514.33  0.00      2514.32  220.04  98.12  220.02  98.12  0.03    138.76 
1 1 1 2   6   1  o 2  467.43  49.94  6633.22   1319.45  -16.21   1865.42  13290.65  1866.54  194.05  85.63  663.60  49.35  -469.55 98.83  
1 1 1 2   6   2  o 6  249.41  37.61  1871.36   521.71   1871.36  521.71   0.00      0.00     249.41  37.61  ?       ?      0.00    37.61  
1 1 1 2   6   3  o 12 407.23  64.67  5246.51   1461.43  5246.51  1461.43  0.00      0.00     407.23  64.67  ?       ?      0.00    64.67  
1 1 1 2   6   4  f 0  116.05  17.29  397.30    111.65   397.30   111.65   0.00      0.00     116.05  17.29  ?       ?      0.00    17.29  
1 1 1 2   6   5  f 0  323.90  50.13  3237.34   902.00   3237.34  902.00   0.00      0.00     323.90  50.13  ?       ?      0.00    50.13  
1 1 1 2   6   6  o 10 478.76  81.05  7712.54   2148.07  7712.54  2148.07  0.00      0.00     478.76  81.05  ?       ?      0.00    81.05  
1 1 1 2   6   7  o 2  245.70  37.39  1831.72   510.71   1831.72  510.71   0.00      0.00     245.70  37.39  ?       ?      0.00    37.39  
1 1 1 2   6   8  o 5  278.60  28.86  2305.16   454.87   2341.31  643.27   2269.00   643.30   275.88  41.94  271.17  42.74  4.71    59.88  
1 1 1 2   6   9  o 10 155.51  15.95  707.38    140.34   734.24   198.33   680.43    198.62   157.03  22.66  150.79  23.73  6.24    32.81  
1 1 1 2   6   10 o 15 453.68  50.23  6541.74   1286.29  6344.51  1819.03  6739.00   1819.15  419.75  78.37  436.11  75.39  -16.36  108.74 
1 1 1 2   6   11 f 0  103.47  10.70  312.12    62.62    301.30   88.29    323.07    88.84    100.73  15.79  104.49  15.26  -3.76   21.96  
1 1 1 2   6   12 o 16 172.77  26.29  903.04    252.50   903.04   252.50   0.00      0.00     172.77  26.29  ?       ?      0.00    26.29  
1 1 1 2   6   13 o 10 66.93   11.22  132.87    41.58    0.00     0.00     132.87    41.58    ?       ?      66.93   11.22  0.00    11.22  
1 1 1 2   6   14 f 0  102.03  10.77  303.86    62.11    318.60   87.82    289.10    87.85    103.68  15.21  98.48   16.09  5.20    22.14  
1 1 1 2   6   15 o 9  149.46  15.38  655.01    130.08   648.41   183.80   661.63    184.13   146.98  22.50  148.56  22.28  -1.58   31.66  
1 1 1 2   6   16 o 15 261.82  27.33  2048.16   404.71   2075.59  572.29   2020.73   572.41   258.11  39.91  254.29  40.58  3.82    56.91  
1 1 1 2   6   17 o 19 216.39  22.33  1380.34   273.42   1406.21  386.54   1354.42   386.81   215.47  32.24  211.14  32.99  4.33    46.13  
1 1 1 2   6   18 o 3  203.70  20.87  1218.11   240.61   1182.66  340.02   1253.67   340.53   198.11  30.91  204.38  29.91  -6.27   43.01  
1 1 1 2   6   19 o 5  267.53  27.39  2118.60   414.75   1903.57  585.91   2334.54   587.17   248.19  42.66  277.35  37.87  -29.17  57.04  
1 1 1 2   6   20 o 19 276.71  29.00  2281.24   453.79   2395.52  642.69   2167.62   640.83   278.58  41.45  263.67  43.88  14.91   60.36  
1 1 1 2   6   21 o 18 151.26  24.72  689.92    207.26   689.92   207.26   0.00      0.00     151.26  24.72  ?       ?      0.00    24.72  
1 1 1 2   6   22 o 1  409.30  77.66  6302.97   1757.98  0.00     0.00     6302.97   1757.98  ?       ?      409.30  77.66  0.00    77.66  
1 1 1 2   6   23 o 19 365.75  63.99  4632.93   1294.72  0.00     0.00     4632.93   1294.72  ?       ?      365.75  63.99  0.00    63.99  
1 1 1 2   6   24 o 8  327.64  55.89  3617.12   1013.51  0.00     0.00     3617.12   1013.51  ?       ?      327.64  55.89  0.00    55.89  
1 1 1 2   6   25 o 1  54.98   18.61  83.13     69.90    77.98    107.05   86.96     92.29    59.69   22.66  58.86   21.28  0.82    31.09  
1 1 1 2   6   26 o 6  46.71   17.37  50.57     62.17    56.70    96.60    46.23     81.24    54.38   21.29  49.79   19.52  4.58    28.88  
1 1 1 2   6   27 o 9  60.73   19.47  108.91    76.81    199.44   105.74   7.80      111.75   79.88   22.24  50.79   21.68  29.09   31.06  
1 1 1 2   6   28 f 0  104.77  24.64  354.45    145.66   354.45   145.66   0.00      0.00     104.77  24.64  ?       ?      0.00    24.64  
1 1 1 2   6   29 o 1  72.28   24.48  161.61    120.86   161.61   120.86   0.00      0.00     72.28   24.48  ?       ?      0.00    24.48  
1 1 1 2   6   30 o 18 111.60  26.82  425.91    169.69   425.91   169.69   0.00      0.00     111.60  26.82  ?       ?      0.00    26.82  
1 1 1 2   6   31 o 18 149.50  20.47  719.27    171.09   700.31   243.39   737.79    240.55   137.84  31.45  142.82  30.28  -4.98   43.66  
1 1 1 2   6   32 o 4  52.44   21.15  60.12     98.13    42.71    143.30   75.49     134.66   56.71   24.39  59.05   24.41  -2.34   34.51  
1 1 1 2   7   0  o 11 30.59   12.90  2.41      38.69    2.29     54.61    2.52      54.81    36.13   15.28  36.23   15.32  -0.10   21.64  
1 1 1 2   7   1  o 19 361.77  31.57  3879.12   649.10   4624.15  1124.07  3506.41   795.05   385.46  52.13  339.89  41.61  45.58   66.71  
1 1 1 2   7   2  o 11 457.66  49.06  6441.79   1268.76  6599.78  1794.30  6283.82   1794.29  446.85  72.42  434.07  74.70  12.78   104.05 
1 1 1 2   7   3  o 2  316.74  32.89  2990.60   589.37   2959.63  833.48   3021.57   833.50   308.58  48.66  312.14  48.06  -3.56   68.39  
1 1 1 2   7   4  o 1  353.72  37.05  3762.95   741.21   3815.77  1048.25  3710.13   1048.21  347.60  54.31  342.14  55.25  5.46    77.47  
1 1 1 2   7   5  o 10 169.15  17.29  836.90    165.50   907.67   234.05   766.13    234.04   174.81  23.95  159.75  26.44  15.06   35.68  
1 1 1 2   7   6  o 15 495.54  54.89  7795.72   1535.35  7790.22  2171.30  7801.22   2171.33  467.61  83.97  468.02  83.90  -0.42   118.70 
1 1 1 2   7   7  o 4  72.23   7.84   151.83    31.98    161.73   45.14    141.85    45.31    74.12   10.94  69.17   11.84  4.95    16.12  
1 1 1 2   7   8  o 1  169.50  17.35  842.54    166.45   826.39   235.32   858.71    235.47   165.84  25.54  169.27  24.98  -3.43   35.72  
1 1 1 2   7   9  o 11 221.32  22.91  1451.70   286.84   1474.59  405.60   1428.79   405.71   219.43  33.24  215.67  33.88  3.75    47.47  
1 1 1 2   7   10 o 5  280.85  29.57  2377.22   469.67   2442.07  664.19   2312.36   664.25   277.70  43.06  269.24  44.53  8.45    61.94  
1 1 1 2   7   11 o 3  330.10  35.34  3351.18   659.30   3272.22  932.29   3430.17   932.48   313.27  53.78  322.12  52.21  -8.84   74.95  
1 1 1 2   7   12 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   7   13 o 7  264.62  27.84  2109.30   416.59   2136.13  589.08   2082.46   589.21   259.63  40.87  255.91  41.53  3.72    58.27  
1 1 1 2   7   14 o 14 152.98  15.82  686.64    136.89   709.71   193.46   663.50    193.74   153.90  22.57  148.44  23.52  5.46    32.59  
1 1 1 2   7   15 o 1  87.91   9.46   225.19    46.99    218.69   65.93    231.90    67.00    85.89   13.84  88.54   13.62  -2.65   19.42  
1 1 1 2   7   16 o 14 286.46  29.95  2452.40   485.24   2505.60  686.17   2399.19   686.29   283.65  43.53  276.88  44.70  6.77    62.39  
1 1 1 2   7   17 f 0  254.24  26.32  1912.40   378.66   1947.57  535.43   1877.22   535.57   252.64  38.10  247.62  38.96  5.02    54.50  
1 1 1 2   7   18 o 6  313.53  32.78  2936.44   581.31   3012.94  822.04   2859.92   822.14   311.26  47.51  302.37  49.04  8.89    68.28  
1 1 1 2   7   19 o 11 230.04  23.96  1562.30   311.76   1596.05  441.32   1528.68   440.46   229.23  34.61  223.96  35.44  5.27    49.54  
1 1 1 2   7   20 o 14 274.73  28.82  2261.29   447.72   2252.10  633.10   2270.48   633.24   267.84  42.60  269.05  42.40  -1.21   60.11  
1 1 1 2   7   21 o 6  225.71  35.66  1584.19   446.78   0.00     0.00     1584.19   446.78   ?       ?      225.71  35.66  0.00    35.66  
1 1 1 2   7   22 o 2  305.34  50.68  3063.09   857.27   0.00     0.00     3063.09   857.27   ?       ?      305.34  50.68  0.00    50.68  
1 1 1 2   7   23 o 9  134.53  23.46  547.56    174.59   0.00     0.00     547.56    174.59   ?       ?      134.53  23.46  0.00    23.46  
1 1 1 2   7   24 o 3  90.22   20.98  248.99    106.57   0.00     0.00     248.99    106.57   ?       ?      90.22   20.98  0.00    20.98  
1 1 1 2   7   25 o 2  59.20   19.35  100.59    75.69    127.87   131.31   87.01     92.63    70.05   25.37  58.73   21.31  11.32   33.13  
1 1 1 2   7   26 o 5  134.93  17.73  548.14    134.03   574.65   203.83   527.95    177.91   134.26  27.38  129.65  24.81  4.61    36.94  
1 1 1 2   7   27 o 7  74.86   19.40  174.88    84.05    245.38   138.36   133.65    105.81   87.63   25.78  67.57   22.90  20.05   34.49  
1 1 1 2   7   28 o 11 102.37  24.84  342.96    144.50   342.96   144.50   0.00      0.00     102.37  24.84  ?       ?      0.00    24.84  
1 1 1 2   7   29 o 9  75.89   24.99  185.33    126.17   185.33   126.17   0.00      0.00     75.89   24.99  ?       ?      0.00    24.99  
1 1 1 2   7   30 o 17 46.25   21.09  -50.15    123.80   -50.15   123.80   0.00      0.00     46.25   21.09  ?       ?      0.00    21.09  
1 1 1 2   7   31 o 13 91.52   21.16  280.02    108.95   266.40   157.43   292.54    150.94   85.88   27.90  90.13   27.03  -4.26   38.85  
1 1 1 2   7   32 o 6  122.61  21.39  508.62    145.07   419.87   207.52   593.45    202.88   101.03  31.95  125.09  28.84  -24.05  43.04  
1 1 1 2   8   0  o 3  142.63  7.60   586.75    62.04    -20.41   82.31    1385.34   94.40    41.21   18.09  219.35  7.51   -178.14 19.59  
1 1 1 2   8   1  o 14 156.64  12.65  712.75    112.80   675.31   193.44   732.04    138.86   150.33  23.16  158.30  15.48  -7.97   27.85  
1 1 1 2   8   2  o 19 174.15  15.46  884.61    152.96   983.88   263.67   834.25    187.78   181.26  26.09  168.21  19.83  13.06   32.77  
1 1 1 2   8   3  o 17 128.81  13.22  484.21    96.39    474.65   136.27   493.78    136.37   126.34  19.41  129.00  18.98  -2.67   27.15  
1 1 1 2   8   4  o 9  264.57  27.48  2086.05   411.24   1982.76  581.54   2189.37   581.61   252.08  41.64  266.28  39.22  -14.20  57.20  
1 1 1 2   8   5  o 5  433.61  47.69  5928.11   1167.64  6141.77  1651.31  5714.47   1651.26  420.26  70.97  401.79  74.33  18.47   102.77 
1 1 1 2   8   6  o 18 307.05  32.37  2851.25   561.92   2786.84  794.66   2915.67   794.69   294.56  48.69  302.25  47.35  -7.69   67.92  
1 1 1 2   8   7  o 19 108.93  11.30  346.08    69.65    362.99   98.50    329.18    98.50    110.75  15.95  105.17  16.89  5.58    23.23  
1 1 1 2   8   8  o 7  89.51   9.44   233.45    47.77    229.08   67.38    237.87    67.74    87.92   13.80  89.67   13.58  -1.75   19.37  
1 1 1 2   8   9  o 9  141.91  14.58  590.01    117.11   576.40   165.59   603.62    165.65   138.64  21.50  142.09  20.93  -3.45   30.01  
1 1 1 2   8   10 o 8  200.28  20.62  1187.05   233.72   1134.49  330.44   1239.65   330.61   192.22  31.00  201.72  29.41  -9.50   42.73  
1 1 1 2   8   11 o 18 222.47  34.69  1535.00   428.54   1535.00  428.54   0.00      0.00     222.47  34.69  ?       ?      0.00    34.69  
1 1 1 2   8   12 o 13 66.85   11.61  132.77    42.95    0.00     0.00     132.77    42.95    ?       ?      66.85   11.61  0.00    11.61  
1 1 1 2   8   13 o 8  107.57  11.27  337.59    68.57    330.21   96.65    345.07    97.31    105.40  16.51  107.86  16.22  -2.46   23.15  
1 1 1 2   8   14 o 15 242.63  25.00  1748.12   343.29   1661.77  485.31   1834.60   485.67   231.70  37.79  244.61  35.63  -12.92  51.94  
1 1 1 2   8   15 o 2  189.19  19.48  1050.84   208.53   1065.98  294.75   1035.67   295.07   188.35  28.12  185.45  28.64  2.90    40.13  
1 1 1 2   8   16 o 11 103.41  11.02  311.51    64.40    316.58   90.46    306.31    91.70    103.50  15.72  101.67  16.26  1.83    22.62  
1 1 1 2   8   17 f 0  435.60  47.35  5850.71   1165.09  6327.97  1647.78  5373.55   1647.60  438.47  67.64  397.88  74.88  40.59   100.91 
1 1 1 2   8   18 o 13 331.80  34.59  3310.65   649.22   3156.18  917.62   3465.47   918.64   314.93  52.61  331.93  49.74  -17.00  72.40  
1 1 1 2   8   19 o 5  167.23  26.12  842.57    242.55   0.00     0.00     842.57    242.55   ?       ?      167.23  26.12  0.00    26.12  
1 1 1 2   8   20 o 15 223.53  35.32  1551.26   438.16   0.00     0.00     1551.26   438.16   ?       ?      223.53  35.32  0.00    35.32  
1 1 1 2   8   21 o 11 138.33  23.17  578.25    177.48   0.00     0.00     578.25    177.48   ?       ?      138.33  23.17  0.00    23.17  
1 1 1 2   8   22 o 1  308.70  51.48  3139.06   880.11   0.00     0.00     3139.06   880.11   ?       ?      308.70  51.48  0.00    51.48  
1 1 1 2   8   23 o 1  60.24   21.28  94.26     91.77    0.00     0.00     94.26     91.77    ?       ?      60.24   21.28  0.00    21.28  
1 1 1 2   8   24 o 19 216.52  23.70  1417.32   289.80   1535.22  411.23   1301.00   408.47   220.16  33.60  200.50  36.85  19.66   49.87  
1 1 1 2   8   25 f 0  165.44  18.71  822.50    174.59   697.71   243.16   955.29    250.84   147.34  29.77  175.21  25.70  -27.87  39.33  
1 1 1 2   8   26 o 3  137.39  17.12  568.74    132.10   570.43   182.90   566.89    191.00   134.42  24.61  133.38  25.88  1.03    35.71  
1 1 1 2   8   27 o 9  74.12   23.39  171.58    111.30   171.58   111.30   0.00      0.00     74.12   23.39  ?       ?      0.00    23.39  
1 1 1 2   8   28 o 6  68.47   26.00  126.69    140.97   126.69   140.97   0.00      0.00     68.47   26.00  ?       ?      0.00    26.00  
1 1 1 2   8   29 o 9  72.78   27.29  158.74    154.11   158.74   154.11   0.00      0.00     72.78   27.29  ?       ?      0.00    27.29  
1 1 1 2   8   30 o 4  110.85  20.27  400.19    124.22   408.43   200.25   395.03    158.38   104.07  31.12  106.08  26.17  -2.01   40.66  
1 1 1 2   8   31 o 7  84.94   23.89  255.11    121.33   227.97   183.58   276.16    161.68   79.16   29.76  85.77   28.30  -6.61   41.07  
1 1 1 2   8   32 o 17 169.41  24.86  1027.22   234.59   905.50   339.89   1137.94   324.18   133.79  40.66  161.99  35.81  -28.20  54.18  
1 1 1 2   9   0  o 18 151.37  22.88  685.77    192.63   0.00     0.00     685.77    192.63   ?       ?      151.37  22.88  0.00    22.88  
1 1 1 2   9   1  o 2  164.70  24.96  815.30    228.63   0.00     0.00     815.30    228.63   ?       ?      164.70  24.96  0.00    24.96  
1 1 1 2   9   2  o 19 428.24  45.89  5779.95   1110.67  0.00     0.00     5779.95   1110.67  ?       ?      428.24  45.89  0.00    45.89  
1 1 1 2   9   3  o 15 188.14  15.55  1033.32   166.40   1106.28  283.88   995.13    205.38   191.80  26.49  183.64  19.79  8.15    33.07  
1 1 1 2   9   4  o 18 321.55  34.17  3150.38   621.03   3143.08  878.39   3157.66   878.15   310.76  51.01  311.61  50.84  -0.85   72.02  
1 1 1 2   9   5  o 8  290.52  30.65  2549.19   503.40   2726.25  712.16   2372.38   711.66   293.51  43.59  271.21  47.44  22.30   64.42  
1 1 1 2   9   6  o 6  248.00  25.89  1837.46   363.16   1977.35  513.84   1697.85   513.33   252.74  36.47  232.23  39.95  20.51   54.09  
1 1 1 2   9   7  o 9  277.94  29.26  2328.12   459.89   2470.81  650.63   2185.65   650.13   279.89  41.77  261.13  44.99  18.76   61.39  
1 1 1 2   9   8  o 5  78.58   9.33   180.42    41.27    237.03   61.18    133.15    55.91    89.75   12.19  66.46   15.01  23.29   19.34  
1 1 1 2   9   9  o 17 161.10  16.81  762.65    153.13   891.57   217.29   635.45    215.84   172.87  22.42  144.18  27.07  28.68   35.15  
1 1 1 2   9   10 o 19 263.63  27.79  2085.16   414.24   2281.54  586.07   1889.13   585.57   270.63  38.84  243.47  43.49  27.16   58.31  
1 1 1 2   9   11 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   9   12 o 19 310.69  33.08  2917.54   580.99   3178.50  821.90   2656.90   821.40   317.08  46.54  286.32  51.88  30.76   69.70  
1 1 1 2   9   13 o 15 175.92  18.33  907.92    182.38   992.50   258.49   824.08    257.35   182.30  25.39  165.07  28.17  17.23   37.92  
1 1 1 2   9   14 o 10 160.01  16.63  748.83    150.52   795.93   213.07   701.92    212.67   163.62  23.35  153.05  25.07  10.56   34.26  
1 1 1 2   9   15 o 18 244.42  25.64  1764.66   354.35   1995.05  501.36   1534.71   500.89   257.15  34.86  223.04  40.62  34.11   53.52  
1 1 1 2   9   16 o 15 138.96  21.12  573.66    163.19   0.00     0.00     573.66    163.19   ?       ?      138.96  21.12  0.00    21.12  
1 1 1 2   9   17 o 12 117.13  18.17  407.12    118.19   0.00     0.00     407.12    118.19   ?       ?      117.13  18.17  0.00    18.17  
1 1 1 2   9   18 o 11 184.42  28.87  1031.15   295.67   0.00     0.00     1031.15   295.67   ?       ?      184.42  28.87  0.00    28.87  
1 1 1 2   9   19 o 15 343.35  59.24  4028.41   1125.52  0.00     0.00     4028.41   1125.52  ?       ?      343.35  59.24  0.00    59.24  
1 1 1 2   9   20 o 19 185.22  29.62  1051.00   304.33   0.00     0.00     1051.00   304.33   ?       ?      185.22  29.62  0.00    29.62  
1 1 1 2   9   21 o 17 279.75  45.73  2521.03   709.12   0.00     0.00     2521.03   709.12   ?       ?      279.75  45.73  0.00    45.73  
1 1 1 2   9   22 o 14 73.67   17.44  164.61    72.63    159.83   109.05   168.43    97.37    73.77   23.14  74.78   21.52  -1.01   31.60  
1 1 1 2   9   23 o 16 203.62  22.17  1245.31   254.94   1252.29  361.31   1238.39   359.79   199.26  32.72  198.09  32.78  1.16    46.32  
1 1 1 2   9   24 o 6  213.39  23.58  1391.22   283.99   1362.27  399.40   1420.82   403.89   203.85  35.41  208.58  34.97  -4.73   49.77  
1 1 1 2   9   25 o 17 270.31  30.65  2348.23   467.16   2270.21  659.59   2426.76   661.75   247.84  48.10  258.56  46.28  -10.72  66.75  
1 1 1 2   9   26 o 13 74.40   23.45  172.25    111.90   172.25   111.90   0.00      0.00     74.40   23.45  ?       ?      0.00    23.45  
1 1 1 2   9   27 o 14 131.97  27.01  580.56    197.71   580.56   197.71   0.00      0.00     131.97  27.01  ?       ?      0.00    27.01  
1 1 1 2   9   28 o 15 94.15   24.59  298.32    134.31   298.32   134.31   0.00      0.00     94.15   24.59  ?       ?      0.00    24.59  
1 1 1 2   9   29 o 10 65.13   20.45  136.57    85.17    176.87   112.51   82.46     130.35   73.01   23.57  60.37   24.37  12.64   33.91  
1 1 1 2   9   30 o 13 71.80   21.00  173.54    92.05    146.02   121.85   210.12    140.47   67.26   24.43  77.22   26.38  -9.97   35.96  
1 1 1 2   9   31 o 10 180.39  23.92  1143.62   241.57   1090.81  342.16   1196.10   341.10   153.55  38.81  164.81  36.97  -11.27  53.59  
1 1 1 2   10  0  o 17 308.23  23.00  2794.29   404.11   2530.78  693.82   2929.58   497.13   284.47  43.90  313.91  27.88  -29.44  52.00  
1 1 1 2   10  1  o 5  411.27  34.07  5099.31   797.26   5336.71  1378.72  4980.04   977.20   400.18  62.02  400.74  43.16  -0.56   75.56  
1 1 1 2   10  2  o 1  210.22  21.74  1304.95   258.58   1334.59  366.17   1275.47   365.21   209.57  31.40  204.52  32.17  5.05    44.95  
1 1 1 2   10  3  o 10 264.39  27.67  2088.39   413.70   2288.62  585.41   1888.64   584.71   272.16  38.55  244.62  43.22  27.54   57.91  
1 1 1 2   10  4  o 8  121.03  18.45  435.58    124.13   0.00     0.00     435.58    124.13   ?       ?      121.03  18.45  0.00    18.45  
1 1 1 2   10  5  o 14 453.89  86.70  7814.10   2176.83  0.00     0.00     7814.10   2176.83  ?       ?      453.89  86.70  0.00    86.70  
1 1 1 2   10  6  o 6  200.96  30.75  1228.26   343.50   0.00     0.00     1228.26   343.50   ?       ?      200.96  30.75  0.00    30.75  
1 1 1 2   10  7  o 4  152.75  23.14  698.58    196.57   0.00     0.00     698.58    196.57   ?       ?      152.75  23.14  0.00    23.14  
1 1 1 2   10  8  o 18 36.51   10.83  38.93     24.32    0.00     0.00     38.93     24.32    ?       ?      36.51   10.83  0.00    10.83  
1 1 1 2   10  9  o 14 262.59  41.03  2143.51   598.34   0.00     0.00     2143.51   598.34   ?       ?      262.59  41.03  0.00    41.03  
1 1 1 2   10  10 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   10  11 o 8  334.34  53.52  3559.67   992.54   0.00     0.00     3559.67   992.54   ?       ?      334.34  53.52  0.00    53.52  
1 1 1 2   10  12 o 2  418.18  70.00  5817.42   1621.15  0.00     0.00     5817.42   1621.15  ?       ?      418.18  70.00  0.00    70.00  
1 1 1 2   10  13 o 19 193.52  29.26  1123.16   314.96   0.00     0.00     1123.16   314.96   ?       ?      193.52  29.26  0.00    29.26  
1 1 1 2   10  14 o 18 421.10  70.31  5883.70   1639.76  0.00     0.00     5883.70   1639.76  ?       ?      421.10  70.31  0.00    70.31  
1 1 1 2   10  15 o 6  271.08  42.01  2264.81   632.63   0.00     0.00     2264.81   632.63   ?       ?      271.08  42.01  0.00    42.01  
1 1 1 2   10  16 o 15 132.87  20.52  525.89    151.51   0.00     0.00     525.89    151.51   ?       ?      132.87  20.52  0.00    20.52  
1 1 1 2   10  17 o 6  326.84  54.32  3519.73   983.40   0.00     0.00     3519.73   983.40   ?       ?      326.84  54.32  0.00    54.32  
1 1 1 2   10  18 o 3  301.39  32.36  2771.78   551.14   2834.94  779.47   2708.63   779.38   295.26  47.60  287.55  48.97  7.72    68.29  
1 1 1 2   10  19 o 16 199.04  21.46  1176.16   241.34   1203.96  340.92   1148.23   341.69   198.01  31.01  192.90  31.98  5.11    44.54  
1 1 1 2   10  20 o 15 262.94  28.15  2082.92   418.31   2061.26  592.18   2104.49   590.97   254.58  41.98  257.65  41.35  -3.06   58.93  
1 1 1 2   10  21 o 6  380.84  42.56  4619.97   914.52   4617.89  1292.88  4622.04   1293.79  358.72  65.18  358.86  65.20  -0.14   92.20  
1 1 1 2   10  22 o 10 129.67  17.14  500.90    124.45   452.99   174.17   550.87    177.89   120.60  25.93  133.94  24.02  -13.34  35.34  
1 1 1 2   10  23 o 4  229.23  39.71  1765.08   503.59   1765.08  503.59   0.00      0.00     229.23  39.71  ?       ?      0.00    39.71  
1 1 1 2   10  24 o 3  149.10  26.81  707.56    221.07   707.56   221.07   0.00      0.00     149.10  26.81  ?       ?      0.00    26.81  
1 1 1 2   10  25 o 14 75.87   23.18  180.42    110.24   180.42   110.24   0.00      0.00     75.87   23.18  ?       ?      0.00    23.18  
1 1 1 2   10  26 o 13 95.92   24.68  303.15    136.70   303.15   136.70   0.00      0.00     95.92   24.68  ?       ?      0.00    24.68  
1 1 1 2   10  27 o 4  197.98  40.53  1540.12   445.17   1540.12  445.17   0.00      0.00     197.98  40.53  ?       ?      0.00    40.53  
1 1 1 2   10  28 o 3  117.49  18.79  439.43    122.45   336.25   164.67   567.07    183.15   97.07   28.01  128.73  25.68  -31.66  38.00  
1 1 1 2   10  29 o 3  119.65  19.89  467.77    131.80   464.03   181.96   471.90    191.17   112.37  28.24  112.32  29.33  0.05    40.72  
1 1 1 2   10  30 o 13 152.65  21.07  785.37    179.69   642.44   250.58   936.64    257.80   122.24  34.31  156.10  29.86  -33.85  45.48  
1 1 1 2   10  31 o 18 52.00   21.17  64.63     99.35    68.69    135.72   59.95     145.84   56.63   24.03  56.82   24.52  -0.20   34.33  
1 1 1 2   11  0  o 6  160.23  16.21  749.18    147.01   515.69   179.80   1220.05   255.34   130.95  24.83  203.75  22.19  -72.80  33.30  
1 1 1 2   11  1  o 6  126.45  16.75  470.30    118.62   426.27   135.05   618.95    248.12   119.58  20.40  142.36  31.22  -22.77  37.30  
1 1 1 2   11  2  o 6  582.99  59.33  10796.44  1958.15  9522.48  2765.37  12077.55  2773.13  507.55  98.46  589.96  84.27  -82.41  129.60 
1 1 1 2   11  3  o 16 307.22  28.23  2793.32   492.24   2287.34  686.14   3329.88   706.57   271.14  45.70  331.95  37.75  -60.80  59.28  
1 1 1 2   11  4  o 2  65.72   14.02  129.43    51.29    139.91   53.92    29.77     166.21   68.36   14.20  64.74   26.97  3.62    30.48  
1 1 1 2   11  5  o 6  187.20  16.88  1022.36   179.44   0.00     0.00     1022.36   179.44   ?       ?      187.20  16.88  0.00    16.88  
1 1 1 2   11  6  f 0  389.12  31.94  4501.67   707.23   4138.10  1220.83  4685.31   867.65   356.91  61.82  393.83  38.88  -36.92  73.03  
1 1 1 2   11  7  o 9  186.21  19.26  1016.08   202.97   1030.91  286.73   1001.18   287.35   185.61  27.76  182.71  28.31  2.89    39.65  
1 1 1 2   11  8  o 11 315.93  32.84  2977.52   586.89   2899.75  829.69   3055.40   830.28   304.94  49.06  313.88  47.57  -8.95   68.33  
1 1 1 2   11  9  o 19 314.96  32.63  2955.93   581.50   2790.72  822.14   3121.32   822.59   298.99  49.64  318.06  46.42  -19.08  67.96  
1 1 1 2   11  10 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   11  11 f 0  168.11  17.60  826.43    167.36   823.64   236.41   829.24    236.96   166.15  25.61  166.74  25.57  -0.58   36.19  
1 1 1 2   11  12 o 9  151.65  16.18  672.17    138.71   706.11   196.41   638.40    195.93   154.15  22.89  146.13  24.20  8.02    33.31  
1 1 1 2   11  13 o 10 130.87  14.38  500.49    106.29   484.12   148.65   517.62    152.04   127.41  21.06  131.91  20.76  -4.50   29.57  
1 1 1 2   11  14 o 3  70.81   12.17  148.69    47.68    146.72   62.86    151.36    73.19    69.81   16.02  70.86   17.97  -1.05   24.08  
1 1 1 2   11  15 o 7  270.11  28.23  2184.88   431.32   2136.55  609.64   2233.32   610.33   260.73  42.17  267.24  41.10  -6.50   58.88  
1 1 1 2   11  16 o 13 219.04  22.97  1426.39   284.58   1414.40  401.81   1438.46   403.10   213.98  33.83  215.92  33.61  -1.94   47.69  
1 1 1 2   11  17 o 2  315.69  33.88  3054.64   604.33   2987.49  853.02   3122.32   856.30   300.59  51.27  308.30  50.10  -7.71   71.69  
1 1 1 2   11  18 o 16 126.73  16.91  475.26    119.94   442.95   160.65   515.96    180.29   120.55  24.06  130.08  25.05  -9.53   34.73  
1 1 1 2   11  19 o 13 332.07  57.00  3736.17   1047.43  3736.17  1047.43  0.00      0.00     332.07  57.00  ?       ?      0.00    57.00  
1 1 1 2   11  20 o 3  169.60  28.26  884.06    265.50   884.06   265.50   0.00      0.00     169.60  28.26  ?       ?      0.00    28.26  
1 1 1 2   11  21 o 7  128.76  24.31  511.96    173.13   511.96   173.13   0.00      0.00     128.76  24.31  ?       ?      0.00    24.31  
1 1 1 2   11  22 o 13 63.33   22.23  109.57    100.00   109.57   100.00   0.00      0.00     63.33   22.23  ?       ?      0.00    22.23  
1 1 1 2   11  23 o 7  148.66  27.47  707.68    225.80   707.68   225.80   0.00      0.00     148.66  27.47  ?       ?      0.00    27.47  
1 1 1 2   11  24 o 3  179.37  32.51  1082.98   322.39   1082.98  322.39   0.00      0.00     179.37  32.51  ?       ?      0.00    32.51  
1 1 1 2   11  25 f 0  110.75  25.87  406.97    161.51   406.97   161.51   0.00      0.00     110.75  25.87  ?       ?      0.00    25.87  
1 1 1 2   11  26 o 4  143.31  19.23  644.96    154.23   638.27   215.39   652.00    220.95   135.97  28.51  137.07  28.99  -1.10   40.65  
1 1 1 2   11  27 o 13 164.38  20.98  871.03    193.50   817.53   268.57   928.78    279.01   148.52  32.41  159.56  31.58  -11.04  45.25  
1 1 1 2   11  28 o 8  222.29  28.86  1779.44   359.56   1649.10  503.95   1914.60   513.17   182.08  47.66  202.80  45.23  -20.73  65.71  
1 1 1 2   11  29 o 7  110.66  20.96  415.14    128.29   423.59   170.57   404.13    194.66   105.60  27.77  99.80   30.85  5.80    41.51  
1 1 1 2   11  30 o 18 83.41   29.74  288.95    179.61   0.00     0.00     288.95    179.61   ?       ?      83.41   29.74  0.00    29.74  
1 1 1 2   12  0  o 8  193.19  14.76  1082.04   162.49   1115.38  231.44   1049.64   228.19   195.19  20.98  189.21  21.38  5.98    29.96  
1 1 1 2   12  1  o 18 427.48  38.02  5435.79   923.41   5944.18  1592.07  5178.07   1133.56  432.82  66.17  412.55  48.81  20.28   82.23  
1 1 1 2   12  2  o 4  329.63  27.32  3187.12   512.24   3109.08  872.48   3228.18   632.79   318.06  49.38  329.88  33.90  -11.81  59.90  
1 1 1 2   12  3  f 0  485.30  42.78  7068.40   1179.65  7521.17  2038.53  6840.45   1446.43  479.21  76.69  471.11  54.49  8.10    94.07  
1 1 1 2   12  4  o 12 306.92  24.79  2756.93   433.14   2509.60  737.41   2887.20   535.19   285.90  46.53  312.72  30.19  -26.81  55.46  
1 1 1 2   12  5  o 19 51.90   13.56  80.48     40.85    82.77    59.08    78.38     56.55    53.95   17.05  52.58   16.69  1.37    23.85  
1 1 1 2   12  6  f 0  342.13  31.91  3465.60   619.48   2905.88  859.58   4070.44   893.55   305.93  50.72  366.58  43.30  -60.65  66.68  
1 1 1 2   12  7  o 17 344.22  37.42  3550.57   727.51   3665.91  1013.55  3427.99   1044.86  342.82  53.23  329.25  57.36  13.57   78.25  
1 1 1 2   12  8  o 5  216.65  24.94  1385.06   304.56   1447.47  402.63   1301.59   465.64   219.41  32.99  205.48  40.91  13.93   52.56  
1 1 1 2   12  9  o 14 337.23  53.25  3570.45   996.74   3570.45  996.74   0.00      0.00     337.23  53.25  ?       ?      0.00    53.25  
1 1 1 2   12  10 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   12  11 o 2  165.95  25.73  825.03    237.22   825.03   237.22   0.00      0.00     165.95  25.73  ?       ?      0.00    25.73  
1 1 1 2   12  12 o 19 275.58  43.49  2376.42   665.15   2376.42  665.15   0.00      0.00     275.58  43.49  ?       ?      0.00    43.49  
1 1 1 2   12  13 f 0  183.96  28.61  1026.08   292.29   1026.08  292.29   0.00      0.00     183.96  28.61  ?       ?      0.00    28.61  
1 1 1 2   12  14 o 7  205.36  32.23  1295.26   367.47   1295.26  367.47   0.00      0.00     205.36  32.23  ?       ?      0.00    32.23  
1 1 1 2   12  15 o 2  54.64   19.36  76.20     75.98    76.20    75.98    0.00      0.00     54.64   19.36  ?       ?      0.00    19.36  
1 1 1 2   12  16 o 8  138.85  23.53  582.18    180.84   582.18   180.84   0.00      0.00     138.85  23.53  ?       ?      0.00    23.53  
1 1 1 2   12  17 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   12  18 o 7  124.28  25.80  474.67    178.02   474.67   178.02   0.00      0.00     124.28  25.80  ?       ?      0.00    25.80  
1 1 1 2   12  19 o 15 226.19  37.28  1635.97   467.21   1635.97  467.21   0.00      0.00     226.19  37.28  ?       ?      0.00    37.28  
1 1 1 2   12  20 o 12 289.92  53.21  3038.14   852.94   3038.14  852.94   0.00      0.00     289.92  53.21  ?       ?      0.00    53.21  
1 1 1 2   12  21 o 5  218.71  24.10  1472.10   297.63   1328.95  414.75   1624.10   427.36   198.50  37.78  222.45  34.59  -23.94  51.22  
1 1 1 2   12  22 o 9  301.58  34.73  3023.63   590.35   2719.84  831.53   3332.38   838.28   256.84  57.80  294.93  51.38  -38.09  77.33  
1 1 1 2   12  23 o 17 58.60   20.10  98.29     81.52    59.05    98.45    183.85    145.38   54.35   21.43  77.73   26.83  -23.38  34.34  
1 1 1 2   12  24 o 7  105.11  18.72  345.80    108.82   299.44   140.60   415.07    171.86   94.91   25.33  110.94  27.20  -16.03  37.17  
1 1 1 2   12  25 o 10 87.00   19.46  243.15    94.76    206.39   123.75   295.26    147.35   78.92   24.64  92.86   26.40  -13.94  36.11  
1 1 1 2   12  26 o 17 101.47  19.31  331.75    108.35   265.82   142.86   421.05    166.26   87.29   26.33  109.67  26.67  -22.37  37.47  
1 1 1 2   12  27 o 16 121.41  19.99  481.89    134.50   420.51   182.64   554.61    198.81   106.04  29.12  122.84  28.71  -16.80  40.89  
1 1 1 2   12  28 o 10 87.69   22.37  269.54    112.94   251.66   149.31   293.46    172.65   81.80   27.20  86.55   29.25  -4.76   39.95  
1 1 1 2   12  29 o 9  78.77   29.16  250.62    174.93   0.00     0.00     250.62    174.93   ?       ?      78.77   29.16  0.00    29.16  
1 1 1 2   13  0  o 16 179.90  20.36  950.70    206.59   937.61   238.68   989.81    412.49   177.86  23.99  178.42  41.12  -0.56   47.60  
1 1 1 2   13  1  o 3  527.13  44.02  8432.24   1319.96  7889.84  2277.36  8706.63   1619.78  475.63  86.60  528.55  54.15  -52.92  102.13 
1 1 1 2   13  2  o 16 402.89  33.29  4824.82   762.98   4506.30  1306.18  4989.78   940.02   373.44  63.18  406.31  40.86  -32.87  75.24  
1 1 1 2   13  3  o 17 285.21  26.73  2398.84   432.55   2885.75  722.38   2126.68   540.06   307.49  42.02  265.34  36.41  42.14   55.60  
1 1 1 2   13  4  o 13 240.51  25.12  1706.41   341.74   1792.22  483.05   1620.44   483.52   243.38  35.63  230.45  37.86  12.93   51.99  
1 1 1 2   13  5  o 9  406.57  43.62  5051.24   1002.10  5287.56  1417.00  4814.80   1417.36  403.39  63.27  381.93  67.09  21.46   92.22  
1 1 1 2   13  6  o 18 390.75  41.92  4660.51   925.58   4936.16  1309.06  4384.93   1308.88  390.54  60.33  364.55  64.92  25.99   88.63  
1 1 1 2   13  7  o 10 292.85  27.18  2540.50   451.73   2771.23  762.16   2415.56   560.87   297.90  46.05  282.51  35.35  15.39   58.06  
1 1 1 2   13  8  o 15 248.52  21.46  1813.96   303.20   1713.98  498.42   1872.69   382.01   235.91  38.10  250.93  26.94  -15.02  46.66  
1 1 1 2   13  9  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   13  10 o 14 329.24  34.83  3297.34   648.38   3145.66  916.51   3449.31   917.38   310.36  53.36  327.29  50.44  -16.93  73.43  
1 1 1 2   13  11 o 7  343.36  36.84  3618.16   714.81   3602.07  1010.45  3634.29   1011.33  330.05  55.28  331.74  55.03  -1.69   78.00  
1 1 1 2   13  12 o 3  284.16  30.37  2437.50   487.76   2553.38  689.29   2321.28   690.30   283.88  43.70  268.87  46.40  15.01   63.74  
1 1 1 2   13  13 f 0  324.81  34.73  3220.54   637.64   3198.96  901.25   3242.16   902.26   312.81  52.01  315.21  51.65  -2.40   73.30  
1 1 1 2   13  14 o 13 438.44  48.82  6150.06   1207.85  5939.00  1707.82  6361.29   1708.51  402.74  76.67  420.88  73.38  -18.14  106.12 
1 1 1 2   13  15 o 3  191.65  21.39  1089.08   231.28   1217.86  326.17   958.86    328.00   200.19  29.24  175.61  33.76  24.58   44.67  
1 1 1 2   13  16 o 8  215.68  23.49  1388.32   286.14   1376.45  405.31   1400.10   404.02   210.16  34.81  212.21  34.34  -2.05   48.90  
1 1 1 2   13  17 o 10 161.09  19.21  772.52    174.13   697.41   242.00   853.16    250.74   149.57  29.23  166.65  27.14  -17.07  39.89  
1 1 1 2   13  18 o 11 92.78   19.55  263.61    100.84   335.04   136.02   176.44    150.26   103.87  23.38  78.91   27.28  24.96   35.92  
1 1 1 2   13  19 o 10 383.02  47.47  5173.59   1021.42  5121.60  1443.72  5225.69   1445.29  333.81  76.92  338.87  76.16  -5.06   108.24 
1 1 1 2   13  20 o 15 292.14  33.77  2790.13   555.97   2743.38  784.73   2837.24   787.80   267.75  52.93  273.52  52.07  -5.77   74.25  
1 1 1 2   13  21 o 10 269.11  31.08  2366.75   471.27   2270.43  663.00   2465.12   669.99   242.90  49.23  255.83  47.36  -12.93  68.32  
1 1 1 2   13  22 o 14 113.75  18.08  399.09    114.10   348.34   148.06   473.31    179.06   103.09  25.23  119.73  26.73  -16.64  36.75  
1 1 1 2   13  23 o 4  93.43   19.28  276.97    99.95    257.35   125.77   310.60    164.69   88.20   24.14  95.29   28.15  -7.09   37.09  
1 1 1 2   13  24 o 16 98.25   19.67  309.82    107.07   302.53   133.72   322.83    178.74   94.66   24.44  95.35   29.58  -0.69   38.37  
1 1 1 2   13  25 o 10 157.77  21.23  808.57    187.38   789.25   251.15   832.84    281.42   146.97  30.76  147.50  33.94  -0.53   45.80  
1 1 1 2   13  26 o 14 119.42  19.63  465.81    129.93   456.57   171.86   478.12    198.50   112.30  26.99  111.91  30.20  0.40    40.51  
1 1 1 2   13  27 o 14 91.12   21.34  286.93    109.63   290.61   140.68   281.23    174.95   88.20   26.01  84.49   29.42  3.70    39.27  
1 1 1 2   13  28 o 15 84.27   22.38  256.66    110.06   316.08   141.98   167.19    174.23   90.47   25.98  69.19   28.09  21.29   38.26  
1 1 1 2   14  0  o 7  163.46  25.01  798.32    227.24   669.15   574.44   822.29    247.42   151.95  53.28  165.44  26.98  -13.49  59.72  
1 1 1 2   14  1  o 6  428.36  34.66  5499.52   845.07   4986.53  1434.12  5772.38   1045.94  386.67  67.04  434.42  42.48  -47.75  79.36  
1 1 1 2   14  2  o 7  157.95  16.43  730.01    146.77   505.65   212.21   935.71    203.20   128.45  29.41  178.26  20.21  -49.81  35.69  
1 1 1 2   14  3  o 2  374.70  30.87  4186.37   658.11   3838.53  1103.30  4378.49   819.95   343.25  58.06  379.61  38.14  -36.36  69.47  
1 1 1 2   14  4  o 4  333.02  26.35  3279.97   499.73   2858.77  816.09   3532.66   632.10   300.19  49.05  343.13  32.48  -42.94  58.83  
1 1 1 2   14  5  o 5  387.89  42.22  4640.59   925.00   4892.47  1307.94  4388.56   1308.35  384.59  61.30  360.50  65.64  24.09   89.81  
1 1 1 2   14  6  o 2  199.58  18.33  1166.93   207.66   1041.34  312.55   1266.19   277.86   185.12  30.47  206.57  23.87  -21.45  38.71  
1 1 1 2   14  7  o 13 314.49  33.52  2988.65   595.90   3092.22  842.02   2884.74   843.44   311.82  48.62  299.67  50.84  12.15   70.35  
1 1 1 2   14  8  o 4  107.54  22.35  350.33    133.45   350.33   133.45   0.00      0.00     107.54  22.35  ?       ?      0.00    22.35  
1 1 1 2   14  9  o 14 120.22  21.93  435.03    145.77   0.00     0.00     435.03    145.77   ?       ?      120.22  21.93  0.00    21.93  
1 1 1 2   14  10 o 19 177.02  19.63  923.74    196.11   959.11   293.02   895.04    263.94   177.56  29.80  172.05  27.66  5.51    40.66  
1 1 1 2   14  11 o 15 350.44  38.16  3769.91   755.33   4024.03  1068.33  3515.93   1068.06  350.83  54.84  324.05  59.61  26.78   81.00  
1 1 1 2   14  12 o 17 168.87  19.28  841.92    183.57   818.12   258.12   866.27    261.13   163.85  28.47  168.89  27.91  -5.04   39.87  
1 1 1 2   14  13 o 1  295.19  31.66  2646.54   528.21   2686.59  746.94   2606.47   747.07   288.70  46.66  283.71  47.55  4.99    66.62  
1 1 1 2   14  14 o 13 119.30  15.81  421.14    105.60   415.75   144.98   427.23    154.11   116.88  22.42  118.24  23.53  -1.35   32.51  
1 1 1 2   14  15 o 1  303.60  32.84  2864.20   563.26   2687.87  793.67   3043.14   799.50   279.63  51.33  301.01  47.87  -21.38  70.19  
1 1 1 2   14  16 o 15 117.23  16.94  411.37    110.69   354.83   152.27   474.73    161.20   106.43  25.30  124.02  23.50  -17.59  34.53  
1 1 1 2   14  17 o 6  255.81  28.16  2040.40   406.64   1946.75  574.05   2134.71   576.11   237.40  43.73  250.92  41.44  -13.52  60.25  
1 1 1 2   14  18 o 2  204.30  22.65  1277.95   261.16   1134.64  363.97   1430.03   374.94   184.26  35.70  210.05  32.11  -25.79  48.02  
1 1 1 2   14  19 o 17 48.06   19.37  35.91     82.21    12.84    102.98   76.44     136.50   49.38   20.94  62.96   25.10  -13.58  32.69  
1 1 1 2   14  20 o 19 247.35  28.87  1992.06   402.20   1955.15  565.41   2029.86   572.25   227.36  44.91  232.25  44.54  -4.88   63.25  
1 1 1 2   14  21 o 15 110.41  19.31  381.96    117.96   433.20   157.28   316.07    178.34   115.04  24.56  96.33   29.49  18.71   38.38  
1 1 1 2   14  22 o 17 163.70  20.84  848.81    191.42   841.46   262.45   857.16    279.81   155.16  30.55  154.78  32.53  0.38    44.63  
1 1 1 2   14  23 o 9  53.85   21.10  66.82     94.95    -14.70   121.31   195.77    152.56   48.84   21.68  77.25   27.43  -28.41  34.96  
1 1 1 2   14  24 o 6  160.82  21.17  843.69    190.74   741.74   255.77   971.46    286.31   139.68  32.51  161.17  32.07  -21.49  45.67  
1 1 1 2   14  25 o 2  97.40   20.91  319.35    113.42   301.26   139.15   355.17    195.80   91.37   25.54  94.81   31.13  -3.45   40.27  
1 1 1 2   14  26 o 19 65.47   22.13  147.01    98.79    168.77   116.33   90.72     187.10   69.21   24.00  64.00   27.70  5.20    36.65  
1 1 1 2   14  27 o 13 54.00   21.64  78.68     101.99   116.20   119.61   -21.25    195.21   60.55   23.70  55.72   25.79  4.84    35.03  
1 1 1 2   15  0  o 1  102.99  14.58  312.48    83.79    329.41   110.98   290.05    127.77   104.93  19.13  97.77   23.13  7.16    30.01  
1 1 1 2   15  1  o 16 311.82  33.53  2920.56   590.75   3173.72  834.25   2665.94   836.64   318.77  47.00  288.93  52.37  29.84   70.37  
1 1 1 2   15  2  f 0  301.67  48.21  2860.53   806.76   0.00     0.00     2860.53   806.76   ?       ?      301.67  48.21  0.00    48.21  
1 1 1 2   15  3  o 1  350.19  57.30  3967.45   1112.18  0.00     0.00     3967.45   1112.18  ?       ?      350.19  57.30  0.00    57.30  
1 1 1 2   15  4  o 4  480.27  89.31  8500.34   2371.68  0.00     0.00     8500.34   2371.68  ?       ?      480.27  89.31  0.00    89.31  
1 1 1 2   15  5  o 19 154.92  27.09  725.63    232.15   0.00     0.00     725.63    232.15   ?       ?      154.92  27.09  0.00    27.09  
1 1 1 2   15  6  o 19 102.09  25.21  318.01    146.85   0.00     0.00     318.01    146.85   ?       ?      102.09  25.21  0.00    25.21  
1 1 1 2   15  7  o 16 183.22  30.21  1021.15   306.72   0.00     0.00     1021.15   306.72   ?       ?      183.22  30.21  0.00    30.21  
1 1 1 2   15  8  x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   15  9  o 2  194.93  20.58  1123.58   226.83   1236.48  338.69   1031.76   305.45   201.41  30.22  183.74  29.99  17.67   42.58  
1 1 1 2   15  10 o 14 64.56   22.03  113.84    97.93    107.17   99.26    357.58    600.19   63.55   22.16  129.11  52.23  -65.56  56.74  
1 1 1 2   15  11 o 18 235.78  23.18  1660.25   309.73   1750.39  480.57   1596.19   405.09   235.64  36.72  227.30  31.92  8.35    48.66  
1 1 1 2   15  12 o 7  152.76  18.05  693.34    155.23   793.51   215.76   585.85    223.50   161.63  23.98  136.63  29.37  25.00   37.92  
1 1 1 2   15  13 o 8  225.07  24.36  1535.67   309.70   1522.18  435.45   1549.48   440.55   217.51  36.14  219.43  36.24  -1.92   51.18  
1 1 1 2   15  14 o 10 189.26  21.22  1080.58   226.57   1190.97  317.79   966.46    323.11   194.77  29.33  172.73  33.80  22.04   44.75  
1 1 1 2   15  15 o 4  152.86  18.75  703.01    161.12   727.31   222.30   676.12    233.87   152.30  26.38  145.50  29.02  6.80    39.22  
1 1 1 2   15  16 o 9  141.99  17.98  607.73    143.30   540.42   196.52   684.14    209.40   129.98  27.21  147.42  25.68  -17.43  37.41  
1 1 1 2   15  17 o 19 137.74  17.68  574.15    136.57   519.33   189.11   633.91    197.44   126.90  26.80  141.34  25.26  -14.44  36.83  
1 1 1 2   15  18 o 18 61.57   19.86  113.66    79.90    152.77   103.55   56.12     125.59   70.51   22.60  58.46   23.80  12.05   32.82  
1 1 1 2   15  19 o 4  190.66  22.69  1147.65   243.47   1154.65  338.49   1140.15   350.46   182.04  33.63  179.26  35.31  2.78    48.76  
1 1 1 2   15  20 o 4  76.09   20.66  186.53    92.56    242.70   117.10   93.01     151.09   85.90   23.20  65.26   26.28  20.63   35.06  
1 1 1 2   15  21 o 1  97.67   19.90  306.76    107.76   306.34   141.01   307.34    167.08   94.85   25.39  93.64   28.52  1.20    38.19  
1 1 1 2   15  22 o 4  90.42   21.51  271.53    110.02   241.47   139.41   321.16    179.13   83.47   26.16  93.89   29.68  -10.42  39.57  
1 1 1 2   15  23 o 8  54.53   21.16  75.99     94.72    83.49    118.45   62.68     157.75   58.46   23.36  60.75   25.84  -2.29   34.84  
1 1 1 2   15  24 o 7  46.30   20.22  8.65      101.58   4.56     125.35   16.48     173.34   49.98   22.12  57.59   25.72  -7.61   33.92  
1 1 1 2   15  25 o 19 62.50   22.73  130.55    105.49   128.03   127.29   136.09    188.52   63.16   24.52  67.48   28.46  -4.32   37.57  
1 1 1 2   16  0  o 5  239.24  31.85  1756.80   426.54   1877.90  521.37   1511.67   741.77   244.03  38.49  206.83  59.37  37.20   70.75  
1 1 1 2   16  1  o 4  266.54  31.21  2169.41   468.55   2032.73  578.68   2429.58   798.39   252.42  41.37  267.81  53.80  -15.39  67.87  
1 1 1 2   16  2  o 11 63.48   19.72  117.76    79.40    121.29   80.21    -55.78    562.35   64.29   19.79  105.50  46.76  -41.21  50.78  
1 1 1 2   16  3  o 11 107.44  14.43  340.89    86.75    384.75   117.35   288.03    128.81   113.30  18.69  96.86   23.42  16.44   29.97  
1 1 1 2   16  4  o 7  287.79  26.27  2486.88   429.16   2382.89  685.79   2553.81   550.21   270.19  45.85  287.54  33.99  -17.35  57.08  
1 1 1 2   16  5  o 7  194.04  21.15  1120.79   231.77   1168.82  325.30   1071.27   330.29   194.84  30.05  185.47  32.19  9.36    44.03  
1 1 1 2   16  6  f 0  135.65  15.72  542.92    120.13   467.49   166.51   624.82    173.50   123.44  24.36  144.04  21.65  -20.60  32.59  
1 1 1 2   16  7  o 7  242.11  39.68  1887.02   532.36   1887.02  532.36   0.00      0.00     242.11  39.68  ?       ?      0.00    39.68  
1 1 1 2   16  8  f 0  124.61  22.85  474.85    157.46   0.00     0.00     474.85    157.46   ?       ?      124.61  22.85  0.00    22.85  
1 1 1 2   16  9  o 18 225.67  24.84  1544.93   316.52   1658.34  445.36   1429.19   449.92   228.13  35.13  209.21  38.89  18.92   52.41  
1 1 1 2   16  10 o 15 64.93   22.43  116.08    101.61   0.00     0.00     116.08    101.61   ?       ?      64.93   22.43  0.00    22.43  
1 1 1 2   16  11 o 12 196.19  32.99  1232.46   358.39   0.00     0.00     1232.46   358.39   ?       ?      196.19  32.99  0.00    32.99  
1 1 1 2   16  12 o 19 159.82  27.78  804.39    245.64   0.00     0.00     804.39    245.64   ?       ?      159.82  27.78  0.00    27.78  
1 1 1 2   16  13 o 5  132.76  25.06  553.74    184.01   0.00     0.00     553.74    184.01   ?       ?      132.76  25.06  0.00    25.06  
1 1 1 2   16  14 f 0  202.52  37.08  1392.60   415.17   0.00     0.00     1392.60   415.17   ?       ?      202.52  37.08  0.00    37.08  
1 1 1 2   16  15 o 13 180.74  33.59  1100.24   335.71   0.00     0.00     1100.24   335.71   ?       ?      180.74  33.59  0.00    33.59  
1 1 1 2   16  16 o 1  92.46   27.33  280.96    155.15   0.00     0.00     280.96    155.15   ?       ?      92.46   27.33  0.00    27.33  
1 1 1 2   16  17 o 11 87.70   27.38  254.17    152.89   0.00     0.00     254.17    152.89   ?       ?      87.70   27.38  0.00    27.38  
1 1 1 2   16  18 o 16 64.43   24.88  104.88    130.52   0.00     0.00     104.88    130.52   ?       ?      64.43   24.88  0.00    24.88  
1 1 1 2   16  19 o 11 81.54   27.31  222.19    150.44   0.00     0.00     222.19    150.44   ?       ?      81.54   27.31  0.00    27.31  
1 1 1 2   16  20 o 8  70.32   27.37  140.66    158.83   0.00     0.00     140.66    158.83   ?       ?      70.32   27.37  0.00    27.37  
1 1 1 2   16  21 o 1  66.03   27.18  104.02    166.08   0.00     0.00     104.02    166.08   ?       ?      66.03   27.18  0.00    27.18  
1 1 1 2   16  22 o 16 125.31  33.65  641.43    247.11   0.00     0.00     641.43    247.11   ?       ?      125.31  33.65  0.00    33.65  
1 1 1 2   16  23 o 7  60.40   26.59  53.60     178.76   0.00     0.00     53.60     178.76   ?       ?      60.40   26.59  0.00    26.59  
1 1 1 2   16  24 o 3  79.32   30.26  258.01    191.44   0.00     0.00     258.01    191.44   ?       ?      79.32   30.26  0.00    30.26  
1 1 1 2   17  0  o 9  106.36  14.41  335.35    85.72    325.81   114.19   347.68    129.76   103.42  19.96  106.39  21.97  -2.96   29.68  
1 1 1 2   17  1  o 18 178.45  18.36  945.71    185.39   899.42   268.31   987.99    256.46   170.12  28.48  179.73  25.58  -9.61   38.28  
1 1 1 2   17  2  o 12 195.48  20.31  1141.31   224.61   1207.47  333.40   1086.32   303.93   196.57  30.54  186.86  29.30  9.71    42.32  
1 1 1 2   17  3  o 16 161.17  17.47  771.07    159.05   778.86   227.33   763.60    222.61   159.04  25.78  157.57  25.48  1.48    36.25  
1 1 1 2   17  4  o 11 287.64  40.58  2710.55   651.52   3027.00  834.72   2217.21   1042.23  293.98  51.33  228.34  71.52  65.64   88.03  
1 1 1 2   17  5  o 12 292.94  44.39  2888.25   723.19   3388.76  929.01   2118.44   1152.13  306.56  54.80  215.94  75.48  90.62   93.27  
1 1 1 2   17  6  o 11 89.69   18.71  246.02    93.23    253.54   94.06    -170.64   700.03   91.11   18.61  107.71  49.49  -16.60  52.88  
1 1 1 2   17  7  x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   17  8  o 7  143.30  24.33  636.83    192.96   636.83   192.96   0.00      0.00     143.30  24.33  ?       ?      0.00    24.33  
1 1 1 2   17  9  o 10 109.79  20.52  371.14    124.55   371.14   124.55   0.00      0.00     109.79  20.52  ?       ?      0.00    20.52  
1 1 1 2   17  10 f 0  289.85  43.45  2944.50   700.79   3256.73  899.87   2463.31   1117.14  288.16  56.42  217.86  74.41  70.30   93.38  
1 1 1 2   17  11 o 15 110.83  20.38  380.39    124.87   391.84   127.07   57.74     674.37   112.51  20.43  108.69  49.42  3.82    53.48  
1 1 1 2   17  12 o 10 154.63  17.25  721.47    150.53   685.69   211.81   757.99    213.98   146.29  26.18  154.68  24.95  -8.39   36.17  
1 1 1 2   17  13 o 2  100.43  15.37  305.77    85.82    339.20   113.04   260.29    131.86   104.31  19.60  89.67   24.79  14.64   31.60  
1 1 1 2   17  14 o 7  71.40   20.17  160.75    86.30    166.37   104.73   148.87    152.29   72.77   22.65  73.05   27.18  -0.27   35.38  
1 1 1 2   17  15 o 12 99.62   18.85  311.24    103.84   321.92   128.44   291.09    176.44   99.57   22.94  92.81   29.48  6.76    37.35  
1 1 1 2   17  16 o 10 96.16   19.04  292.66    101.38   327.92   130.35   238.67    161.27   99.96   23.17  84.70   28.27  15.26   36.55  
1 1 1 2   17  17 o 15 65.55   20.69  135.95    87.07    122.84   105.84   163.39    153.16   64.23   22.84  73.47   27.27  -9.24   35.57  
1 1 1 2   17  18 o 15 58.23   20.32  101.18    83.51    99.42    102.53   104.66    143.91   59.75   22.29  64.77   25.79  -5.03   34.09  
1 1 1 2   17  19 f 0  99.67   19.36  322.84    106.77   342.81   139.72   294.82    165.54   99.43   24.61  89.98   28.55  9.45    37.69  
1 1 1 2   17  20 o 13 77.87   21.03  205.90    96.17    146.10   119.39   316.43    162.31   66.96   24.20  91.89   28.13  -24.93  37.11  
1 1 1 2   17  21 f 0  56.68   21.16  96.16     92.48    106.36   109.30   70.47     173.51   59.65   22.84  61.64   26.68  -1.99   35.12  
1 1 1 2   17  22 o 5  62.79   21.97  133.03    97.62    98.85    116.52   213.50    178.80   58.66   23.26  75.17   29.10  -16.51  37.25  
1 1 1 2   18  0  o 13 121.30  55.80  3.65      893.47   3.65     893.47   0.00      0.00     121.30  55.80  ?       ?      0.00    55.80  
1 1 1 2   18  1  o 2  47.38   16.11  61.66     52.37    68.70    62.87    45.71     94.63    50.60   17.64  52.28   20.88  -1.68   27.33  
1 1 1 2   18  2  o 9  132.79  15.50  525.19    115.94   509.26   160.01   542.80    168.22   128.24  22.56  132.32  22.98  -4.08   32.20  
1 1 1 2   18  3  o 6  108.15  14.71  349.28    88.94    347.87   116.86   351.21    137.10   106.34  19.87  105.76  23.22  0.58    30.56  
1 1 1 2   18  4  o 9  158.78  17.74  757.00    158.92   810.47   225.27   704.01    224.23   160.97  25.20  148.80  27.25  12.16   37.12  
1 1 1 2   18  5  f 0  77.36   15.27  182.11    65.43    183.04   81.00    180.36    110.99   76.88   18.56  76.41   23.24  0.46    29.74  
1 1 1 2   18  6  o 8  257.50  48.55  2465.44   691.33   2465.44  691.33   0.00      0.00     257.50  48.55  ?       ?      0.00    48.55  
1 1 1 2   18  7  o 1  70.29   23.04  148.22    107.24   0.00     0.00     148.22    107.24   ?       ?      70.29   23.04  0.00    23.04  
1 1 1 2   18  8  o 5  202.07  21.82  1257.63   249.06   1291.21  361.99   1227.45   343.22   196.52  33.27  192.34  32.22  4.17    46.32  
1 1 1 2   18  9  o 5  210.26  22.72  1373.53   269.83   1422.17  392.64   1330.00   371.45   204.36  34.71  198.25  33.85  6.10    48.48  
1 1 1 2   18  10 o 7  119.81  15.26  432.51    102.56   414.35   136.03   456.43    156.10   114.71  21.45  119.51  23.59  -4.80   31.88  
1 1 1 2   18  11 o 19 154.20  17.50  724.11    152.21   696.93   211.62   753.24    219.07   146.35  26.15  152.38  25.97  -6.03   36.86  
1 1 1 2   18  12 o 12 143.47  17.34  629.46    139.92   677.27   192.41   575.82    203.82   145.12  23.93  131.08  27.94  14.04   36.79  
1 1 1 2   18  13 o 8  128.56  24.59  541.42    174.84   545.23   178.09   439.90    919.84   128.77  24.99  116.18  54.51  12.59   59.97  
1 1 1 2   18  14 o 19 66.34   23.93  129.38    116.63   129.38   116.63   0.00      0.00     66.34   23.93  ?       ?      0.00    23.93  
1 1 1 2   18  15 o 10 52.42   21.26  50.84     99.70    53.58    100.27   -187.99   936.97   52.89   21.37  97.75   48.04  -44.86  52.58  
1 1 1 2   18  16 o 3  135.32  27.51  640.45    206.43   640.45   206.43   0.00      0.00     135.32  27.51  ?       ?      0.00    27.51  
1 1 1 2   18  17 o 17 56.40   22.07  80.37     103.71   72.06    104.34   762.13    944.79   55.30   21.98  106.68  51.47  -51.39  55.97  
1 1 1 2   18  18 o 13 103.49  24.26  376.77    141.63   375.98   143.14   413.54    978.50   103.16  24.53  95.93   47.51  7.24    53.47  
1 1 1 2   18  19 o 10 52.13   21.49  55.08     104.01   55.08    104.01   0.00      0.00     52.13   21.49  ?       ?      0.00    21.49  
1 1 1 2   19  0  f 0  138.31  25.58  609.77    195.61   904.67   1151.94  601.01    198.49   145.91  65.64  136.97  26.20  8.94    70.67  
1 1 1 2   19  1  o 14 106.06  24.75  360.89    147.93   0.00     0.00     360.89    147.93   ?       ?      106.06  24.75  0.00    24.75  
1 1 1 2   19  2  o 13 162.64  18.27  801.60    167.65   832.93   237.11   770.28    237.08   161.40  26.51  154.34  27.78  7.06    38.40  
1 1 1 2   19  3  f 0  296.18  30.22  2851.23   506.62   2847.80  795.36   2853.56   657.19   265.09  54.10  282.28  41.82  -17.19  68.38  
1 1 1 2   19  4  o 8  67.27   16.13  139.80    61.49    105.73   74.63    211.81    108.49   59.59   19.20  81.65   22.45  -22.07  29.54  
1 1 1 2   19  5  o 4  123.11  14.88  455.02    103.03   386.70   136.28   546.16    157.40   110.46  22.26  132.17  21.48  -21.71  30.94  
1 1 1 2   19  6  x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   19  7  o 14 150.91  17.25  692.67    146.75   676.80   202.92   710.08    212.47   144.69  25.35  147.88  25.98  -3.19   36.30  
1 1 1 2   19  8  o 11 148.00  16.99  667.08    141.73   624.35   193.50   716.54    208.17   138.55  25.26  148.60  25.31  -10.05  35.76  
1 1 1 2   19  9  o 1  77.43   16.36  186.54    70.45    200.78   86.84    159.13    120.49   79.51   19.24  71.82   24.44  7.69    31.10  
1 1 1 2   19  10 o 11 44.36   16.76  45.97     58.41    74.31    70.76    -14.66    103.50   52.13   18.66  45.72   20.17  6.42    27.48  
1 1 1 2   19  11 o 6  77.15   16.55  186.81    71.10    182.82   86.69    195.01    124.26   75.35   19.79  77.19   24.76  -1.84   31.70  
1 1 1 2   19  12 o 16 158.85  18.94  792.51    169.29   779.49   230.19   807.84    249.85   150.69  27.63  151.48  29.79  -0.79   40.63  
1 1 1 2   19  13 o 7  113.68  19.90  416.46    125.13   434.74   157.39   385.04    206.30   112.84  24.96  101.35  31.83  11.49   40.45  
1 1 1 2   19  14 o 9  59.05   21.45  102.77    93.89    174.86   111.80   -69.80    172.98   72.33   23.51  52.86   24.40  19.47   33.89  
1 1 1 2   19  15 o 17 136.42  20.96  612.68    158.89   597.73   203.76   635.89    253.81   128.02  28.46  125.60  34.26  2.42    44.54  
1 1 1 2   20  1  o 1  144.22  26.16  678.57    208.61   0.00     0.00     678.57    208.61   ?       ?      144.22  26.16  0.00    26.16  
1 1 1 2   20  2  o 6  154.34  29.17  799.46    249.00   0.00     0.00     799.46    249.00   ?       ?      154.34  29.17  0.00    29.17  
1 1 1 2   20  3  o 2  123.48  25.32  500.58    173.48   0.00     0.00     500.58    173.48   ?       ?      123.48  25.32  0.00    25.32  
1 1 1 2   20  4  o 12 94.59   23.91  294.05    129.85   0.00     0.00     294.05    129.85   ?       ?      94.59   23.91  0.00    23.91  
1 1 1 2   20  5  x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 2   20  6  o 9  161.14  31.33  908.50    279.41   0.00     0.00     908.50    279.41   ?       ?      161.14  31.33  0.00    31.33  
1 1 1 2   20  7  f 0  149.28  28.29  761.70    233.55   0.00     0.00     761.70    233.55   ?       ?      149.28  28.29  0.00    28.29  
1 1 1 2   20  8  o 8  107.10  14.93  351.11    89.28    332.92   114.25   379.64    143.06   101.71  20.28  106.70  23.95  -4.99   31.38  
1 1 1 2   20  9  o 18 170.25  20.26  920.94    194.16   953.20   269.50   886.12    279.95   164.92  29.55  156.12  32.30  8.80    43.78  
1 1 1 3   -19 0  o 16 157.61  19.17  762.79    169.86   770.78   174.02   601.71    781.37   158.22  19.58  126.37  55.60  31.85   58.95  
1 1 1 3   -19 1  o 13 64.48   17.97  129.15    68.97    129.73   69.23    50.25     802.90   64.62   18.00  109.33  51.18  -44.71  54.25  
1 1 1 3   -19 2  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   -19 3  o 7  116.72  53.45  294.20    807.01   0.00     0.00     294.20    807.01   ?       ?      116.72  53.45  0.00    53.45  
1 1 1 3   -19 4  o 4  234.41  79.71  3638.56   1281.94  0.00     0.00     3638.56   1281.94  ?       ?      234.41  79.71  0.00    79.71  
1 1 1 3   -19 5  o 11 164.35  64.01  1462.45   869.26   0.00     0.00     1462.45   869.26   ?       ?      164.35  64.01  0.00    64.01  
1 1 1 3   -18 0  o 11 127.35  36.58  558.14    281.50   492.23   309.98   868.25    672.39   119.54  39.17  146.70  56.52  -27.16  68.77  
1 1 1 3   -18 1  x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   -18 2  x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   -18 3  o 5  106.92  36.17  374.48    263.90   473.36   288.54   -131.41   652.62   117.88  37.72  101.75  47.12  16.12   60.36  
1 1 1 3   -18 4  o 9  232.48  36.50  1815.34   471.09   1839.74  571.49   1763.60   832.13   225.03  45.80  196.12  64.17  28.91   78.84  
1 1 1 3   -18 5  o 18 189.08  34.53  1193.13   360.95   1136.70  414.70   1369.46   733.09   179.21  41.18  176.27  60.27  2.93    72.99  
1 1 1 3   -18 6  o 5  128.08  53.67  528.97    663.87   0.00     0.00     528.97    663.87   ?       ?      128.08  53.67  0.00    53.67  
1 1 1 3   -18 7  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   -18 8  o 11 199.89  67.20  2005.92   911.03   0.00     0.00     2005.92   911.03   ?       ?      199.89  67.20  0.00    67.20  
1 1 1 3   -18 9  o 7  188.72  37.81  1238.19   395.30   1238.19  395.30   0.00      0.00     188.72  37.81  ?       ?      0.00    37.81  
1 1 1 3   -17 0  o 7  81.99   32.67  136.82    231.13   136.82   231.13   0.00      0.00     81.99   32.67  ?       ?      0.00    32.67  
1 1 1 3   -17 1  x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   -17 2  o 4  205.06  32.76  1346.21   372.68   1394.53  451.64   1243.10   659.74   203.85  40.02  179.16  57.01  24.68   69.65  
1 1 1 3   -17 3  o 15 266.61  34.53  2286.44   516.11   2103.21  662.46   2569.42   823.27   242.82  49.21  260.91  56.60  -18.09  75.00  
1 1 1 3   -17 4  o 14 162.51  32.34  853.24    291.08   879.62   334.94   771.85    588.36   162.60  36.75  146.65  53.62  15.95   65.01  
1 1 1 3   -17 5  o 8  198.97  39.91  1334.78   440.00   1334.78  440.00   0.00      0.00     198.97  39.91  ?       ?      0.00    39.91  
1 1 1 3   -17 6  o 15 102.89  33.38  335.10    225.36   300.93   248.08   496.46    539.09   99.73   35.01  127.34  50.17  -27.61  61.18  
1 1 1 3   -17 7  o 18 166.62  30.33  887.84    279.44   950.90   313.01   640.27    620.15   170.99  33.08  137.75  53.94  33.25   63.28  
1 1 1 3   -17 8  o 2  148.29  29.22  703.39    239.93   691.67   261.24   766.54    606.43   145.58  32.12  144.84  54.17  0.74    62.98  
1 1 1 3   -17 9  o 19 159.67  29.39  815.58    259.49   801.57   285.77   881.44    619.55   156.34  32.88  151.63  55.09  4.71    64.16  
1 1 1 3   -17 10 o 15 212.85  61.70  1924.95   797.59   0.00     0.00     1924.95   797.59   ?       ?      212.85  61.70  0.00    61.70  
1 1 1 3   -17 11 o 9  127.29  52.09  519.69    604.94   0.00     0.00     519.69    604.94   ?       ?      127.29  52.09  0.00    52.09  
1 1 1 3   -17 12 o 16 78.70   28.29  176.28    162.85   173.54   169.37   209.69    592.32   78.86   28.78  110.65  48.56  -31.79  56.45  
1 1 1 3   -17 13 o 11 32.30   14.60  -28.92    57.74    -37.68   58.00    962.61    616.89   31.33   14.34  152.74  55.04  -121.40 56.88  
1 1 1 3   -16 0  x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   -16 1  o 17 207.44  53.07  1504.54   634.49   0.00     0.00     1504.54   634.49   ?       ?      207.44  53.07  0.00    53.07  
1 1 1 3   -16 2  o 10 335.35  62.63  4078.11   1161.42  4078.11  1161.42  0.00      0.00     335.35  62.63  ?       ?      0.00    62.63  
1 1 1 3   -16 3  o 10 192.24  38.19  1190.94   406.62   1190.94  406.62   0.00      0.00     192.24  38.19  ?       ?      0.00    38.19  
1 1 1 3   -16 4  o 17 276.04  49.37  2579.16   753.61   2579.16  753.61   0.00      0.00     276.04  49.37  ?       ?      0.00    49.37  
1 1 1 3   -16 5  o 18 136.41  31.60  590.65    242.56   500.70   272.95   928.47    528.97   124.84  36.07  163.63  50.91  -38.79  62.39  
1 1 1 3   -16 6  f 0  257.20  32.45  2065.53   468.54   1863.46  598.96   2384.17   752.14   234.99  46.05  261.49  51.94  -26.50  69.41  
1 1 1 3   -16 7  o 3  62.78   25.82  47.77     149.69   33.78    157.01   187.34    495.92   62.54   26.15  109.50  46.17  -46.96  53.06  
1 1 1 3   -16 8  o 6  59.87   25.19  24.90     147.19   62.08    154.87   -322.53   473.42   65.07   26.46  84.15   39.36  -19.08  47.43  
1 1 1 3   -16 9  f 0  170.13  27.78  902.05    261.95   831.35   300.02   1128.79   537.31   160.39  33.66  176.96  50.44  -16.57  60.64  
1 1 1 3   -16 10 o 8  280.61  33.68  2504.84   531.78   2270.46  693.51   2839.31   828.45   253.59  49.42  279.90  53.51  -26.31  72.84  
1 1 1 3   -16 11 o 17 201.65  28.68  1272.49   322.65   1218.49  383.25   1403.91   597.87   192.93  35.93  194.53  52.38  -1.61   63.52  
1 1 1 3   -16 12 o 7  ?       ?      -532.65   136.24   -630.67  142.97   435.23    449.25   ?       ?      120.08  46.22  0.00    46.22  
1 1 1 3   -16 13 o 4  111.62  43.33  359.24    397.31   0.00     0.00     359.24    397.31   ?       ?      111.62  43.33  0.00    43.33  
1 1 1 3   -16 14 o 4  119.90  44.61  472.65    410.21   0.00     0.00     472.65    410.21   ?       ?      119.90  44.61  0.00    44.61  
1 1 1 3   -16 15 o 17 74.82   27.26  153.04    151.81   139.62   164.04   233.11    400.72   74.29   28.09  101.52  42.05  -27.24  50.57  
1 1 1 3   -15 0  x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   -15 1  o 16 364.67  68.06  4625.27   1372.44  0.00     0.00     4625.27   1372.44  ?       ?      364.67  68.06  0.00    68.06  
1 1 1 3   -15 2  o 13 485.70  56.40  7759.45   1543.41  7669.06  2164.67  7852.91   2201.21  445.82  87.71  450.51  88.27  -4.69   124.43 
1 1 1 3   -15 3  o 11 85.83   32.29  171.67    216.12   171.67   216.12   0.00      0.00     85.83   32.29  ?       ?      0.00    32.29  
1 1 1 3   -15 4  o 8  80.57   30.36  149.34    191.29   127.09   210.51   254.77    458.22   80.43   31.45  114.03  45.81  -33.60  55.57  
1 1 1 3   -15 5  o 15 338.96  59.83  3949.01   1121.64  3949.01  1121.64  0.00      0.00     338.96  59.83  ?       ?      0.00    59.83  
1 1 1 3   -15 6  o 19 327.90  57.32  3671.51   1039.62  3671.51  1039.62  0.00      0.00     327.90  57.32  ?       ?      0.00    57.32  
1 1 1 3   -15 7  o 1  225.18  37.88  1600.82   472.28   1600.82  472.28   0.00      0.00     225.18  37.88  ?       ?      0.00    37.88  
1 1 1 3   -15 8  o 6  419.34  47.76  5746.95   1129.33  5426.54  1574.74  6086.25   1620.48  375.52  75.67  401.91  72.92  -26.39  105.08 
1 1 1 3   -15 9  o 16 186.81  25.80  1059.41   269.27   1027.16  331.09   1122.42   462.77   180.87  33.11  183.74  44.38  -2.87   55.37  
1 1 1 3   -15 10 o 3  70.15   25.68  123.00    135.01   102.13   150.08   211.47    309.03   69.34   26.71  97.17   38.07  -27.84  46.51  
1 1 1 3   -15 11 o 17 115.53  25.19  414.69    162.35   378.15   183.30   547.71    349.70   109.55  28.78  129.73  41.53  -20.18  50.53  
1 1 1 3   -15 12 o 19 26.70   10.49  11.87     23.54    11.23    23.60    140.01    333.37   26.53   10.48  93.06   38.43  -66.53  39.84  
1 1 1 3   -15 13 o 15 120.41  24.60  450.75    164.33   518.41   187.49   226.60    341.27   128.76  26.26  99.84   39.73  28.92   47.62  
1 1 1 3   -15 14 o 5  144.93  24.61  649.45    197.45   676.88   232.65   578.82    373.36   146.27  28.73  131.18  42.99  15.09   51.70  
1 1 1 3   -15 15 o 15 148.73  43.30  772.34    392.05   0.00     0.00     772.34    392.05   ?       ?      148.73  43.30  0.00    43.30  
1 1 1 3   -15 16 o 3  104.13  41.02  287.66    360.41   0.00     0.00     287.66    360.41   ?       ?      104.13  41.02  0.00    41.02  
1 1 1 3   -15 17 f 0  213.95  49.63  1717.04   597.71   0.00     0.00     1717.04   597.71   ?       ?      213.95  49.63  0.00    49.63  
1 1 1 3   -14 0  o 18 170.33  29.47  878.20    277.74   946.09   332.68   722.07    504.51   175.55  34.24  153.53  49.95  22.02   60.56  
1 1 1 3   -14 1  o 13 72.78   30.81  18.66     222.21   310.92   246.72   -1236.98  511.40   104.60  34.97  67.36   33.53  37.24   48.45  
1 1 1 3   -14 2  o 1  313.10  51.86  3100.60   899.48   3100.60  899.48   0.00      0.00     313.10  51.86  ?       ?      0.00    51.86  
1 1 1 3   -14 3  o 17 588.77  126.51 14762.30  4148.29  0.00     0.00     14762.30  4148.29  ?       ?      588.77  126.51 0.00    126.51 
1 1 1 3   -14 4  o 13 181.21  54.80  1046.06   618.40   0.00     0.00     1046.06   618.40   ?       ?      181.21  54.80  0.00    54.80  
1 1 1 3   -14 5  o 5  239.36  49.85  1823.84   662.73   0.00     0.00     1823.84   662.73   ?       ?      239.36  49.85  0.00    49.85  
1 1 1 3   -14 6  o 4  408.30  43.30  5131.51   999.56   4615.85  1390.90  5682.26   1437.43  369.77  68.03  416.02  62.09  -46.25  92.10  
1 1 1 3   -14 7  o 4  233.51  27.28  1628.30   358.75   1565.36  474.45   1712.33   548.19   224.90  38.11  233.55  42.45  -8.66   57.05  
1 1 1 3   -14 8  o 18 192.77  33.11  1142.33   353.17   1142.33  353.17   0.00      0.00     192.77  33.11  ?       ?      0.00    33.11  
1 1 1 3   -14 9  o 9  178.17  31.22  976.20    307.66   976.20   307.66   0.00      0.00     178.17  31.22  ?       ?      0.00    31.22  
1 1 1 3   -14 10 f 0  371.03  66.73  4880.40   1368.98  4880.40  1368.98  0.00      0.00     371.03  66.73  ?       ?      0.00    66.73  
1 1 1 3   -14 11 o 7  24.63   12.48  -313.00   88.55    -431.00  93.13    799.17    285.91   ?       ?      160.01  32.24  0.00    32.24  
1 1 1 3   -14 12 o 7  85.46   34.82  112.07    268.94   0.00     0.00     112.07    268.94   ?       ?      85.46   34.82  0.00    34.82  
1 1 1 3   -14 13 o 7  264.22  49.01  2357.62   716.01   0.00     0.00     2357.62   716.01   ?       ?      264.22  49.01  0.00    49.01  
1 1 1 3   -14 14 o 15 218.24  26.13  1451.37   320.90   1420.71  424.22   1492.37   490.62   210.43  36.44  212.48  41.71  -2.05   55.38  
1 1 1 3   -14 15 o 7  195.52  24.73  1164.67   271.35   1021.88  346.89   1389.76   435.55   177.89  35.22  206.34  38.18  -28.45  51.94  
1 1 1 3   -14 16 o 18 187.96  24.95  1082.28   262.59   1145.61  333.65   979.21    425.65   190.00  31.71  168.62  43.64  21.38   53.94  
1 1 1 3   -14 17 o 15 253.25  29.28  2004.06   417.91   1811.43  559.27   2247.62   628.87   229.53  44.05  255.90  44.42  -26.37  62.56  
1 1 1 3   -14 18 o 9  237.30  50.22  2062.63   662.78   0.00     0.00     2062.63   662.78   ?       ?      237.30  50.22  0.00    50.22  
1 1 1 3   -14 19 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   -13 0  o 4  336.74  36.16  3425.75   688.11   3336.34  960.57   3519.99   986.21   323.07  53.68  332.08  53.55  -9.01   75.82  
1 1 1 3   -13 1  o 6  205.31  40.73  1313.32   463.04   0.00     0.00     1313.32   463.04   ?       ?      205.31  40.73  0.00    40.73  
1 1 1 3   -13 2  o 14 251.70  30.08  1895.60   425.98   2328.88  582.02   1395.72   625.16   276.39  37.66  207.60  52.45  68.78   64.57  
1 1 1 3   -13 3  o 7  237.26  28.54  1679.73   380.91   1933.56  512.56   1366.61   569.28   251.95  36.50  206.69  48.77  45.26   60.92  
1 1 1 3   -13 4  o 11 499.99  52.83  7863.09   1493.49  6733.29  2102.45  9013.91   2121.90  431.09  87.94  515.67  73.78  -84.58  114.79 
1 1 1 3   -13 5  o 18 252.02  28.72  1889.66   408.07   2055.49  556.20   1696.34   600.54   259.56  38.49  232.22  46.67  27.34   60.50  
1 1 1 3   -13 6  o 8  450.41  78.17  6905.38   1947.99  0.00     0.00     6905.38   1947.99  ?       ?      450.41  78.17  0.00    78.17  
1 1 1 3   -13 7  o 13 266.50  47.44  2213.89   699.23   0.00     0.00     2213.89   699.23   ?       ?      266.50  47.44  0.00    47.44  
1 1 1 3   -13 8  o 3  344.16  58.44  3785.58   1113.35  0.00     0.00     3785.58   1113.35  ?       ?      344.16  58.44  0.00    58.44  
1 1 1 3   -13 9  f 0  73.50   25.03  146.30    126.41   176.19   143.83   44.87     264.97   79.76   26.70  81.05   33.93  -1.29   43.18  
1 1 1 3   -13 10 o 16 149.72  21.93  666.92    182.91   739.94   226.71   530.75    309.59   156.82  26.10  131.31  38.55  25.51   46.55  
1 1 1 3   -13 11 o 15 19.30   8.05   1.98      14.83    1.98     14.83    0.00      0.00     19.30   8.05   ?       ?      0.00    8.05   
1 1 1 3   -13 12 o 6  134.40  26.78  552.50    199.33   552.50   199.33   0.00      0.00     134.40  26.78  ?       ?      0.00    26.78  
1 1 1 3   -13 13 o 13 287.62  31.96  2518.23   518.79   2534.89  716.87   2499.92   751.72   280.39  46.14  276.43  49.17  3.96    67.43  
1 1 1 3   -13 14 o 10 362.49  39.83  4129.34   815.21   3897.25  1140.59  4371.72   1165.57  333.00  61.94  355.90  59.12  -22.90  85.63  
1 1 1 3   -13 15 o 1  82.48   25.50  203.68    132.95   203.68   132.95   0.00      0.00     82.48   25.50  ?       ?      0.00    25.50  
1 1 1 3   -13 16 o 19 189.48  23.56  1084.51   250.76   1020.00  321.27   1185.09   401.15   179.91  32.29  191.31  37.87  -11.40  49.77  
1 1 1 3   -13 17 o 6  235.74  26.73  1699.92   355.34   1495.29  474.27   1961.79   536.52   212.98  40.26  245.21  39.45  -32.23  56.37  
1 1 1 3   -13 18 o 7  183.16  23.47  1021.06   241.13   875.80   305.16   1262.54   393.45   164.80  33.40  197.04  36.11  -32.24  49.19  
1 1 1 3   -13 19 o 11 276.81  30.87  2412.84   482.27   2028.99  654.70   2868.22   713.11   237.93  49.54  289.50  44.32  -51.56  66.47  
1 1 1 3   -13 20 o 12 108.77  39.20  369.67    312.88   0.00     0.00     369.67    312.88   ?       ?      108.77  39.20  0.00    39.20  
1 1 1 3   -13 21 o 11 93.38   37.53  206.52    307.60   0.00     0.00     206.52    307.60   ?       ?      93.38   37.53  0.00    37.53  
1 1 1 3   -12 0  o 4  414.73  67.17  5523.10   1544.58  5523.10  1544.58  0.00      0.00     414.73  67.17  ?       ?      0.00    67.17  
1 1 1 3   -12 1  o 10 260.33  28.18  2001.06   414.43   1995.91  572.72   2006.71   600.45   256.41  40.23  256.43  42.26  -0.02   58.35  
1 1 1 3   -12 2  o 12 160.99  20.62  762.82    186.21   771.53   244.86   750.86    286.78   160.44  27.58  157.07  32.86  3.36    42.90  
1 1 1 3   -12 3  o 13 227.55  24.97  1524.96   320.86   1582.44  446.53   1463.60   461.36   229.16  35.06  219.32  38.02  9.84    51.72  
1 1 1 3   -12 4  o 1  232.14  24.78  1587.39   325.19   1543.14  450.89   1635.35   469.44   225.73  36.00  232.40  36.38  -6.66   51.18  
1 1 1 3   -12 5  o 12 110.89  18.56  365.53    113.96   292.84   142.16   496.21    190.62   98.33   25.10  127.98  26.81  -29.65  36.72  
1 1 1 3   -12 6  o 8  530.76  59.34  8961.72   1777.16  9130.47  2511.14  8792.38   2515.44  506.49  89.64  494.30  92.03  12.20   128.48 
1 1 1 3   -12 7  o 19 490.53  54.51  7573.78   1508.97  7833.24  2131.20  7312.93   2136.83  475.52  80.97  455.40  84.86  20.12   117.29 
1 1 1 3   -12 8  o 5  157.16  21.06  730.25    185.20   531.72   236.77   1043.16   297.26   131.65  31.71  186.43  28.69  -54.77  42.76  
1 1 1 3   -12 9  o 11 189.25  37.45  1100.45   392.42   0.00     0.00     1100.45   392.42   ?       ?      189.25  37.45  0.00    37.45  
1 1 1 3   -12 10 o 2  126.52  40.14  474.15    327.32   0.00     0.00     474.15    327.32   ?       ?      126.52  40.14  0.00    40.14  
1 1 1 3   -12 11 o 18 289.41  50.01  2618.36   800.90   0.00     0.00     2618.36   800.90   ?       ?      289.41  50.01  0.00    50.01  
1 1 1 3   -12 12 o 16 187.94  23.55  1045.49   248.54   1138.17  320.68   906.08    393.29   194.61  29.64  170.36  40.76  24.25   50.40  
1 1 1 3   -12 13 o 18 547.26  63.36  9891.79   1953.72  9875.93  2758.43  9907.75   2767.56  503.23  99.01  503.76  99.23  -0.53   140.18 
1 1 1 3   -12 14 o 14 249.19  40.31  1942.20   556.94   1942.20  556.94   0.00      0.00     249.19  40.31  ?       ?      0.00    40.31  
1 1 1 3   -12 15 o 15 111.60  23.25  379.53    144.15   379.53   144.15   0.00      0.00     111.60  23.25  ?       ?      0.00    23.25  
1 1 1 3   -12 16 o 10 220.37  24.86  1455.86   309.07   1335.43  415.93   1604.35   461.84   206.08  36.49  226.13  36.85  -20.05  51.86  
1 1 1 3   -12 17 o 19 253.02  28.89  1952.05   412.16   2108.47  566.33   1775.92   600.97   256.81  39.69  230.70  46.98  26.11   61.50  
1 1 1 3   -12 18 o 1  252.94  28.03  1957.54   400.13   1760.05  547.09   2184.67   586.72   230.60  42.91  259.02  40.81  -28.42  59.21  
1 1 1 3   -12 19 o 3  192.59  23.72  1125.80   256.71   1125.67  333.04   1125.99   402.95   188.66  31.89  184.54  39.24  4.11    50.57  
1 1 1 3   -12 20 o 13 233.54  27.53  1686.30   361.98   1715.55  488.31   1650.61   539.32   228.12  38.67  219.31  44.36  8.81    58.85  
1 1 1 3   -12 21 o 13 60.47   23.00  82.63     110.42   76.13    121.98   112.14    259.88   61.31   23.95  82.54   34.00  -21.23  41.59  
1 1 1 3   -12 22 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   -12 23 o 14 139.52  38.91  684.60    323.28   0.00     0.00     684.60    323.28   ?       ?      139.52  38.91  0.00    38.91  
1 1 1 3   -11 0  o 14 237.24  25.13  1656.85   337.06   1578.84  469.06   1740.14   484.66   228.24  37.07  240.10  36.29  -11.86  51.88  
1 1 1 3   -11 1  o 5  375.89  59.83  4461.25   1247.73  4461.25  1247.73  0.00      0.00     375.89  59.83  ?       ?      0.00    59.83  
1 1 1 3   -11 2  o 16 309.08  47.99  2933.44   823.88   2933.44  823.88   0.00      0.00     309.08  47.99  ?       ?      0.00    47.99  
1 1 1 3   -11 3  o 10 269.74  41.33  2204.72   619.65   2204.72  619.65   0.00      0.00     269.74  41.33  ?       ?      0.00    41.33  
1 1 1 3   -11 4  o 19 183.64  20.45  987.60    211.98   1075.00  291.25   889.16    309.11   190.26  27.46  171.55  32.58  18.71   42.61  
1 1 1 3   -11 5  o 5  158.79  18.32  737.92    163.92   733.38   221.86   743.37    243.25   156.93  25.50  157.50  27.93  -0.58   37.82  
1 1 1 3   -11 6  o 14 297.86  30.87  2620.20   520.23   2523.37  731.42   2719.33   740.09   287.51  45.85  299.20  44.44  -11.69  63.85  
1 1 1 3   -11 7  o 17 216.88  23.46  1380.92   287.39   1450.67  398.93   1305.67   414.38   220.18  32.54  207.72  36.06  12.46   48.57  
1 1 1 3   -11 8  o 16 485.44  51.60  7255.41   1416.00  6802.26  2000.18  7710.68   2004.87  449.42  80.48  483.90  74.56  -34.49  109.71 
1 1 1 3   -11 9  o 18 409.09  43.72  5092.81   1010.92  5153.01  1425.97  5031.99   1433.37  399.03  64.45  393.32  65.81  5.71    92.11  
1 1 1 3   -11 10 o 18 337.43  29.64  3372.74   568.28   1.51     791.07   6967.54   816.88   130.23  56.65  485.97  29.42  -355.74 63.84  
1 1 1 3   -11 11 o 15 440.96  75.33  6553.87   1838.42  0.00     0.00     6553.87   1838.42  ?       ?      440.96  75.33  0.00    75.33  
1 1 1 3   -11 12 o 11 541.84  99.45  10660.41  2979.51  0.00     0.00     10660.41  2979.51  ?       ?      541.84  99.45  0.00    99.45  
1 1 1 3   -11 13 o 19 342.22  55.96  3696.36   1061.41  0.00     0.00     3696.36   1061.41  ?       ?      342.22  55.96  0.00    55.96  
1 1 1 3   -11 14 o 9  416.45  44.29  5298.56   1042.63  5034.03  1467.80  5567.98   1481.30  390.77  67.89  413.89  64.44  -23.12  93.61  
1 1 1 3   -11 15 o 19 386.84  66.24  5026.33   1418.18  0.00     0.00     5026.33   1418.18  ?       ?      386.84  66.24  0.00    66.24  
1 1 1 3   -11 16 o 3  297.15  48.54  2837.32   799.52   2837.32  799.52   0.00      0.00     297.15  48.54  ?       ?      0.00    48.54  
1 1 1 3   -11 17 o 10 74.33   23.54  160.99    112.58   160.99   112.58   0.00      0.00     74.33   23.54  ?       ?      0.00    23.54  
1 1 1 3   -11 18 o 18 170.78  34.50  918.73    326.57   0.00     0.00     918.73    326.57   ?       ?      170.78  34.50  0.00    34.50  
1 1 1 3   -11 19 o 4  65.94   22.37  120.84    100.98   95.82    116.15   198.24    204.33   63.78   23.74  86.82   31.62  -23.03  39.54  
1 1 1 3   -11 20 o 17 280.60  31.58  2452.09   499.83   2468.02  696.44   2435.17   717.79   269.87  46.64  266.18  48.77  3.69    67.48  
1 1 1 3   -11 21 o 19 62.92   21.93  107.65    97.26    139.85   109.82   -9.41     209.39   69.78   23.33  66.92   29.13  2.86    37.32  
1 1 1 3   -11 22 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   -11 23 o 7  96.39   22.51  291.35    122.28   292.97   140.58   286.30    247.84   96.07   25.19  97.45   34.92  -1.38   43.05  
1 1 1 3   -11 24 o 7  80.81   23.84  204.88    118.14   188.11   136.60   254.64    235.31   78.65   26.01  92.61   33.90  -13.97  42.73  
1 1 1 3   -10 0  o 18 336.84  54.82  3661.36   1023.54  0.00     0.00     3661.36   1023.54  ?       ?      336.84  54.82  0.00    54.82  
1 1 1 3   -10 1  o 17 94.69   13.58  264.11    71.69    256.34   102.59   271.53    100.22   92.16   19.97  95.05   19.03  -2.89   27.58  
1 1 1 3   -10 2  o 5  152.10  16.77  677.71    143.96   724.32   203.17   630.70    204.01   155.89  23.43  144.77  25.48  11.12   34.61  
1 1 1 3   -10 3  o 6  391.49  41.20  4655.40   912.18   4410.69  1288.52  4901.24   1291.52  367.95  63.28  390.87  59.43  -22.92  86.81  
1 1 1 3   -10 4  o 14 345.50  54.79  3758.48   1050.48  3758.48  1050.48  0.00      0.00     345.50  54.79  ?       ?      0.00    54.79  
1 1 1 3   -10 5  o 16 202.25  31.16  1225.97   350.18   1225.97  350.18   0.00      0.00     202.25  31.16  ?       ?      0.00    31.16  
1 1 1 3   -10 6  o 3  239.46  25.02  1684.47   338.92   1675.99  475.79   1693.20   482.89   235.96  36.29  237.08  36.66  -1.12   51.58  
1 1 1 3   -10 7  o 7  240.48  24.71  1696.24   336.25   1424.57  470.56   1979.70   480.65   216.54  39.30  257.94  33.23  -41.40  51.47  
1 1 1 3   -10 8  o 17 137.90  16.56  556.37    128.48   559.30   171.54   552.64    193.92   137.20  22.56  135.74  25.83  1.46    34.30  
1 1 1 3   -10 9  o 17 312.03  30.32  2868.08   536.26   1456.66  753.39   4317.56   763.48   214.74  59.21  381.91  35.22  -167.17 68.89  
1 1 1 3   -10 10 o 11 227.92  21.44  1518.17   277.20   -198.79  382.64   3414.34   402.11   82.67   37.45  342.80  20.53  -260.13 42.71  
1 1 1 3   -10 11 o 7  563.34  62.03  10043.43  1972.83  9754.50  2788.81  10332.86  2791.19  523.21  96.40  542.39  92.99  -19.18  133.94 
1 1 1 3   -10 12 o 14 189.60  20.69  1055.81   221.55   838.08   302.70   1307.02   325.13   165.72  32.98  209.51  27.71  -43.79  43.08  
1 1 1 3   -10 13 o 5  400.83  42.23  4884.24   957.21   4409.65  1349.95  5364.15   1357.48  366.18  66.67  409.71  59.45  -43.53  89.33  
1 1 1 3   -10 14 o 7  340.23  54.79  3643.52   1033.80  0.00     0.00     3643.52   1033.80  ?       ?      340.23  54.79  0.00    54.79  
1 1 1 3   -10 15 o 15 492.10  85.98  8360.95   2340.64  0.00     0.00     8360.95   2340.64  ?       ?      492.10  85.98  0.00    85.98  
1 1 1 3   -10 16 o 11 285.84  46.37  2542.14   734.90   0.00     0.00     2542.14   734.90   ?       ?      285.84  46.37  0.00    46.37  
1 1 1 3   -10 17 o 2  351.67  37.50  3770.31   745.40   3428.45  1048.85  4119.18   1059.55  322.10  58.89  357.80  53.20  -35.70  79.36  
1 1 1 3   -10 18 o 9  324.66  54.56  3490.31   980.83   3490.31  980.83   0.00      0.00     324.66  54.56  ?       ?      0.00    54.56  
1 1 1 3   -10 19 o 2  302.17  50.82  3017.86   850.30   3017.86  850.30   0.00      0.00     302.17  50.82  ?       ?      0.00    50.82  
1 1 1 3   -10 20 o 14 189.44  31.50  1115.54   330.58   1115.54  330.58   0.00      0.00     189.44  31.50  ?       ?      0.00    31.50  
1 1 1 3   -10 21 o 10 148.25  27.16  682.01    222.67   682.01   222.67   0.00      0.00     148.25  27.16  ?       ?      0.00    27.16  
1 1 1 3   -10 22 o 11 195.11  36.73  1241.31   396.28   0.00     0.00     1241.31   396.28   ?       ?      195.11  36.73  0.00    36.73  
1 1 1 3   -10 23 o 1  107.06  21.17  353.34    125.52   301.58   152.67   461.28    220.48   97.67   26.54  119.17  31.69  -21.50  41.33  
1 1 1 3   -10 24 f 0  68.92   20.88  144.32    89.69    129.09   100.23   205.60    201.01   66.70   22.29  85.71   31.34  -19.01  38.46  
1 1 1 3   -10 25 o 3  174.18  22.18  935.25    216.73   904.71   282.79   978.71    337.40   166.27  30.76  169.57  35.79  -3.30   47.19  
1 1 1 3   -9  0  o 11 483.54  55.94  7677.93   1524.25  8035.49  2155.46  7320.27   2155.76  460.56  84.64  432.35  89.80  28.21   123.40 
1 1 1 3   -9  1  o 11 236.37  36.96  1729.01   485.05   0.00     0.00     1729.01   485.05   ?       ?      236.37  36.96  0.00    36.96  
1 1 1 3   -9  2  o 4  186.26  28.72  1050.71   297.23   0.00     0.00     1050.71   297.23   ?       ?      186.26  28.72  0.00    28.72  
1 1 1 3   -9  3  o 7  129.85  20.60  503.36    148.42   0.00     0.00     503.36    148.42   ?       ?      129.85  20.60  0.00    20.60  
1 1 1 3   -9  4  o 15 325.73  35.01  3212.57   644.46   3689.26  911.94   2737.00   910.86   342.14  47.73  288.52  57.02  53.63   74.36  
1 1 1 3   -9  5  o 7  280.66  29.16  2348.29   462.92   2157.77  653.19   2540.55   656.17   262.41  44.98  287.12  40.97  -24.71  60.84  
1 1 1 3   -9  6  o 18 402.32  42.86  4949.69   974.68   4813.67  1377.55  5086.05   1379.26  382.29  65.10  394.71  62.99  -12.42  90.58  
1 1 1 3   -9  7  o 8  276.23  42.77  2341.66   656.37   2341.66  656.37   0.00      0.00     276.23  42.77  ?       ?      0.00    42.77  
1 1 1 3   -9  8  o 3  435.39  71.23  6164.53   1718.89  6164.53  1718.89  0.00      0.00     435.39  71.23  ?       ?      0.00    71.23  
1 1 1 3   -9  9  f 0  334.94  32.15  3313.93   610.54   3.06     858.88   6695.95   868.07   137.28  59.38  477.22  31.87  -339.95 67.39  
1 1 1 3   -9  10 o 11 326.65  33.73  3156.91   623.40   3022.73  879.53   3292.37   883.74   313.92  50.52  328.77  48.26  -14.85  69.87  
1 1 1 3   -9  11 o 4  235.54  36.47  1666.35   477.18   0.00     0.00     1666.35   477.18   ?       ?      235.54  36.47  0.00    36.47  
1 1 1 3   -9  12 o 12 191.15  20.35  1069.16   219.85   1067.23  305.81   1071.22   316.29   189.14  29.10  189.26  30.12  -0.12   41.88  
1 1 1 3   -9  13 o 15 445.25  47.28  6052.07   1190.00  5619.37  1681.69  6486.03   1684.15  412.18  73.78  447.98  67.59  -35.80  100.06 
1 1 1 3   -9  14 o 2  215.97  22.93  1372.70   279.92   1515.56  393.07   1225.69   398.73   224.79  31.31  200.35  35.99  24.44   47.70  
1 1 1 3   -9  15 o 14 365.43  38.70  4029.60   799.54   4080.32  1129.63  3978.68   1131.80  358.20  56.83  353.03  57.85  5.17    81.09  
1 1 1 3   -9  16 o 4  243.45  38.75  1803.96   523.48   0.00     0.00     1803.96   523.48   ?       ?      243.45  38.75  0.00    38.75  
1 1 1 3   -9  17 o 17 43.53   21.05  -257.12   160.38   0.00     0.00     -257.12   160.38   ?       ?      43.53   21.05  0.00    21.05  
1 1 1 3   -9  18 o 12 311.05  50.23  3065.63   866.37   0.00     0.00     3065.63   866.37   ?       ?      311.05  50.23  0.00    50.23  
1 1 1 3   -9  19 o 13 381.91  41.56  4534.66   896.40   4347.74  1266.11  4722.52   1269.30  356.10  64.30  374.19  61.20  -18.09  88.77  
1 1 1 3   -9  20 o 7  224.54  24.35  1506.01   308.90   1398.06  433.15   1617.71   440.64   211.02  37.11  228.50  34.68  -17.48  50.79  
1 1 1 3   -9  21 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   -9  22 o 12 267.95  45.72  2402.82   678.10   2402.82  678.10   0.00      0.00     267.95  45.72  ?       ?      0.00    45.72  
1 1 1 3   -9  23 o 18 136.77  18.05  560.09    138.29   563.31   181.92   555.70    212.82   135.02  24.37  132.42  28.82  2.60    37.74  
1 1 1 3   -9  24 f 0  257.77  28.74  2073.86   418.05   1837.06  585.07   2320.85   597.54   228.81  46.14  262.74  40.95  -33.92  61.69  
1 1 1 3   -9  25 o 2  115.44  17.96  404.03    115.13   401.85   148.51   407.32    182.28   113.14  23.63  112.31  28.29  0.82    36.86  
1 1 1 3   -9  26 o 19 122.73  18.22  458.82    124.51   417.39   160.86   520.71    196.64   114.18  25.22  126.61  27.82  -12.43  37.54  
1 1 1 3   -8  0  o 19 444.89  83.53  7375.13   2054.90  7375.13  2054.90  0.00      0.00     444.89  83.53  ?       ?      0.00    83.53  
1 1 1 3   -8  1  o 16 368.24  39.95  4184.18   831.05   4523.22  1175.28  3845.14   1175.27  370.43  57.10  336.30  63.20  34.13   85.17  
1 1 1 3   -8  2  o 13 467.68  52.40  7043.67   1382.69  6680.16  1955.27  7407.30   1955.58  422.59  83.56  452.02  78.19  -29.42  114.44 
1 1 1 3   -8  3  o 18 330.84  35.30  3335.01   660.08   3478.03  933.57   3192.05   933.41   328.04  51.25  312.13  54.05  15.91   74.48  
1 1 1 3   -8  4  f 0  459.40  88.44  8066.62   2247.87  0.00     0.00     8066.62   2247.87  ?       ?      459.40  88.44  0.00    88.44  
1 1 1 3   -8  5  o 10 367.70  62.40  4553.89   1270.12  0.00     0.00     4553.89   1270.12  ?       ?      367.70  62.40  0.00    62.40  
1 1 1 3   -8  6  o 10 91.76   16.55  251.51    83.96    0.00     0.00     251.51    83.96    ?       ?      91.76   16.55  0.00    16.55  
1 1 1 3   -8  7  o 18 360.70  38.52  3970.67   785.33   4185.90  1110.61  3755.43   1110.64  359.58  55.59  337.58  59.48  22.00   81.42  
1 1 1 3   -8  8  o 7  87.39   12.71  224.90    61.88    -7.60    79.99    571.43    97.66    42.17   18.18  140.23  12.25  -98.06  21.92  
1 1 1 3   -8  9  o 5  19.80   9.95   -154.43   50.60    -154.43  50.60    0.00      0.00     19.80   9.95   ?       ?      0.00    9.95   
1 1 1 3   -8  10 o 4  136.85  21.46  556.04    163.05   556.04   163.05   0.00      0.00     136.85  21.46  ?       ?      0.00    21.46  
1 1 1 3   -8  11 o 11 268.27  27.73  2118.54   420.95   2204.57  594.53   2032.05   596.11   270.41  39.46  258.76  41.54  11.65   57.29  
1 1 1 3   -8  12 o 4  430.08  45.03  5556.91   1095.37  5380.78  1548.68  5733.22   1549.49  412.04  67.83  426.99  65.28  -14.95  94.14  
1 1 1 3   -8  13 o 3  322.12  33.39  3069.93   608.44   3209.67  860.02   2929.90   860.90   324.70  47.55  308.95  50.27  15.75   69.19  
1 1 1 3   -8  14 o 14 221.09  34.10  1468.32   418.87   0.00     0.00     1468.32   418.87   ?       ?      221.09  34.10  0.00    34.10  
1 1 1 3   -8  15 f 0  674.01  79.07  15236.43  3001.44  15135.67 4244.52  15337.21  4244.83  610.73  125.27 616.45  124.25 -5.73   176.44 
1 1 1 3   -8  16 o 3  469.24  50.95  6849.07   1350.56  6630.36  1909.54  7067.99   1910.43  439.86  78.50  457.19  75.42  -17.32  108.86 
1 1 1 3   -8  17 o 5  388.18  41.10  4561.96   901.95   4350.39  1273.96  4774.59   1277.15  366.97  62.72  386.91  59.40  -19.94  86.38  
1 1 1 3   -8  18 o 3  477.89  82.76  7834.06   2188.20  0.00     0.00     7834.06   2188.20  ?       ?      477.89  82.76  0.00    82.76  
1 1 1 3   -8  19 o 12 426.54  73.19  6177.38   1727.61  0.00     0.00     6177.38   1727.61  ?       ?      426.54  73.19  0.00    73.19  
1 1 1 3   -8  20 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   -8  21 o 4  239.25  39.33  1805.55   521.42   0.00     0.00     1805.55   521.42   ?       ?      239.25  39.33  0.00    39.33  
1 1 1 3   -8  22 o 19 232.63  25.21  1627.79   331.30   1541.64  463.71   1717.63   473.50   220.18  38.06  233.52  36.52  -13.33  52.75  
1 1 1 3   -8  23 o 16 130.08  23.23  517.81    167.07   517.81   167.07   0.00      0.00     130.08  23.23  ?       ?      0.00    23.23  
1 1 1 3   -8  24 o 6  174.03  29.48  953.20    283.98   953.20   283.98   0.00      0.00     174.03  29.48  ?       ?      0.00    29.48  
1 1 1 3   -8  25 o 18 65.22   19.46  128.55    78.38    116.91   93.85    155.39    142.54   64.04   21.57  74.81   26.51  -10.78  34.18  
1 1 1 3   -8  26 o 18 103.63  17.34  326.27    99.53    337.27   123.33   305.71    168.57   104.09  21.35  97.54   28.39  6.55    35.53  
1 1 1 3   -8  27 o 4  48.92   19.42  42.90     81.33    31.50    91.77    84.60     175.56   49.37   20.25  69.04   28.13  -19.67  34.66  
1 1 1 3   -7  0  o 13 165.62  16.95  802.88    158.91   636.10   224.26   971.06    225.20   144.69  28.01  181.19  22.11  -36.50  35.69  
1 1 1 3   -7  1  o 11 144.17  15.03  607.52    122.55   642.99   173.21   571.98    173.42   147.14  21.11  138.27  22.63  8.87    30.95  
1 1 1 3   -7  2  o 5  125.98  13.28  463.26    94.61    426.36   133.31   500.71    134.30   119.48  20.15  130.06  18.51  -10.58  27.36  
1 1 1 3   -7  3  o 1  461.51  50.84  6731.44   1324.74  6464.82  1873.35  6998.12   1873.58  425.97  79.53  447.64  75.60  -21.68  109.73 
1 1 1 3   -7  4  o 14 515.98  58.91  8699.51   1713.71  8684.46  2423.48  8714.56   2423.62  477.58  91.73  478.68  91.53  -1.10   129.59 
1 1 1 3   -7  5  o 14 356.15  38.03  3876.69   765.59   4044.11  1082.65  3709.23   1082.78  352.63  55.30  335.28  58.37  17.35   80.41  
1 1 1 3   -7  6  o 10 397.81  43.29  4922.10   972.61   5427.72  1375.56  4416.60   1375.40  403.32  61.34  356.01  69.79  47.31   92.92  
1 1 1 3   -7  7  o 14 186.06  28.60  1047.16   295.67   0.00     0.00     1047.16   295.67   ?       ?      186.06  28.60  0.00    28.60  
1 1 1 3   -7  8  o 1  479.43  94.00  8953.22   2494.73  0.00     0.00     8953.22   2494.73  ?       ?      479.43  94.00  0.00    94.00  
1 1 1 3   -7  9  o 6  115.88  12.67  392.27    82.91    512.93   115.82   265.40    118.75   132.21  15.56  93.47   22.42  38.74   27.29  
1 1 1 3   -7  10 o 15 327.75  34.47  3234.57   638.82   3140.71  903.17   3328.54   903.68   314.07  51.90  324.53  50.12  -10.46  72.15  
1 1 1 3   -7  11 o 1  201.82  30.91  1225.60   346.70   1225.60  346.70   0.00      0.00     201.82  30.91  ?       ?      0.00    30.91  
1 1 1 3   -7  12 o 2  314.89  48.89  3059.00   855.08   3059.00  855.08   0.00      0.00     314.89  48.89  ?       ?      0.00    48.89  
1 1 1 3   -7  13 o 7  140.27  22.30  583.83    173.56   583.83   173.56   0.00      0.00     140.27  22.30  ?       ?      0.00    22.30  
1 1 1 3   -7  14 o 3  686.44  76.86  15113.26  2976.81  14395.58 4209.77  15830.99  4209.93  623.82  121.93 663.33  114.71 -39.51  167.40 
1 1 1 3   -7  15 o 17 593.74  64.99  11058.49  2179.12  11064.11 3081.65  11052.88  3081.84  564.90  98.61  564.54  98.68  0.36    139.51 
1 1 1 3   -7  16 o 1  225.48  23.45  1494.09   299.10   1508.49  422.10   1479.56   423.88   223.82  33.91  221.46  34.46  2.36    48.35  
1 1 1 3   -7  17 o 12 245.99  25.75  1788.06   358.20   1531.60  504.30   2049.21   508.88   222.62  40.97  260.61  34.89  -37.99  53.81  
1 1 1 3   -7  18 f 0  415.71  44.45  5285.28   1044.42  4953.94  1476.31  5617.28   1477.77  386.49  69.07  415.88  63.94  -29.39  94.13  
1 1 1 3   -7  19 o 14 368.40  38.95  4091.86   811.31   3577.36  1145.20  4610.26   1149.54  332.28  62.33  383.49  53.69  -51.21  82.26  
1 1 1 3   -7  20 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   -7  21 o 11 293.49  47.64  2750.62   775.18   0.00     0.00     2750.62   775.18   ?       ?      293.49  47.64  0.00    47.64  
1 1 1 3   -7  22 o 14 254.13  41.56  2056.41   585.40   0.00     0.00     2056.41   585.40   ?       ?      254.13  41.56  0.00    41.56  
1 1 1 3   -7  23 o 5  292.39  31.78  2628.04   524.83   2331.47  739.96   2928.27   744.52   262.29  50.98  299.78  44.62  -37.48  67.75  
1 1 1 3   -7  24 o 18 135.11  16.63  542.25    126.30   533.62   172.05   552.35    185.99   131.89  23.59  133.70  25.16  -1.81   34.49  
1 1 1 3   -7  25 o 5  150.25  25.73  701.85    213.98   701.85   213.98   0.00      0.00     150.25  25.73  ?       ?      0.00    25.73  
1 1 1 3   -7  26 o 13 135.25  24.43  571.05    182.71   571.05   182.71   0.00      0.00     135.25  24.43  ?       ?      0.00    24.43  
1 1 1 3   -7  27 o 19 199.54  22.85  1226.00   257.01   1243.85  357.31   1206.86   369.95   194.10  33.26  189.63  35.28  4.47    48.49  
1 1 1 3   -7  28 o 9  43.66   18.62  5.53      82.31    -27.08   102.87   63.53     137.21   44.84   19.93  61.26   24.90  -16.42  31.90  
1 1 1 3   -6  0  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   -6  1  o 1  264.69  27.26  2068.05   408.33   2093.35  577.34   2042.73   577.60   262.48  39.54  259.01  40.14  3.47    56.35  
1 1 1 3   -6  2  o 4  221.68  22.75  1443.48   285.44   1394.73  403.50   1492.32   403.83   214.96  33.81  222.89  32.52  -7.93   46.91  
1 1 1 3   -6  3  o 18 276.93  28.63  2272.24   448.59   2302.57  634.34   2241.89   634.45   274.24  41.60  270.26  42.28  3.97    59.31  
1 1 1 3   -6  4  o 8  583.16  66.54  11109.59  2187.82  10634.95 3093.97  11584.26  3094.10  524.79  106.35 555.79  100.68 -30.99  146.45 
1 1 1 3   -6  5  o 18 305.74  31.90  2796.39   551.59   2855.05  780.00   2737.72   780.13   302.46  46.40  295.46  47.61  7.00    66.48  
1 1 1 3   -6  6  o 7  140.87  14.69  579.87    117.06   560.73   164.61   599.45    166.52   137.10  21.63  141.98  21.07  -4.88   30.20  
1 1 1 3   -6  7  o 7  173.21  18.71  881.91    183.06   -4.99    256.54   1801.89   261.28   75.80   32.62  248.34  18.46  -172.53 37.48  
1 1 1 3   -6  8  o 18 216.18  23.15  1383.63   282.81   -41.88   398.08   2836.39   401.86   91.36   39.96  310.50  22.70  -219.14 45.96  
1 1 1 3   -6  9  o 5  240.60  37.46  1787.88   500.59   0.00     0.00     1787.88   500.59   ?       ?      240.60  37.46  0.00    37.46  
1 1 1 3   -6  10 o 3  206.40  31.80  1296.76   364.68   0.00     0.00     1296.76   364.68   ?       ?      206.40  31.80  0.00    31.80  
1 1 1 3   -6  11 o 17 372.41  39.76  4245.98   836.80   4401.54  1183.59  4090.51   1183.23  367.04  58.11  351.64  60.82  15.40   84.11  
1 1 1 3   -6  12 o 9  494.87  54.85  7758.73   1532.18  7117.11  2166.65  8400.57   2167.02  442.90  88.32  491.59  79.50  -48.70  118.83 
1 1 1 3   -6  13 o 4  75.91   15.92  172.66    67.14    172.66   67.14    0.00      0.00     75.91   15.92  ?       ?      0.00    15.92  
1 1 1 3   -6  14 o 8  272.41  41.59  2250.82   629.77   2250.82  629.77   0.00      0.00     272.41  41.59  ?       ?      0.00    41.59  
1 1 1 3   -6  15 f 0  276.17  28.55  2244.98   446.06   2021.57  630.14   2469.36   631.50   257.47  44.23  286.74  39.40  -29.27  59.23  
1 1 1 3   -6  16 o 19 536.22  57.86  8871.96   1752.80  8177.16  2478.58  9567.06   2479.09  490.57  91.37  538.61  82.83  -48.04  123.33 
1 1 1 3   -6  17 o 14 204.99  21.55  1232.58   249.82   1019.35  352.14   1448.62   354.46   182.99  34.79  220.75  28.65  -37.75  45.07  
1 1 1 3   -6  18 o 6  332.98  35.10  3328.79   660.92   3035.87  933.82   3622.79   935.53   308.53  54.73  340.67  49.27  -32.14  73.63  
1 1 1 3   -6  19 o 16 267.28  41.58  2197.27   617.31   2197.27  617.31   0.00      0.00     267.28  41.58  ?       ?      0.00    41.58  
1 1 1 3   -6  20 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   -6  21 o 14 284.61  29.91  2414.00   481.36   2366.90  679.40   2461.48   682.11   275.94  44.40  281.89  43.55  -5.95   62.19  
1 1 1 3   -6  22 o 7  155.36  26.29  731.04    226.08   0.00     0.00     731.04    226.08   ?       ?      155.36  26.29  0.00    26.29  
1 1 1 3   -6  23 o 5  79.41   23.39  189.80    113.84   0.00     0.00     189.80    113.84   ?       ?      79.41   23.39  0.00    23.39  
1 1 1 3   -6  24 o 7  84.53   16.02  215.06    74.90    155.44   99.64    292.51    113.57   72.22   22.03  97.84   20.86  -25.62  30.34  
1 1 1 3   -6  25 o 3  178.69  19.75  955.09    199.21   960.06   278.48   949.88    285.10   175.44  28.64  174.03  29.59  1.40    41.18  
1 1 1 3   -6  26 o 1  71.35   20.85  155.48    90.76    155.48   90.76    0.00      0.00     71.35   20.85  ?       ?      0.00    20.85  
1 1 1 3   -6  27 o 7  148.38  27.22  699.75    223.31   699.75   223.31   0.00      0.00     148.38  27.22  ?       ?      0.00    27.22  
1 1 1 3   -6  28 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   -6  29 o 16 61.25   21.06  108.22    89.53    95.66    124.19   121.82    129.18   63.25   24.31  67.46   25.05  -4.21   34.91  
1 1 1 3   -5  0  o 19 267.87  27.47  2110.12   416.41   2046.18  588.84   2174.09   588.94   260.08  40.78  268.70  39.35  -8.62   56.67  
1 1 1 3   -5  1  o 8  111.47  16.90  366.60    104.78   366.60   104.78   0.00      0.00     111.47  16.90  ?       ?      0.00    16.90  
1 1 1 3   -5  2  o 4  441.46  71.22  6258.74   1743.57  6258.74  1743.57  0.00      0.00     441.46  71.22  ?       ?      0.00    71.22  
1 1 1 3   -5  3  o 19 700.09  80.09  16044.65  3161.00  15843.24 4470.32  16246.07  4470.34  642.43  125.72 653.40  123.71 -10.97  176.38 
1 1 1 3   -5  4  o 17 302.29  31.26  2705.68   534.73   2543.44  756.10   2868.04   756.36   287.41  47.48  306.86  44.21  -19.45  64.88  
1 1 1 3   -5  5  o 18 787.63  98.14  22015.38  4341.32  20921.94 6139.50  23108.85  6139.59  661.37  162.81 715.02  154.12 -53.64  224.19 
1 1 1 3   -5  6  o 19 489.84  53.32  7477.47   1475.06  6998.68  2085.92  7956.38   2086.19  449.22  83.97  485.65  77.43  -36.42  114.22 
1 1 1 3   -5  7  o 14 335.23  35.96  3387.08   681.23   1.39     962.13   6790.81   964.69   141.46  61.99  476.06  35.56  -334.61 71.46  
1 1 1 3   -5  8  o 17 13.81   6.84   -46.55    20.10    -46.55   20.10    0.00      0.00     13.81   6.84   ?       ?      0.00    6.84   
1 1 1 3   -5  9  o 7  189.14  19.56  1051.93   209.29   999.40   295.51   1104.80   296.46   181.64  29.34  191.67  27.75  -10.03  40.38  
1 1 1 3   -5  10 o 16 304.46  32.06  2795.11   551.87   2693.22  780.37   2897.05   780.57   290.23  48.55  302.48  46.43  -12.25  67.18  
1 1 1 3   -5  11 o 9  189.93  29.16  1092.15   307.77   0.00     0.00     1092.15   307.77   ?       ?      189.93  29.16  0.00    29.16  
1 1 1 3   -5  12 o 13 101.38  16.96  306.05    95.20    0.00     0.00     306.05    95.20    ?       ?      101.38  16.96  0.00    16.96  
1 1 1 3   -5  13 o 6  217.59  22.58  1396.25   277.91   1259.51  392.69   1533.46   393.36   202.79  35.00  225.55  31.22  -22.76  46.89  
1 1 1 3   -5  14 o 5  400.38  42.55  4878.36   963.12   4593.00  1361.86  5163.89   1362.27  374.44  65.75  400.66  61.16  -26.22  89.80  
1 1 1 3   -5  15 o 18 121.77  19.27  439.34    130.26   439.34   130.26   0.00      0.00     121.77  19.27  ?       ?      0.00    19.27  
1 1 1 3   -5  16 o 19 491.50  81.31  7943.96   2214.11  7943.96  2214.11  0.00      0.00     491.50  81.31  ?       ?      0.00    81.31  
1 1 1 3   -5  17 o 16 357.35  37.21  3803.36   752.20   3577.11  1063.48  4029.85   1064.07  338.61  56.71  361.63  52.81  -23.02  77.50  
1 1 1 3   -5  18 o 19 405.06  43.03  4972.24   985.19   4381.30  1392.75  5564.06   1393.78  365.57  68.89  419.17  59.60  -53.60  91.10  
1 1 1 3   -5  19 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   -5  20 f 0  158.10  25.91  749.95    227.05   0.00     0.00     749.95    227.05   ?       ?      158.10  25.91  0.00    25.91  
1 1 1 3   -5  21 o 14 238.02  36.98  1724.65   488.91   1724.65  488.91   0.00      0.00     238.02  36.98  ?       ?      0.00    36.98  
1 1 1 3   -5  22 o 9  413.31  44.88  5284.59   1047.72  4998.17  1480.87  5571.66   1482.54  383.42  69.85  409.10  65.32  -25.68  95.64  
1 1 1 3   -5  23 o 17 168.51  27.08  861.70    253.06   861.70   253.06   0.00      0.00     168.51  27.08  ?       ?      0.00    27.08  
1 1 1 3   -5  24 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   -5  25 f 0  232.36  38.62  1742.44   497.04   0.00     0.00     1742.44   497.04   ?       ?      232.36  38.62  0.00    38.62  
1 1 1 3   -5  26 f 0  170.91  19.87  877.67    191.36   839.37   267.32   917.92    274.06   162.82  29.69  170.79  28.99  -7.97   41.50  
1 1 1 3   -5  27 o 1  178.89  31.06  1030.71   307.38   1030.71  307.38   0.00      0.00     178.89  31.06  ?       ?      0.00    31.06  
1 1 1 3   -5  28 o 16 158.91  28.92  815.57    254.13   815.57   254.13   0.00      0.00     158.91  28.92  ?       ?      0.00    28.92  
1 1 1 3   -5  29 o 5  117.98  26.71  454.52    176.70   454.52   176.70   0.00      0.00     117.98  26.71  ?       ?      0.00    26.71  
1 1 1 3   -5  30 o 16 121.82  27.38  494.15    186.82   0.00     0.00     494.15    186.82   ?       ?      121.82  27.38  0.00    27.38  
1 1 1 3   -4  0  o 13 188.81  28.15  1058.32   295.85   0.00     0.00     1058.32   295.85   ?       ?      188.81  28.15  0.00    28.15  
1 1 1 3   -4  1  o 15 746.20  84.18  17989.69  3543.04  18405.20 5010.61  17574.18  5010.61  707.11  128.15 686.00  132.03 21.12   184.00 
1 1 1 3   -4  2  o 15 696.48  77.32  15444.48  3039.29  14744.57 4298.17  16144.41  4298.24  637.15  121.95 675.01  115.04 -37.85  167.65 
1 1 1 3   -4  3  o 13 444.51  70.84  6271.27   1746.95  6271.27  1746.95  0.00      0.00     444.51  70.84  ?       ?      0.00    70.84  
1 1 1 3   -4  4  o 4  620.19  110.84 13649.36  3801.36  13649.36 3801.36  0.00      0.00     620.19  110.84 ?       ?      0.00    110.84 
1 1 1 3   -4  5  o 14 596.80  65.20  11158.21  2197.57  11162.41 3107.83  11154.02  3107.83  568.21  98.87  567.95  98.91  0.26    139.85 
1 1 1 3   -4  6  o 8  407.88  42.16  5001.17   972.98   -4.26    1375.03  10020.79  1376.98  169.08  74.10  578.95  41.71  -409.87 85.03  
1 1 1 3   -4  7  o 12 106.45  11.54  330.08    69.41    1.24     95.71    694.90    100.81   47.39   20.15  154.94  11.41  -107.54 23.15  
1 1 1 3   -4  8  o 9  616.07  70.92  12506.60  2462.33  12165.40 3482.20  12847.82  3482.34  557.03  112.77 578.18  108.91 -21.16  156.78 
1 1 1 3   -4  9  o 8  395.74  42.23  4797.02   944.49   4435.20  1335.59  5158.96   1335.82  364.57  66.26  398.33  60.30  -33.77  89.59  
1 1 1 3   -4  10 o 1  124.74  13.07  454.22    92.22    345.23   129.95   564.81    130.90   106.86  21.92  138.59  16.80  -31.72  27.61  
1 1 1 3   -4  11 o 15 260.61  27.14  2025.31   400.03   1957.04  565.61   2093.63   565.85   250.50  40.73  260.03  39.12  -9.53   56.47  
1 1 1 3   -4  12 o 10 203.96  21.10  1227.84   243.54   1144.44  344.25   1311.42   344.60   193.41  32.13  208.21  29.67  -14.80  43.73  
1 1 1 3   -4  13 o 14 181.68  27.84  996.62    281.15   0.00     0.00     996.62    281.15   ?       ?      181.68  27.84  0.00    27.84  
1 1 1 3   -4  14 o 4  453.45  81.82  7361.76   2051.51  0.00     0.00     7361.76   2051.51  ?       ?      453.45  81.82  0.00    81.82  
1 1 1 3   -4  15 o 10 268.70  27.83  2139.29   423.05   2140.73  598.30   2137.85   598.26   264.25  40.75  264.06  40.78  0.19    57.65  
1 1 1 3   -4  16 o 7  371.37  38.82  4132.15   815.39   4073.14  1152.97  4191.19   1153.28  359.95  57.75  365.74  56.77  -5.79   80.98  
1 1 1 3   -4  17 o 11 224.84  34.03  1515.20   425.57   1515.20  425.57   0.00      0.00     224.84  34.03  ?       ?      0.00    34.03  
1 1 1 3   -4  18 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   -4  19 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   -4  20 o 18 293.66  30.73  2575.17   510.32   2564.81  721.48   2585.55   721.92   286.83  45.32  288.10  45.13  -1.27   63.96  
1 1 1 3   -4  21 o 12 219.37  22.94  1418.26   284.59   1457.80  401.91   1378.50   403.03   219.54  32.90  212.98  34.12  6.57    47.40  
1 1 1 3   -4  22 o 4  559.96  63.82  10194.34  2014.80  9806.65  2849.11  10582.16  2849.60  507.35  101.37 533.63  96.58  -26.29  140.01 
1 1 1 3   -4  23 o 19 168.62  18.53  836.47    176.39   797.12   247.42   877.15    251.55   162.22  27.55  170.65  26.54  -8.42   38.26  
1 1 1 3   -4  24 o 6  203.36  32.49  1278.35   366.50   1278.35  366.50   0.00      0.00     203.36  32.49  ?       ?      0.00    32.49  
1 1 1 3   -4  25 o 14 105.12  14.63  327.39    85.88    357.49   117.93   293.40    125.32   108.71  19.62  97.62   22.78  11.09   30.06  
1 1 1 3   -4  26 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   -4  27 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   -4  28 o 2  174.48  31.12  991.18    300.23   991.18   300.23   0.00      0.00     174.48  31.12  ?       ?      0.00    31.12  
1 1 1 3   -4  29 o 19 46.78   19.13  28.88     81.55    66.77    122.27   -1.47     109.45   59.47   23.74  49.02   21.20  10.45   31.83  
1 1 1 3   -4  30 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   -4  31 o 9  99.94   27.23  337.33    160.47   337.33   160.47   0.00      0.00     99.94   27.23  ?       ?      0.00    27.23  
1 1 1 3   -3  0  o 17 425.44  66.59  5647.83   1573.13  0.00     0.00     5647.83   1573.13  ?       ?      425.44  66.59  0.00    66.59  
1 1 1 3   -3  1  o 18 535.18  87.53  9322.64   2596.38  0.00     0.00     9322.64   2596.38  ?       ?      535.18  87.53  0.00    87.53  
1 1 1 3   -3  2  o 6  260.17  39.07  2028.43   565.56   2028.43  565.56   0.00      0.00     260.17  39.07  ?       ?      0.00    39.07  
1 1 1 3   -3  3  o 18 712.50  132.15 18695.58  5206.28  18695.58 5206.28  0.00      0.00     712.50  132.15 ?       ?      0.00    132.15 
1 1 1 3   -3  4  o 3  527.87  86.73  9108.86   2536.98  9108.86  2536.98  0.00      0.00     527.87  86.73  ?       ?      0.00    86.73  
1 1 1 3   -3  5  o 6  711.16  136.10 19225.64  5353.95  19225.64 5353.95  0.00      0.00     711.16  136.10 ?       ?      0.00    136.10 
1 1 1 3   -3  6  o 18 7.59    3.28   -0.34     2.61     -0.34    2.61     0.00      0.00     7.59    3.28   ?       ?      0.00    3.28   
1 1 1 3   -3  7  o 18 393.30  62.16  4869.88   1356.94  0.00     0.00     4869.88   1356.94  ?       ?      393.30  62.16  0.00    62.16  
1 1 1 3   -3  8  o 18 259.05  26.61  1976.76   390.05   1936.17  551.51   2017.37   551.71   252.64  39.30  258.30  38.37  -5.66   54.93  
1 1 1 3   -3  9  o 16 122.12  12.73  434.52    87.94    435.55   124.02   433.47    124.71   121.31  18.39  120.98  18.55  0.33    26.12  
1 1 1 3   -3  10 o 11 337.86  35.51  3440.92   678.41   3370.58  959.37   3511.28   959.47   325.16  53.24  332.77  51.92  -7.62   74.36  
1 1 1 3   -3  11 o 10 489.25  54.88  7689.06   1514.76  7583.72  2142.19  7794.40   2142.21  454.36  85.26  462.50  83.77  -8.14   119.53 
1 1 1 3   -3  12 o 5  316.71  51.42  3237.03   902.80   3237.03  902.80   0.00      0.00     316.71  51.42  ?       ?      0.00    51.42  
1 1 1 3   -3  13 o 3  352.17  37.67  3803.46   749.85   3875.08  1060.45  3731.84   1060.45  343.27  55.72  335.76  57.06  7.52    79.75  
1 1 1 3   -3  14 o 11 487.58  98.19  9523.58   2653.23  0.00     0.00     9523.58   2653.23  ?       ?      487.58  98.19  0.00    98.19  
1 1 1 3   -3  15 o 15 404.95  69.36  5576.24   1554.43  0.00     0.00     5576.24   1554.43  ?       ?      404.95  69.36  0.00    69.36  
1 1 1 3   -3  16 o 15 644.03  75.80  13933.91  2748.94  13137.71 3887.51  14730.18  3887.67  561.61  123.91 609.08  115.41 -47.48  169.33 
1 1 1 3   -3  17 o 8  583.64  107.16 12412.67  3458.02  0.00     0.00     12412.67  3458.02  ?       ?      583.64  107.16 0.00    107.16 
1 1 1 3   -3  18 o 5  541.26  93.57  10056.36  2802.22  10056.36 2802.22  0.00      0.00     541.26  93.57  ?       ?      0.00    93.57  
1 1 1 3   -3  19 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   -3  20 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   -3  21 o 7  420.24  45.51  5474.50   1080.47  5453.09  1528.02  5495.91   1528.02  401.64  68.74  403.53  68.40  -1.89   96.98  
1 1 1 3   -3  22 o 18 228.23  23.79  1537.11   307.13   1655.11  434.22   1418.98   434.46   234.02  33.26  215.30  36.45  18.73   49.34  
1 1 1 3   -3  23 o 1  72.33   15.64  157.16    63.06    204.62   85.35    100.08    93.59    82.37   18.50  61.83   21.52  20.54   28.38  
1 1 1 3   -3  24 o 16 376.15  66.40  4945.65   1381.45  0.00     0.00     4945.65   1381.45  ?       ?      376.15  66.40  0.00    66.40  
1 1 1 3   -3  25 o 1  81.06   23.20  199.72    113.44   0.00     0.00     199.72    113.44   ?       ?      81.06   23.20  0.00    23.20  
1 1 1 3   -3  26 o 10 110.95  16.44  367.62    101.57   356.12   147.60   377.96    139.99   107.06  24.54  110.81  22.77  -3.75   33.48  
1 1 1 3   -3  27 o 6  263.29  47.21  2430.26   687.30   0.00     0.00     2430.26   687.30   ?       ?      263.29  47.21  0.00    47.21  
1 1 1 3   -3  28 o 12 138.24  26.21  606.21    200.36   0.00     0.00     606.21    200.36   ?       ?      138.24  26.21  0.00    26.21  
1 1 1 3   -3  29 o 11 206.06  23.58  1321.04   273.96   1335.55  389.40   1306.82   385.50   198.13  35.54  195.90  35.59  2.23    50.30  
1 1 1 3   -3  30 o 14 168.17  20.78  876.79    196.36   817.63   280.72   933.47    274.77   154.36  32.70  167.60  29.64  -13.24  44.14  
1 1 1 3   -3  31 o 3  110.40  28.02  415.32    177.87   415.32   177.87   0.00      0.00     110.40  28.02  ?       ?      0.00    28.02  
1 1 1 3   -2  0  o 6  838.25  180.91 30345.15  8449.82  30345.15 8449.82  0.00      0.00     838.25  180.91 ?       ?      0.00    180.91 
1 1 1 3   -2  1  o 13 349.23  53.42  3722.59   1037.00  3722.59  1037.00  0.00      0.00     349.23  53.42  ?       ?      0.00    53.42  
1 1 1 3   -2  2  o 4  211.86  31.58  1334.81   372.37   0.00     0.00     1334.81   372.37   ?       ?      211.86  31.58  0.00    31.58  
1 1 1 3   -2  3  o 13 561.80  93.00  10393.69  2894.61  0.00     0.00     10393.69  2894.61  ?       ?      561.80  93.00  0.00    93.00  
1 1 1 3   -2  4  o 11 130.03  13.26  491.63    97.59    470.53   137.71   512.92    138.33   126.20  19.65  132.03  18.78  -5.83   27.18  
1 1 1 3   -2  5  o 12 268.69  26.84  2115.54   408.51   -4.75    576.97   4246.91   578.48   114.11  49.01  381.67  26.57  -267.56 55.74  
1 1 1 3   -2  6  o 14 7.35    2.98   0.61      1.96     0.61     1.96     0.00      0.00     7.35    2.98   ?       ?      0.00    2.98   
1 1 1 3   -2  7  o 7  400.26  62.87  5014.56   1397.01  5014.56  1397.01  0.00      0.00     400.26  62.87  ?       ?      0.00    62.87  
1 1 1 3   -2  8  o 13 209.47  21.39  1283.74   253.61   1275.31  358.48   1292.19   358.84   206.61  31.19  208.06  30.99  -1.44   43.97  
1 1 1 3   -2  9  o 9  300.09  30.97  2668.18   525.94   2466.14  743.64   2870.38   743.94   282.56  47.53  306.98  43.43  -24.42  64.38  
1 1 1 3   -2  10 o 12 482.77  52.47  7262.98   1430.68  6846.50  2023.19  7679.53   2023.37  444.69  82.28  476.84  76.50  -32.15  112.35 
1 1 1 3   -2  11 o 8  281.72  44.08  2470.92   689.50   0.00     0.00     2470.92   689.50   ?       ?      281.72  44.08  0.00    44.08  
1 1 1 3   -2  12 f 0  65.14   12.34  126.51    44.47    0.00     0.00     126.51    44.47    ?       ?      65.14   12.34  0.00    12.34  
1 1 1 3   -2  13 o 2  224.76  34.80  1553.09   434.52   0.00     0.00     1553.09   434.52   ?       ?      224.76  34.80  0.00    34.80  
1 1 1 3   -2  14 o 14 126.11  13.30  464.86    94.85    446.78   134.00   483.01    134.28   122.28  19.76  127.44  18.93  -5.16   27.37  
1 1 1 3   -2  15 o 10 221.46  34.20  1502.08   420.81   0.00     0.00     1502.08   420.81   ?       ?      221.46  34.20  0.00    34.20  
1 1 1 3   -2  16 o 4  496.08  94.04  9260.62   2580.12  0.00     0.00     9260.62   2580.12  ?       ?      496.08  94.04  0.00    94.04  
1 1 1 3   -2  17 o 18 282.13  43.63  2446.59   683.81   0.00     0.00     2446.59   683.81   ?       ?      282.13  43.63  0.00    43.63  
1 1 1 3   -2  18 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   -2  19 o 19 699.47  80.80  16152.21  3184.92  15592.98 4504.11  16711.46  4504.19  628.30  129.19 658.86  123.63 -30.56  178.81 
1 1 1 3   -2  20 o 15 136.19  21.69  551.87    163.93   551.87   163.93   0.00      0.00     136.19  21.69  ?       ?      0.00    21.69  
1 1 1 3   -2  21 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   -2  22 o 3  474.06  87.85  8258.64   2302.63  8258.64  2302.63  0.00      0.00     474.06  87.85  ?       ?      0.00    87.85  
1 1 1 3   -2  23 o 11 142.68  16.45  597.09    132.25   552.45   187.09   641.68    186.98   135.31  25.01  146.58  22.97  -11.27  33.96  
1 1 1 3   -2  24 o 13 129.79  15.37  494.78    112.30   500.18   158.23   489.29    159.40   129.02  22.16  127.46  22.61  1.55    31.66  
1 1 1 3   -2  25 o 16 295.68  32.17  2681.46   537.31   2557.53  759.23   2805.80   760.52   277.25  49.52  292.69  46.84  -15.44  68.16  
1 1 1 3   -2  26 o 13 295.59  32.79  2721.76   547.01   2557.04  773.76   2886.33   773.42   271.79  51.48  292.55  47.69  -20.76  70.17  
1 1 1 3   -2  27 o 18 376.82  45.49  4838.95   964.16   4609.67  1363.59  5068.19   1363.46  327.49  74.25  350.89  70.14  -23.41  102.14 
1 1 1 3   -2  28 o 11 190.59  21.84  1109.07   234.62   1057.56  332.92   1159.90   330.69   179.15  33.61  189.19  31.56  -10.04  46.10  
1 1 1 3   -2  29 o 10 181.22  32.10  1088.01   321.76   0.00     0.00     1088.01   321.76   ?       ?      181.22  32.10  0.00    32.10  
1 1 1 3   -2  30 o 10 148.14  28.21  722.42    231.16   0.00     0.00     722.42    231.16   ?       ?      148.14  28.21  0.00    28.21  
1 1 1 3   -2  31 o 17 98.25   18.97  303.83    103.15   290.34   155.47   314.44    137.85   92.84   27.34  97.51   24.62  -4.67   36.79  
1 1 1 3   -1  0  o 14 489.78  51.39  7226.67   1423.43  7323.29  2013.04  7130.04   2013.04  480.68  75.43  473.46  76.68  7.22    107.57 
1 1 1 3   -1  1  f 0  525.09  55.42  8356.15   1645.28  8034.89  2326.75  8677.42   2326.79  498.38  84.33  520.85  80.41  -22.46  116.52 
1 1 1 3   -1  2  o 17 572.40  95.31  10850.62  3021.71  0.00     0.00     10850.62  3021.71  ?       ?      572.40  95.31  0.00    95.31  
1 1 1 3   -1  3  o 5  595.14  100.36 11874.58  3306.87  0.00     0.00     11874.58  3306.87  ?       ?      595.14  100.36 0.00    100.36 
1 1 1 3   -1  4  o 3  315.01  47.80  3004.65   837.21   0.00     0.00     3004.65   837.21   ?       ?      315.01  47.80  0.00    47.80  
1 1 1 3   -1  5  o 4  499.45  51.69  7516.22   1460.62  1.38     2065.05  15039.54  2066.21  206.58  90.66  708.43  51.15  -501.85 104.10 
1 1 1 3   -1  6  o 10 611.66  65.04  11553.97  2248.71  -24.47   3179.54  23141.51  3180.78  246.18  110.02 868.18  64.28  -622.00 127.42 
1 1 1 3   -1  7  o 6  768.77  159.23 24404.07  6795.81  24404.07 6795.81  0.00      0.00     768.77  159.23 ?       ?      0.00    159.23 
1 1 1 3   -1  8  o 1  164.78  24.54  804.64    225.08   804.64   225.08   0.00      0.00     164.78  24.54  ?       ?      0.00    24.54  
1 1 1 3   -1  9  o 18 255.91  38.77  1978.48   551.79   1978.48  551.79   0.00      0.00     255.91  38.77  ?       ?      0.00    38.77  
1 1 1 3   -1  10 f 0  197.07  20.16  1137.38   224.90   1182.96  318.05   1091.80   318.07   199.08  28.65  190.75  30.04  8.33    41.51  
1 1 1 3   -1  11 o 4  209.81  21.53  1294.23   255.66   1222.75  361.47   1365.78   361.65   200.89  32.45  213.19  30.41  -12.30  44.47  
1 1 1 3   -1  12 o 8  377.13  40.32  4360.01   859.45   4445.65  1215.46  4274.38   1215.42  367.85  59.60  359.46  61.08  8.39    85.34  
1 1 1 3   -1  13 o 1  192.10  29.37  1118.56   313.64   0.00     0.00     1118.56   313.64   ?       ?      192.10  29.37  0.00    29.37  
1 1 1 3   -1  14 o 9  262.41  41.50  2164.44   604.46   0.00     0.00     2164.44   604.46   ?       ?      262.41  41.50  0.00    41.50  
1 1 1 3   -1  15 o 2  167.23  25.59  842.55    237.82   0.00     0.00     842.55    237.82   ?       ?      167.23  25.59  0.00    25.59  
1 1 1 3   -1  16 o 12 196.31  30.08  1167.59   328.18   0.00     0.00     1167.59   328.18   ?       ?      196.31  30.08  0.00    30.08  
1 1 1 3   -1  17 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   -1  18 o 4  294.24  45.46  2660.16   743.10   0.00     0.00     2660.16   743.10   ?       ?      294.24  45.46  0.00    45.46  
1 1 1 3   -1  19 o 8  443.57  46.97  5977.90   1177.85  6060.00  1665.83  5895.81   1665.64  433.36  69.29  426.56  70.48  6.80    98.84  
1 1 1 3   -1  20 o 1  189.34  19.68  1049.65   210.82   1076.98  298.40   1022.41   297.90   189.92  28.23  184.74  29.05  5.18    40.50  
1 1 1 3   -1  21 o 7  147.97  23.56  654.56    193.39   654.56   193.39   0.00      0.00     147.97  23.56  ?       ?      0.00    23.56  
1 1 1 3   -1  22 o 17 303.10  48.70  2920.69   818.67   2920.69  818.67   0.00      0.00     303.10  48.70  ?       ?      0.00    48.70  
1 1 1 3   -1  23 o 6  180.88  19.50  961.91    199.25   991.97   284.31   932.89    279.33   181.47  28.21  175.74  28.68  5.73    40.22  
1 1 1 3   -1  24 o 1  150.82  17.55  669.05    149.12   692.22   210.20   645.57    211.58   151.67  25.01  146.04  26.20  5.62    36.22  
1 1 1 3   -1  25 o 16 237.44  25.39  1689.66   340.78   1705.39  481.40   1673.86   482.47   233.19  37.21  230.72  37.73  2.47    52.99  
1 1 1 3   -1  26 o 5  166.49  19.23  825.92    180.42   773.50   252.16   880.90    258.24   157.55  28.95  168.95  27.58  -11.40  39.98  
1 1 1 3   -1  27 o 5  230.31  25.74  1623.48   334.56   1473.21  472.25   1774.88   474.03   210.07  40.63  234.09  36.46  -24.02  54.59  
1 1 1 3   -1  28 f 0  323.75  39.16  3525.29   713.09   3127.01  1007.79  3924.64   1009.14  270.37  65.61  317.19  57.54  -46.82  87.26  
1 1 1 3   -1  29 o 9  127.80  18.13  497.09    129.28   426.57   180.40   571.53    185.35   114.26  27.78  134.07  25.00  -19.81  37.37  
1 1 1 3   -1  30 o 4  121.65  27.32  488.04    186.15   0.00     0.00     488.04    186.15   ?       ?      121.65  27.32  0.00    27.32  
1 1 1 3   -1  31 o 7  151.75  30.14  787.38    253.32   0.00     0.00     787.38    253.32   ?       ?      151.75  30.14  0.00    30.14  
1 1 1 3   -1  32 o 12 64.22   21.68  126.95    94.85    156.73   130.64   93.76     137.93   71.24   25.37  63.41   25.25  7.83    35.79  
1 1 1 3   0   0  o 7  175.75  17.85  899.84    177.62   921.73   251.18   877.94    251.20   176.58  25.52  172.10  26.26  4.47    36.61  
1 1 1 3   0   1  o 8  237.33  24.15  1647.17   324.39   1575.86  458.72   1718.50   458.78   229.50  36.00  240.31  34.22  -10.81  49.67  
1 1 1 3   0   2  o 4  354.05  36.43  3705.60   729.89   3712.92  1032.22  3698.29   1032.23  348.87  53.22  348.12  53.35  0.75    75.36  
1 1 1 3   0   3  o 2  344.60  52.64  3620.01   1008.43  0.00     0.00     3620.01   1008.43  ?       ?      344.60  52.64  0.00    52.64  
1 1 1 3   0   4  o 12 569.04  94.64  10711.28  2982.98  0.00     0.00     10711.28  2982.98  ?       ?      569.04  94.64  0.00    94.64  
1 1 1 3   0   5  f 0  5.86    2.46   0.12      1.40     0.12     1.40     0.00      0.00     5.86    2.46   ?       ?      0.00    2.46   
1 1 1 3   0   6  o 3  624.26  67.44  12077.70  2378.44  12176.61 3363.63  11978.80  3363.63  601.05  101.07 595.17  102.12 5.89    143.68 
1 1 1 3   0   7  o 4  535.83  56.95  8762.69   1724.99  9186.31  2439.53  8339.10   2439.48  532.44  82.48  503.30  87.61  29.14   120.33 
1 1 1 3   0   8  o 9  524.08  87.38  9106.55   2536.34  9106.55  2536.34  0.00      0.00     524.08  87.38  ?       ?      0.00    87.38  
1 1 1 3   0   9  o 16 44.70   9.27   59.58     23.00    59.58    23.00    0.00      0.00     44.70   9.27   ?       ?      0.00    9.27   
1 1 1 3   0   10 f 0  217.62  22.27  1389.19   274.28   1359.98  387.86   1418.41   387.93   212.68  32.82  217.52  32.02  -4.84   45.86  
1 1 1 3   0   11 o 5  366.12  38.56  4050.24   798.26   3813.34  1128.80  4287.24   1129.02  343.97  59.31  367.69  55.19  -23.72  81.01  
1 1 1 3   0   12 o 10 275.10  28.60  2256.28   445.13   2248.53  629.42   2264.03   629.58   269.03  42.14  270.05  41.97  -1.02   59.48  
1 1 1 3   0   13 o 17 57.13   8.11   95.78     25.86    90.19    35.10    102.43    38.25    54.89   11.51  58.54   11.79  -3.65   16.47  
1 1 1 3   0   14 o 3  254.09  26.50  1929.49   380.86   1976.95  538.58   1882.02   538.65   252.00  38.44  245.19  39.62  6.81    55.21  
1 1 1 3   0   15 o 13 93.62   10.20  255.70    53.91    259.46   76.21    251.93    76.28    93.53   14.68  92.08   14.94  1.45    20.94  
1 1 1 3   0   16 o 17 338.22  56.07  3767.97   1050.65  3767.97  1050.65  0.00      0.00     338.22  56.07  ?       ?      0.00    56.07  
1 1 1 3   0   17 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   0   18 o 7  317.05  49.70  3135.18   874.89   0.00     0.00     3135.18   874.89   ?       ?      317.05  49.70  0.00    49.70  
1 1 1 3   0   19 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   0   20 o 3  335.79  35.01  3364.63   664.90   3285.19  940.58   3443.98   940.05   324.49  52.27  333.12  50.76  -8.62   72.86  
1 1 1 3   0   21 o 8  705.44  88.93  17875.52  3521.62  17804.26 4980.38  17946.78  4980.27  608.96  144.63 612.87  144.01 -3.91   204.10 
1 1 1 3   0   22 o 12 309.34  49.94  3060.89   856.60   3060.89  856.60   0.00      0.00     309.34  49.94  ?       ?      0.00    49.94  
1 1 1 3   0   23 o 7  202.26  31.73  1243.38   356.34   1243.38  356.34   0.00      0.00     202.26  31.73  ?       ?      0.00    31.73  
1 1 1 3   0   24 o 5  404.20  44.08  5074.47   1006.30  4919.54  1423.22  5229.34   1423.02  379.58  67.80  393.85  65.22  -14.26  94.08  
1 1 1 3   0   25 o 17 305.14  32.77  2841.18   565.13   2843.43  799.81   2838.93   798.62   295.16  48.91  294.95  48.88  0.21    69.15  
1 1 1 3   0   26 o 6  158.99  18.42  751.53    165.05   717.71   236.11   783.84    230.81   152.01  28.09  159.81  26.06  -7.80   38.32  
1 1 1 3   0   27 o 1  121.63  16.79  442.11    114.08   394.12   165.98   485.08    157.07   111.93  26.28  125.67  22.60  -13.74  34.67  
1 1 1 3   0   28 o 6  196.49  22.05  1177.10   244.39   1217.06  348.94   1138.61   342.41   193.58  32.55  186.72  33.16  6.86    46.47  
1 1 1 3   0   29 o 14 235.07  26.92  1752.58   356.71   1732.97  507.34   1771.75   501.63   220.22  41.66  223.91  40.52  -3.68   58.11  
1 1 1 3   0   30 o 4  103.52  18.38  331.81    105.25   291.15   158.90   363.59    140.48   93.92   27.63  106.25  23.64  -12.33  36.36  
1 1 1 3   0   31 o 6  218.25  45.10  1900.12   546.42   0.00     0.00     1900.12   546.42   ?       ?      218.25  45.10  0.00    45.10  
1 1 1 3   0   32 o 5  149.93  31.45  804.91    262.02   0.00     0.00     804.91    262.02   ?       ?      149.93  31.45  0.00    31.45  
1 1 1 3   1   0  o 14 525.28  55.36  8358.89   1644.39  8064.52  2325.50  8653.26   2325.54  499.64  84.06  520.21  80.47  -20.57  116.37 
1 1 1 3   1   1  o 10 571.16  60.84  9972.12   1964.24  10052.79 2777.84  9891.46   2777.86  554.30  90.41  549.09  91.33  5.21    128.51 
1 1 1 3   1   2  o 17 756.95  145.15 21826.95  6077.98  0.00     0.00     21826.95  6077.98  ?       ?      756.95  145.15 0.00    145.15 
1 1 1 3   1   3  o 18 155.54  23.05  714.75    199.61   0.00     0.00     714.75    199.61   ?       ?      155.54  23.05  0.00    23.05  
1 1 1 3   1   4  o 13 806.63  165.37 26575.23  7400.18  0.00     0.00     26575.23  7400.18  ?       ?      806.63  165.37 0.00    165.37 
1 1 1 3   1   5  o 6  463.36  47.67  6434.88   1249.93  -15.10   1767.15  12892.42  1768.19  192.33  84.15  657.66  47.15  -465.32 96.46  
1 1 1 3   1   6  o 15 178.63  18.15  929.93    183.59   922.18   259.58   937.69    259.68   176.40  26.45  177.96  26.20  -1.56   37.23  
1 1 1 3   1   7  o 18 413.99  43.07  5120.03   1008.57  5135.18  1426.32  5104.87   1426.35  405.82  63.29  404.49  63.52  1.33    89.67  
1 1 1 3   1   8  o 2  529.17  88.57  9319.49   2595.58  9319.49  2595.58  0.00      0.00     529.17  88.57  ?       ?      0.00    88.57  
1 1 1 3   1   9  o 7  270.60  41.08  2217.39   618.18   2217.39  618.18   0.00      0.00     270.60  41.08  ?       ?      0.00    41.08  
1 1 1 3   1   10 o 11 230.37  34.82  1598.81   446.09   1598.81  446.09   0.00      0.00     230.37  34.82  ?       ?      0.00    34.82  
1 1 1 3   1   11 o 19 286.62  29.68  2441.03   481.36   2494.37  680.71   2387.68   680.78   284.69  42.99  277.93  44.14  6.76    61.62  
1 1 1 3   1   12 f 0  141.35  14.53  583.70    116.22   565.10   164.20   602.37    164.53   137.65  21.48  142.38  20.74  -4.73   29.86  
1 1 1 3   1   13 o 14 164.97  16.98  798.43    158.49   781.50   223.96   815.42    224.33   161.20  25.01  164.89  24.44  -3.69   34.97  
1 1 1 3   1   14 o 3  238.25  24.78  1690.78   334.00   1655.33  472.30   1726.24   472.40   230.83  36.88  236.24  35.97  -5.41   51.52  
1 1 1 3   1   15 o 4  110.87  11.64  358.83    73.00    379.98   102.90   337.39    103.58   113.25  16.30  106.32  17.59  6.94    23.97  
1 1 1 3   1   16 f 0  157.39  23.93  743.89    209.44   743.89   209.44   0.00      0.00     157.39  23.93  ?       ?      0.00    23.93  
1 1 1 3   1   17 o 11 229.38  35.41  1611.51   451.22   0.00     0.00     1611.51   451.22   ?       ?      229.38  35.41  0.00    35.41  
1 1 1 3   1   18 o 7  226.41  34.59  1553.38   435.30   0.00     0.00     1553.38   435.30   ?       ?      226.41  34.59  0.00    34.59  
1 1 1 3   1   19 o 4  253.52  38.72  1950.64   545.68   0.00     0.00     1950.64   545.68   ?       ?      253.52  38.72  0.00    38.72  
1 1 1 3   1   20 o 2  576.03  108.32 12385.37  3450.36  0.00     0.00     12385.37  3450.36  ?       ?      576.03  108.32 0.00    108.32 
1 1 1 3   1   21 o 11 342.53  55.06  3745.86   1045.99  3745.86  1045.99  0.00      0.00     342.53  55.06  ?       ?      0.00    55.06  
1 1 1 3   1   22 o 12 253.47  26.57  1913.61   380.85   1860.97  538.49   1966.31   538.70   244.68  39.70  252.23  38.42  -7.55   55.24  
1 1 1 3   1   23 o 14 108.82  20.28  356.00    122.03   356.00   122.03   0.00      0.00     108.82  20.28  ?       ?      0.00    20.28  
1 1 1 3   1   24 f 0  202.75  32.85  1255.67   369.29   1255.67  369.29   0.00      0.00     202.75  32.85  ?       ?      0.00    32.85  
1 1 1 3   1   25 o 10 161.85  18.64  774.16    170.02   787.11   243.28   761.80    237.70   160.69  27.35  158.08  27.17  2.60    38.55  
1 1 1 3   1   26 o 15 56.66   19.55  86.55     77.20    19.19    114.07   143.49    104.87   53.15   22.26  70.29   22.77  -17.14  31.84  
1 1 1 3   1   27 o 8  96.74   17.59  283.53    94.11    335.93   135.30   234.40    130.99   103.95  23.26  86.94   24.95  17.00   34.10  
1 1 1 3   1   28 o 17 87.00   19.55  234.30    95.25    261.94   138.82   209.71    130.93   91.00   25.54  82.27   25.28  8.73    35.93  
1 1 1 3   1   29 o 16 102.40  18.62  323.36    105.42   249.21   158.86   381.70    140.92   88.30   27.96  109.69  23.11  -21.39  36.27  
1 1 1 3   1   30 o 16 64.47   20.61  126.68    86.14    140.59   134.30   116.96    112.29   70.49   25.64  64.90   23.47  5.59    34.76  
1 1 1 3   1   31 o 11 95.64   28.74  312.68    170.45   312.68   170.45   0.00      0.00     95.64   28.74  ?       ?      0.00    28.74  
1 1 1 3   1   32 o 18 46.26   20.41  -10.94    105.94   0.00     0.00     -10.94    105.94   ?       ?      46.26   20.41  0.00    20.41  
1 1 1 3   2   0  o 6  181.57  26.95  976.51    272.37   0.00     0.00     976.51    272.37   ?       ?      181.57  26.95  0.00    26.95  
1 1 1 3   2   1  o 4  755.88  144.48 21694.45  6041.08  0.00     0.00     21694.45  6041.08  ?       ?      755.88  144.48 0.00    144.48 
1 1 1 3   2   2  o 8  385.18  59.49  4570.37   1273.02  0.00     0.00     4570.37   1273.02  ?       ?      385.18  59.49  0.00    59.49  
1 1 1 3   2   3  o 19 341.33  52.11  3549.57   988.82   0.00     0.00     3549.57   988.82   ?       ?      341.33  52.11  0.00    52.11  
1 1 1 3   2   4  f 0  509.28  51.11  7806.82   1474.01  0.64     2084.05  15620.69  2085.07  207.26  91.02  722.23  50.61  -514.98 104.14 
1 1 1 3   2   5  o 5  362.11  37.35  3881.89   765.24   4002.94  1082.20  3760.84   1082.22  362.16  53.67  350.05  55.72  12.11   77.37  
1 1 1 3   2   6  o 16 562.79  60.13  9708.40   1912.60  9866.36  2704.82  9550.45   2704.83  547.92  89.05  537.56  90.89  10.37   127.24 
1 1 1 3   2   7  o 16 460.86  48.28  6401.41   1258.45  6102.20  1779.67  6700.66   1779.76  436.75  73.59  460.52  69.48  -23.77  101.21 
1 1 1 3   2   8  o 4  657.66  123.54 16133.13  4492.77  16133.13 4492.77  0.00      0.00     657.66  123.54 ?       ?      0.00    123.54 
1 1 1 3   2   9  o 12 470.74  77.88  7292.38   2031.19  7292.38  2031.19  0.00      0.00     470.74  77.88  ?       ?      0.00    77.88  
1 1 1 3   2   10 f 0  289.88  44.65  2580.12   719.21   2580.12  719.21   0.00      0.00     289.88  44.65  ?       ?      0.00    44.65  
1 1 1 3   2   11 o 13 469.29  51.10  6875.12   1354.48  6947.82  1915.52  6802.41   1915.53  450.55  76.81  444.77  77.86  5.78    109.37 
1 1 1 3   2   12 f 0  273.81  28.47  2236.77   440.96   2207.79  623.57   2265.75   623.64   266.24  42.21  270.09  41.55  -3.85   59.23  
1 1 1 3   2   13 o 15 207.14  21.39  1267.95   250.68   1285.60  354.48   1250.29   354.55   205.47  31.02  202.39  31.54  3.09    44.24  
1 1 1 3   2   14 o 15 211.04  21.86  1319.67   261.02   1345.44  369.07   1293.87   369.21   209.68  31.64  205.25  32.41  4.43    45.30  
1 1 1 3   2   15 o 7  443.33  50.09  6361.23   1252.42  6059.25  1771.11  6663.27   1771.27  400.32  79.87  426.15  75.15  -25.84  109.67 
1 1 1 3   2   16 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   2   17 o 2  369.03  39.51  4180.21   824.01   4277.23  1165.32  4083.18   1165.33  360.43  58.31  350.71  60.04  9.72    83.69  
1 1 1 3   2   18 o 16 275.76  28.57  2258.50   445.78   2457.32  630.81   2060.14   630.06   283.51  39.86  257.38  44.24  26.13   59.54  
1 1 1 3   2   19 o 2  296.97  46.01  2718.54   758.99   0.00     0.00     2718.54   758.99   ?       ?      296.97  46.01  0.00    46.01  
1 1 1 3   2   20 o 6  204.24  31.05  1252.20   352.60   0.00     0.00     1252.20   352.60   ?       ?      204.24  31.05  0.00    31.05  
1 1 1 3   2   21 o 8  344.02  36.23  3571.10   704.86   3619.65  997.19   3522.63   996.45   337.36  53.25  332.23  54.11  5.14    75.92  
1 1 1 3   2   22 o 1  278.88  29.18  2330.92   460.19   2492.34  651.22   2169.90   650.40   282.78  41.34  261.71  44.91  21.07   61.04  
1 1 1 3   2   23 o 15 291.30  30.98  2557.00   510.10   2489.29  721.25   2624.75   721.52   279.43  46.60  287.93  45.13  -8.50   64.88  
1 1 1 3   2   24 o 18 298.74  48.55  2852.21   804.02   2852.21  804.02   0.00      0.00     298.74  48.55  ?       ?      0.00    48.55  
1 1 1 3   2   25 o 9  102.02  23.94  319.01    137.74   319.01   137.74   0.00      0.00     102.02  23.94  ?       ?      0.00    23.94  
1 1 1 3   2   26 o 16 187.25  20.56  1047.30   217.38   1137.24  312.83   963.33    302.28   191.56  29.38  175.21  31.20  16.35   42.86  
1 1 1 3   2   27 o 11 101.02  16.43  306.94    92.00    310.23   144.46   304.70    119.32   99.37   25.27  99.27   21.56  0.10    33.22  
1 1 1 3   2   28 o 8  112.02  25.70  399.57    161.76   399.57   161.76   0.00      0.00     112.02  25.70  ?       ?      0.00    25.70  
1 1 1 3   2   29 o 6  126.10  18.25  485.87    128.29   390.32   185.04   574.30    178.01   108.41  29.12  134.63  23.91  -26.22  37.68  
1 1 1 3   2   30 o 11 174.52  21.49  951.57    210.74   855.10   301.46   1043.77   294.71   155.75  34.61  176.40  30.19  -20.65  45.93  
1 1 1 3   2   31 o 6  122.08  19.67  469.15    133.15   381.40   192.66   549.38    184.23   104.24  30.36  128.49  25.87  -24.25  39.89  
1 1 1 3   2   32 o 1  85.36   22.17  242.31    109.59   268.86   166.72   222.11    145.41   87.55   28.73  80.88   26.84  6.67    39.31  
1 1 1 3   3   0  o 17 485.49  50.87  7091.27   1396.61  7110.44  1975.09  7072.11   1975.11  473.97  75.09  472.52  75.34  1.44    106.37 
1 1 1 3   3   1  o 11 341.17  35.04  3435.63   676.51   3384.04  956.70   3487.21   956.74   333.36  51.66  338.83  50.75  -5.47   72.42  
1 1 1 3   3   2  o 19 370.18  38.17  4058.60   799.49   4091.42  1130.64  4025.79   1130.67  365.60  55.62  362.39  56.17  3.21    79.05  
1 1 1 3   3   3  o 10 466.94  46.35  6518.17   1226.04  0.52     1733.38  13043.39  1734.38  191.13  83.49  662.19  45.91  -471.05 95.28  
1 1 1 3   3   4  o 17 151.63  14.62  668.18    125.72   -11.93   177.15   1358.23   178.44   63.15   27.14  216.71  14.43  -153.55 30.74  
1 1 1 3   3   5  o 16 270.47  27.64  2146.96   423.13   2149.01  598.37   2144.91   598.43   267.40  40.22  267.13  40.27  0.27    56.92  
1 1 1 3   3   6  o 3  465.62  48.89  6539.69   1287.22  6457.47  1820.36  6621.91   1820.43  449.97  72.97  456.43  71.85  -6.46   102.40 
1 1 1 3   3   7  o 17 103.80  15.50  317.41    89.56    317.41   89.56    0.00      0.00     103.80  15.50  ?       ?      0.00    15.50  
1 1 1 3   3   8  o 4  267.91  40.64  2172.12   605.50   2172.12  605.50   0.00      0.00     267.91  40.64  ?       ?      0.00    40.64  
1 1 1 3   3   9  o 19 263.34  40.10  2105.78   587.09   2105.78  587.09   0.00      0.00     263.34  40.10  ?       ?      0.00    40.10  
1 1 1 3   3   10 o 10 348.17  36.35  3638.62   715.90   3505.81  1012.38  3771.47   1012.50  332.79  54.90  346.72  52.51  -13.93  75.97  
1 1 1 3   3   11 o 9  106.39  11.01  329.60    66.24    323.55   93.46    335.70    93.90    104.54  16.09  106.58  15.83  -2.03   22.57  
1 1 1 3   3   12 o 5  313.83  33.01  2973.45   585.75   2918.94  828.32   3027.97   828.42   302.12  49.47  308.48  48.37  -6.36   69.19  
1 1 1 3   3   13 o 17 404.74  44.43  5154.09   1015.33  5125.13  1435.87  5183.05   1435.93  382.90  67.80  385.58  67.32  -2.68   95.55  
1 1 1 3   3   14 o 18 178.85  18.45  942.53    186.69   931.40   263.90   953.69    264.14   175.23  27.11  177.47  26.76  -2.24   38.09  
1 1 1 3   3   15 o 17 105.83  16.24  332.79    95.54    332.79   95.54    0.00      0.00     105.83  16.24  ?       ?      0.00    16.24  
1 1 1 3   3   16 o 11 174.58  26.63  920.89    258.45   0.00     0.00     920.89    258.45   ?       ?      174.58  26.63  0.00    26.63  
1 1 1 3   3   17 o 6  253.56  26.36  1912.86   378.11   1983.92  534.70   1841.79   534.76   253.76  37.86  243.57  39.60  10.19   54.79  
1 1 1 3   3   18 o 8  395.62  42.12  4776.48   941.84   5020.74  1332.11  4532.33   1331.81  393.72  60.90  370.98  64.90  22.74   89.00  
1 1 1 3   3   19 o 12 94.71   15.71  265.91    82.43    0.00     0.00     265.91    82.43    ?       ?      94.71   15.71  0.00    15.71  
1 1 1 3   3   20 o 4  303.72  47.31  2858.20   798.05   0.00     0.00     2858.20   798.05   ?       ?      303.72  47.31  0.00    47.31  
1 1 1 3   3   21 o 16 302.15  47.84  2872.33   802.16   0.00     0.00     2872.33   802.16   ?       ?      302.15  47.84  0.00    47.84  
1 1 1 3   3   22 o 9  398.59  43.58  4968.37   981.04   4863.22  1387.34  5073.55   1387.48  374.86  66.92  384.71  65.15  -9.84   93.40  
1 1 1 3   3   23 o 17 197.53  21.39  1154.44   238.73   1055.66  336.55   1254.48   338.70   185.13  32.87  203.28  29.92  -18.15  44.45  
1 1 1 3   3   24 o 19 165.53  28.05  832.32    257.00   832.32   257.00   0.00      0.00     165.53  28.05  ?       ?      0.00    28.05  
1 1 1 3   3   25 o 4  237.68  38.64  1781.85   509.13   1781.85  509.13   0.00      0.00     237.68  38.64  ?       ?      0.00    38.64  
1 1 1 3   3   26 o 2  134.45  17.33  538.40    130.64   517.97   184.90   558.76    184.60   129.17  25.84  134.65  24.80  -5.47   35.81  
1 1 1 3   3   27 o 10 93.71   17.12  266.31    88.71    290.88   132.50   246.35    119.44   96.32   24.04  88.85   23.18  7.48    33.39  
1 1 1 3   3   28 o 4  176.22  20.03  942.50    199.05   999.75   286.70   889.22    276.58   176.43  29.34  165.69  30.19  10.74   42.10  
1 1 1 3   3   29 o 3  87.06   26.27  244.70    142.19   244.70   142.19   0.00      0.00     87.06   26.27  ?       ?      0.00    26.27  
1 1 1 3   3   30 o 6  49.85   18.94  57.98     74.83    99.62    132.05   38.27     90.83    64.34   24.98  49.70   20.24  14.65   32.15  
1 1 1 3   3   31 o 18 151.40  19.43  718.16    165.01   646.95   246.85   775.69    221.86   134.02  32.44  152.46  26.30  -18.44  41.76  
1 1 1 3   3   32 o 10 76.22   22.46  193.72    104.96   226.20   156.58   167.21    141.43   81.15   27.85  72.48   26.32  8.67    38.32  
1 1 1 3   3   33 o 10 105.11  21.97  371.11    128.26   254.84   191.95   464.90    172.40   83.74   30.63  114.11  26.78  -30.38  40.68  
1 1 1 3   4   0  o 13 656.91  71.79  13524.65  2663.21  13494.41 3766.34  13554.89  3766.35  624.28  109.06 626.00  108.75 -1.72   154.02 
1 1 1 3   4   1  o 1  131.88  13.41  505.78    100.13   520.55   141.58   491.01    141.64   132.95  19.10  128.93  19.77  4.02    27.49  
1 1 1 3   4   2  o 17 241.21  23.55  1700.49   321.94   -22.87   454.74   3432.22   455.84   100.62  43.36  343.53  23.25  -242.91 49.20  
1 1 1 3   4   3  o 10 5.49    2.33   -0.00     1.28     -0.00    1.28     0.00      0.00     5.49    2.33   ?       ?      0.00    2.33   
1 1 1 3   4   4  o 4  406.96  63.84  5178.67   1442.48  5178.67  1442.48  0.00      0.00     406.96  63.84  ?       ?      0.00    63.84  
1 1 1 3   4   5  o 19 517.66  85.89  8843.83   2463.04  8843.83  2463.04  0.00      0.00     517.66  85.89  ?       ?      0.00    85.89  
1 1 1 3   4   6  o 8  654.61  123.16 16010.08  4458.47  16010.08 4458.47  0.00      0.00     654.61  123.16 ?       ?      0.00    123.16 
1 1 1 3   4   7  o 10 477.30  79.05  7505.06   2090.34  7505.06  2090.34  0.00      0.00     477.30  79.05  ?       ?      0.00    79.05  
1 1 1 3   4   8  o 8  599.03  113.54 13506.56  3761.45  13506.56 3761.45  0.00      0.00     599.03  113.54 ?       ?      0.00    113.54 
1 1 1 3   4   9  o 13 215.94  22.13  1369.45   270.43   1382.18  382.38   1356.72   382.50   214.37  32.06  212.24  32.42  2.13    45.59  
1 1 1 3   4   10 o 3  370.44  39.22  4168.84   821.49   4180.03  1161.73  4157.64   1161.79  359.67  58.26  358.56  58.45  1.11    82.53  
1 1 1 3   4   11 o 1  125.30  12.88  458.09    91.31    455.37   129.07   460.83    129.19   123.81  18.75  124.59  18.64  -0.78   26.43  
1 1 1 3   4   12 o 8  84.97   9.03   210.29    43.36    202.75   60.96    218.02    61.70    82.72   13.29  85.91   12.91  -3.20   18.53  
1 1 1 3   4   13 o 2  119.82  12.39  419.37    84.02    405.41   118.53   433.47    119.12   116.59  18.31  120.78  17.70  -4.19   25.47  
1 1 1 3   4   14 o 10 94.86   10.07  262.41    53.97    269.56   76.18    255.21    76.48    95.40   14.35  92.67   14.88  2.73    20.68  
1 1 1 3   4   15 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   4   16 o 8  402.12  44.07  5076.92   1000.59  5096.61  1415.02  5057.24   1415.09  383.16  66.75  381.33  67.09  1.84    94.64  
1 1 1 3   4   17 o 16 520.25  59.29  8828.77   1739.30  8842.07  2459.70  8815.46   2459.79  483.13  92.05  482.15  92.23  0.98    130.30 
1 1 1 3   4   18 o 12 228.03  23.60  1531.90   304.44   1644.69  431.12   1419.71   429.97   233.61  33.07  215.81  35.97  17.80   48.86  
1 1 1 3   4   19 o 13 276.28  42.58  2339.92   653.70   0.00     0.00     2339.92   653.70   ?       ?      276.28  42.58  0.00    42.58  
1 1 1 3   4   20 o 9  75.54   13.85  169.79    57.86    0.00     0.00     169.79    57.86    ?       ?      75.54   13.85  0.00    13.85  
1 1 1 3   4   21 o 7  215.09  33.12  1408.94   395.83   0.00     0.00     1408.94   395.83   ?       ?      215.09  33.12  0.00    33.12  
1 1 1 3   4   22 o 3  171.87  18.31  869.84    177.86   901.70   250.99   837.71    252.07   172.87  26.11  166.10  27.39  6.77    37.84  
1 1 1 3   4   23 o 11 185.12  20.09  1012.01   210.09   974.37   293.57   1051.53   300.78   178.73  29.65  186.01  29.12  -7.27   41.56  
1 1 1 3   4   24 o 9  136.85  23.78  565.57    180.00   565.57   180.00   0.00      0.00     136.85  23.78  ?       ?      0.00    23.78  
1 1 1 3   4   25 o 10 108.88  23.27  363.35    141.02   363.35   141.02   0.00      0.00     108.88  23.27  ?       ?      0.00    23.27  
1 1 1 3   4   26 o 4  187.52  31.77  1112.73   329.79   1112.73  329.79   0.00      0.00     187.52  31.77  ?       ?      0.00    31.77  
1 1 1 3   4   27 o 11 228.89  25.52  1615.58   329.68   1578.10  466.62   1652.94   465.86   216.89  38.91  223.00  37.74  -6.11   54.20  
1 1 1 3   4   28 o 4  211.58  24.30  1392.31   289.80   1289.74  409.04   1495.68   410.64   193.24  38.23  211.15  35.11  -17.91  51.90  
1 1 1 3   4   29 o 15 207.78  24.57  1369.57   287.39   1245.26  407.72   1492.32   405.15   184.77  39.63  207.27  35.31  -22.50  53.08  
1 1 1 3   4   30 o 2  69.36   25.86  134.60    137.98   134.60   137.98   0.00      0.00     69.36   25.86  ?       ?      0.00    25.86  
1 1 1 3   4   31 o 18 113.22  18.31  403.07    114.94   375.51   184.96   420.40    146.71   102.72  29.69  112.75  23.43  -10.03  37.83  
1 1 1 3   4   32 o 5  54.51   24.04  5.18      146.92   5.18     146.92   0.00      0.00     54.51   24.04  ?       ?      0.00    24.04  
1 1 1 3   5   0  o 19 66.51   10.38  130.26    38.34    130.26   38.34    0.00      0.00     66.51   10.38  ?       ?      0.00    10.38  
1 1 1 3   5   1  o 3  223.67  33.51  1495.83   417.10   1495.83  417.10   0.00      0.00     223.67  33.51  ?       ?      0.00    33.51  
1 1 1 3   5   2  o 14 6.99    2.81   0.62      1.72     0.62     1.72     0.00      0.00     6.99    2.81   ?       ?      0.00    2.81   
1 1 1 3   5   3  o 13 7.47    3.71   -15.44    6.18     -15.44   6.18     0.00      0.00     7.47    3.71   ?       ?      0.00    3.71   
1 1 1 3   5   4  o 9  218.12  32.71  1423.22   396.95   1423.22  396.95   0.00      0.00     218.12  32.71  ?       ?      0.00    32.71  
1 1 1 3   5   5  o 9  294.04  30.23  2554.14   503.05   2517.47  711.38   2590.82   711.45   287.29  44.58  291.80  43.82  -4.51   62.51  
1 1 1 3   5   6  o 1  109.10  11.20  346.19    69.14    337.06   97.58    355.40    97.98    106.82  16.44  109.83  16.01  -3.00   22.95  
1 1 1 3   5   7  o 1  338.53  35.22  3423.97   674.51   3407.58  953.88   3440.36   953.92   330.40  52.01  332.16  51.71  -1.76   73.34  
1 1 1 3   5   8  o 6  41.84   6.02   51.33     14.05    35.57    19.44    68.58     20.33    34.62   9.50   48.26   7.59   -13.64  12.16  
1 1 1 3   5   9  o 8  56.36   6.76   92.62     21.42    98.40    30.45    86.95     30.15    57.71   9.52   54.09   10.08  3.63    13.87  
1 1 1 3   5   10 f 0  115.95  11.91  391.95    78.15    377.23   110.42   406.73    110.61   112.68  17.65  117.24  16.92  -4.56   24.45  
1 1 1 3   5   11 o 17 103.97  10.78  315.08    63.39    308.09   89.41    322.14    89.88    101.90  15.80  104.31  15.48  -2.41   22.11  
1 1 1 3   5   12 o 16 52.17   6.84   79.61     20.00    75.90    27.90    83.54     28.69    50.43   9.99   53.00   9.79   -2.57   13.99  
1 1 1 3   5   13 o 6  467.82  53.95  7239.89   1422.46  6982.99  2011.57  7496.84   2011.75  419.32  86.44  440.33  82.62  -21.01  119.57 
1 1 1 3   5   14 f 0  212.35  32.95  1390.81   388.61   1390.81  388.61   0.00      0.00     212.35  32.95  ?       ?      0.00    32.95  
1 1 1 3   5   15 o 18 187.75  28.78  1071.66   300.36   0.00     0.00     1071.66   300.36   ?       ?      187.75  28.78  0.00    28.78  
1 1 1 3   5   16 o 3  452.60  50.40  6537.52   1287.21  6474.60  1820.30  6600.45   1820.48  423.24  77.79  428.47  76.83  -5.23   109.33 
1 1 1 3   5   17 o 2  639.61  78.00  14179.24  2804.97  15207.10 3966.93  13151.48  3966.73  599.48  119.47 537.52  129.99 61.95   176.55 
1 1 1 3   5   18 o 7  212.13  22.05  1322.65   264.58   1558.71  375.01   1088.69   373.34   228.60  29.25  188.57  35.80  40.02   46.22  
1 1 1 3   5   19 o 1  232.42  35.44  1636.16   457.96   0.00     0.00     1636.16   457.96   ?       ?      232.42  35.44  0.00    35.44  
1 1 1 3   5   20 o 16 285.40  44.63  2531.77   707.33   0.00     0.00     2531.77   707.33   ?       ?      285.40  44.63  0.00    44.63  
1 1 1 3   5   21 o 5  348.11  58.31  4023.52   1124.08  0.00     0.00     4023.52   1124.08  ?       ?      348.11  58.31  0.00    58.31  
1 1 1 3   5   22 o 7  81.53   14.95  198.71    67.41    195.11   96.89    202.09    93.84    80.15   20.86  81.54   20.16  -1.39   29.01  
1 1 1 3   5   23 o 9  209.69  22.38  1303.68   265.24   1307.34  376.49   1300.08   373.74   206.34  32.89  205.82  32.73  0.52    46.40  
1 1 1 3   5   24 o 4  140.97  25.29  603.99    197.12   603.99   197.12   0.00      0.00     140.97  25.29  ?       ?      0.00    25.29  
1 1 1 3   5   25 o 13 198.39  32.54  1232.02   357.71   1232.02  357.71   0.00      0.00     198.39  32.54  ?       ?      0.00    32.54  
1 1 1 3   5   26 o 13 95.70   21.07  283.02    112.63   283.02   112.63   0.00      0.00     95.70   21.07  ?       ?      0.00    21.07  
1 1 1 3   5   27 o 19 56.95   18.56  94.01     69.62    79.51    87.73    118.68    114.43   56.42   20.69  66.31   23.73  -9.90   31.48  
1 1 1 3   5   28 o 6  215.46  24.70  1457.08   300.01   1288.29  421.11   1631.06   427.53   190.19  39.85  219.18  35.17  -28.99  53.15  
1 1 1 3   5   29 o 8  63.28   19.63  123.37    78.69    89.52    101.38   174.69    124.82   59.15   22.14  74.81   24.87  -15.65  33.30  
1 1 1 3   5   30 o 12 40.21   17.65  -10.36    78.26    -32.67   101.53   22.30     122.85   43.43   19.51  53.32   22.75  -9.89   29.97  
1 1 1 3   5   31 o 18 56.04   20.32  88.67     84.23    62.98    110.20   124.76    130.63   55.54   22.41  66.19   25.06  -10.65  33.62  
1 1 1 3   5   32 o 18 84.50   21.22  240.44    102.76   277.92   137.62   193.22    154.48   88.41   25.63  75.38   27.49  13.03   37.59  
1 1 1 3   6   0  o 17 239.98  24.57  1693.21   333.68   1728.62  471.91   1657.81   471.88   239.57  35.38  234.25  36.26  5.32    50.66  
1 1 1 3   6   1  o 2  429.99  46.78  5631.07   1136.19  193.26   1606.22  11076.82  1607.40  185.02  80.61  604.57  46.68  -419.55 93.15  
1 1 1 3   6   2  o 1  305.35  31.76  2766.63   548.63   2.74     775.22   5540.01   776.55   130.10  56.34  433.29  31.43  -303.19 64.52  
1 1 1 3   6   3  o 5  293.15  30.26  2545.44   501.90   2676.84  709.79   2414.04   709.79   296.25  42.99  280.00  45.74  16.25   62.77  
1 1 1 3   6   4  o 6  99.47   10.32  287.77    58.07    340.91   82.18    234.77    82.07    107.90  13.57  88.70   16.73  19.20   21.54  
1 1 1 3   6   5  o 12 473.55  51.06  6944.37   1366.20  6789.49  1932.07  7099.25   1932.14  447.83  77.99  459.98  75.81  -12.15  108.76 
1 1 1 3   6   6  o 13 178.03  18.21  927.76    183.51   939.01   259.50   916.51    259.54   177.30  26.29  175.03  26.67  2.28    37.45  
1 1 1 3   6   7  o 13 143.86  14.76  604.37    120.20   637.61   169.98   571.13    170.00   146.63  20.77  138.32  22.16  8.31    30.37  
1 1 1 3   6   8  o 12 198.49  20.34  1159.06   228.54   1110.62  323.09   1207.56   323.32   191.44  30.42  200.25  28.97  -8.81   42.00  
1 1 1 3   6   9  o 5  170.54  17.46  853.31    168.51   822.83   238.22   883.84    238.39   165.29  25.96  171.74  24.91  -6.44   35.98  
1 1 1 3   6   10 o 10 221.30  22.97  1452.41   287.55   1504.78  406.61   1400.01   406.70   221.70  32.95  213.11  34.42  8.59    47.65  
1 1 1 3   6   11 o 16 339.04  36.52  3539.11   699.68   3655.07  989.48   3423.15   989.52   332.40  53.68  319.73  55.95  12.67   77.54  
1 1 1 3   6   12 o 18 166.20  17.17  812.64    161.47   827.91   228.31   797.36    228.38   165.68  24.76  162.36  25.33  3.32    35.42  
1 1 1 3   6   13 f 0  493.44  58.72  8250.52   1630.61  8516.71  2306.01  7984.32   2306.06  456.33  91.22  435.56  94.92  20.77   131.64 
1 1 1 3   6   14 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   6   15 o 14 499.99  57.76  8246.03   1627.52  8424.54  2301.60  8067.51   2301.71  467.19  89.07  453.54  91.56  13.65   127.74 
1 1 1 3   6   16 o 19 343.69  36.92  3589.03   717.06   4144.49  1014.40  3034.27   1013.75  361.61  50.22  302.22  60.54  59.40   78.66  
1 1 1 3   6   17 o 16 299.86  31.52  2682.61   534.50   2962.07  756.32   2403.77   755.48   310.14  43.69  276.27  49.45  33.88   65.99  
1 1 1 3   6   18 o 1  539.20  100.52 10758.13  2997.14  0.00     0.00     10758.13  2997.14  ?       ?      539.20  100.52 0.00    100.52 
1 1 1 3   6   19 o 9  141.94  21.69  599.18    171.16   0.00     0.00     599.18    171.16   ?       ?      141.94  21.69  0.00    21.69  
1 1 1 3   6   20 o 12 83.51   14.77  207.70    68.21    0.00     0.00     207.70    68.21    ?       ?      83.51   14.77  0.00    14.77  
1 1 1 3   6   21 o 16 337.94  36.46  3512.50   696.10   3643.68  984.82   3381.53   984.04   332.35  53.43  318.04  55.94  14.31   77.35  
1 1 1 3   6   22 o 12 103.58  14.82  317.27    85.59    300.57   127.39   331.02    115.57   99.20   22.84  104.75  19.95  -5.55   30.33  
1 1 1 3   6   23 o 2  341.00  36.81  3578.45   709.27   3465.27  1003.06  3691.62   1003.05  321.90  56.33  334.19  54.14  -12.29  78.13  
1 1 1 3   6   24 o 4  166.39  28.27  849.07    260.36   849.07   260.36   0.00      0.00     166.39  28.27  ?       ?      0.00    28.27  
1 1 1 3   6   25 o 14 170.64  29.26  910.35    276.34   910.35   276.34   0.00      0.00     170.64  29.26  ?       ?      0.00    29.26  
1 1 1 3   6   26 o 8  213.46  36.84  1508.12   435.11   1508.12  435.11   0.00      0.00     213.46  36.84  ?       ?      0.00    36.84  
1 1 1 3   6   27 o 11 261.51  29.88  2192.09   440.54   2063.76  622.06   2321.22   623.98   236.11  47.54  254.47  44.32  -18.36  65.00  
1 1 1 3   6   28 o 14 163.04  19.91  818.64    182.48   812.73   256.62   824.69    259.55   156.35  29.68  157.43  29.81  -1.08   42.06  
1 1 1 3   6   29 f 0  93.73   20.17  280.02    105.28   285.23   147.46   274.61    150.38   92.26   26.47  90.50   26.94  1.76    37.77  
1 1 1 3   6   30 o 14 111.72  19.79  397.96    122.25   342.62   170.02   457.20    175.91   98.86   28.44  115.32  27.04  -16.47  39.24  
1 1 1 3   6   31 o 12 149.65  21.07  727.68    175.97   648.56   247.75   808.24    249.99   130.22  33.08  149.25  30.21  -19.04  44.80  
1 1 1 3   6   32 o 11 151.80  22.27  776.39    188.31   633.47   264.85   922.49    267.78   121.91  35.62  155.46  31.09  -33.55  47.28  
1 1 1 3   7   0  o 13 110.68  11.38  356.74    71.29    377.08   100.77   336.35    100.89   113.07  15.97  106.46  17.09  6.61    23.39  
1 1 1 3   7   1  o 4  118.38  12.68  408.83    84.84    2.18     118.89   830.72    121.10   52.72   22.43  169.24  12.55  -116.52 25.71  
1 1 1 3   7   2  o 8  311.81  33.36  2919.04   587.89   -15.02   830.66   5863.59   832.14   131.63  57.64  443.24  32.94  -311.61 66.39  
1 1 1 3   7   3  o 19 85.17   8.96   211.04    43.16    233.59   60.79    188.12    61.28    89.18   12.19  79.57   13.92  9.61    18.51  
1 1 1 3   7   4  o 13 107.03  11.06  333.62    66.97    351.67   94.63    315.50    94.80    109.18  15.54  103.10  16.58  6.07    22.72  
1 1 1 3   7   5  o 11 442.55  48.46  6140.90   1210.93  6371.41  1712.52  5910.40   1712.50  430.67  71.79  411.19  75.32  19.47   104.06 
1 1 1 3   7   6  o 8  303.38  31.78  2767.59   545.28   2740.60  771.12   2794.57   771.18   294.19  47.26  297.44  46.70  -3.25   66.44  
1 1 1 3   7   7  o 2  391.05  42.44  4749.95   937.48   4875.78  1325.79  4624.11   1325.80  380.10  62.96  368.13  65.12  11.97   90.58  
1 1 1 3   7   8  o 9  180.63  18.55  959.87    189.66   942.49   268.16   977.26    268.28   176.52  27.35  179.99  26.78  -3.47   38.27  
1 1 1 3   7   9  o 14 161.15  24.43  781.42    218.92   781.42   218.92   0.00      0.00     161.15  24.43  ?       ?      0.00    24.43  
1 1 1 3   7   10 o 19 139.87  14.39  572.97    113.92   553.30   160.83   592.77    161.39   135.82  21.33  140.88  20.56  -5.06   29.63  
1 1 1 3   7   11 o 1  275.77  29.01  2294.68   452.41   2279.99  639.73   2309.39   639.88   267.40  43.14  269.35  42.81  -1.95   60.78  
1 1 1 3   7   12 o 13 106.83  11.15  333.10    67.37    328.90   95.02    337.34    95.54    105.18  16.26  106.58  16.12  -1.40   22.90  
1 1 1 3   7   13 o 6  205.64  31.68  1294.92   361.97   1294.92  361.97   0.00      0.00     205.64  31.68  ?       ?      0.00    31.68  
1 1 1 3   7   14 o 4  134.55  20.46  539.96    153.08   0.00     0.00     539.96    153.08   ?       ?      134.55  20.46  0.00    20.46  
1 1 1 3   7   15 f 0  392.71  42.96  4761.34   952.73   5324.17  1347.57  4198.88   1347.14  402.83  60.11  349.73  69.55  53.10   91.93  
1 1 1 3   7   16 o 6  317.46  50.14  3166.97   883.52   0.00     0.00     3166.97   883.52   ?       ?      317.46  50.14  0.00    50.14  
1 1 1 3   7   17 o 4  93.71   15.08  259.93    78.38    0.00     0.00     259.93    78.38    ?       ?      93.71   15.08  0.00    15.08  
1 1 1 3   7   18 o 19 190.86  28.96  1093.30   307.31   0.00     0.00     1093.30   307.31   ?       ?      190.86  28.96  0.00    28.96  
1 1 1 3   7   19 o 11 350.85  57.58  4012.89   1119.46  0.00     0.00     4012.89   1119.46  ?       ?      350.85  57.58  0.00    57.58  
1 1 1 3   7   20 o 14 125.62  14.17  462.64    100.43   469.89   140.10   454.98    144.04   125.32  20.16  123.04  21.16  2.29    29.22  
1 1 1 3   7   21 o 13 159.59  18.22  752.18    163.90   842.30   238.84   671.99    225.32   166.82  25.77  148.12  27.51  18.71   37.70  
1 1 1 3   7   22 o 11 96.03   18.45  277.57    98.03    320.59   146.62   242.80    131.83   102.21  25.16  89.33   24.82  12.87   35.34  
1 1 1 3   7   23 o 11 251.31  41.38  2006.23   576.28   2006.23  576.28   0.00      0.00     251.31  41.38  ?       ?      0.00    41.38  
1 1 1 3   7   24 o 8  287.63  50.12  2815.34   797.53   2815.34  797.53   0.00      0.00     287.63  50.12  ?       ?      0.00    50.12  
1 1 1 3   7   25 o 16 177.44  31.76  1008.09   311.60   1008.09  311.60   0.00      0.00     177.44  31.76  ?       ?      0.00    31.76  
1 1 1 3   7   26 o 13 84.47   25.50  223.32    133.97   223.32   133.97   0.00      0.00     84.47   25.50  ?       ?      0.00    25.50  
1 1 1 3   7   27 o 15 140.43  17.93  599.28    141.27   627.75   205.06   573.57    194.89   139.49  26.58  133.28  26.41  6.21    37.47  
1 1 1 3   7   28 f 0  56.26   19.61  89.76     77.74    74.41    119.52   101.02    102.35   59.41   23.55  61.05   22.36  -1.65   32.47  
1 1 1 3   7   29 o 16 99.20   20.18  315.08    110.98   295.57   157.05   334.53    156.84   92.89   27.51  98.92   26.91  -6.03   38.48  
1 1 1 3   7   30 o 18 96.48   21.21  305.83    114.25   339.63   163.25   273.39    159.96   97.93   27.77  88.17   28.07  9.76    39.48  
1 1 1 3   7   31 o 5  95.37   22.18  308.83    119.11   309.43   171.12   308.28    165.88   91.08   29.04  91.21   28.53  -0.13   40.71  
1 1 1 3   7   32 o 17 113.42  22.50  444.48    141.30   356.97   201.58   529.01    198.11   93.26   31.61  116.80  29.53  -23.53  43.26  
1 1 1 3   8   0  o 19 91.15   38.00  80.14     330.28   222.65   466.83   -62.70    467.35   113.74  46.05  97.77   43.01  15.97   63.01  
1 1 1 3   8   1  o 2  309.30  32.78  2887.87   573.11   2.26     809.61   5786.12   811.39   129.30  56.76  439.06  32.42  -309.75 65.36  
1 1 1 3   8   2  o 9  82.08   8.90   196.26    41.27    237.25   59.09    157.21    57.67    89.93   11.72  72.47   14.37  17.46   18.55  
1 1 1 3   8   3  o 5  110.16  11.55  353.98    71.99    412.90   102.74   297.16    100.89   118.40  15.49  99.57   18.33  18.83   23.99  
1 1 1 3   8   4  o 18 255.88  26.63  1952.87   385.39   2091.47  545.25   1814.51   544.80   260.30  37.58  240.62  40.90  19.68   55.54  
1 1 1 3   8   5  o 14 69.95   8.26   142.78    32.52    164.07   47.39    123.83    44.71    74.55   11.44  64.38   12.55  10.17   16.98  
1 1 1 3   8   6  o 6  252.47  39.68  1993.63   556.21   0.00     0.00     1993.63   556.21   ?       ?      252.47  39.68  0.00    39.68  
1 1 1 3   8   7  o 7  52.29   8.13   80.57     23.62    122.58   37.41    52.73     30.45    64.37   10.48  42.20   12.00  22.17   15.94  
1 1 1 3   8   8  o 8  111.21  11.92  361.37    74.91    427.47   107.36   298.64    104.58   120.31  15.94  99.57   18.99  20.74   24.79  
1 1 1 3   8   9  o 4  318.24  34.11  3097.63   613.39   3261.03  867.58   2934.31   867.35   316.63  49.34  297.70  52.68  18.93   72.17  
1 1 1 3   8   10 o 8  128.34  13.45  481.98    97.62    527.28   138.60   437.39    137.51   133.21  18.63  120.63  20.60  12.57   27.77  
1 1 1 3   8   11 o 15 427.75  47.91  5852.67   1156.24  6045.35  1635.16  5659.98   1635.18  410.34  72.04  393.34  75.16  17.00   104.11 
1 1 1 3   8   12 o 9  395.21  70.05  5494.16   1531.12  0.00     0.00     5494.16   1531.12  ?       ?      395.21  70.05  0.00    70.05  
1 1 1 3   8   13 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   8   14 o 18 98.28   15.43  286.04    84.21    0.00     0.00     286.04    84.21    ?       ?      98.28   15.43  0.00    15.43  
1 1 1 3   8   15 o 19 237.23  36.27  1710.82   478.32   0.00     0.00     1710.82   478.32   ?       ?      237.23  36.27  0.00    36.27  
1 1 1 3   8   16 o 16 168.16  25.42  843.61    237.78   0.00     0.00     843.61    237.78   ?       ?      168.16  25.42  0.00    25.42  
1 1 1 3   8   17 o 11 226.56  34.59  1555.65   435.61   0.00     0.00     1555.65   435.61   ?       ?      226.56  34.59  0.00    34.59  
1 1 1 3   8   18 o 16 346.07  37.62  3644.23   735.31   4166.25  1040.32  3123.07   1039.46  361.85  51.54  306.42  61.24  55.43   80.04  
1 1 1 3   8   19 o 4  75.49   11.65  168.33    48.85    235.12   77.46    124.23    62.94    88.73   15.79  64.23   16.86  24.51   23.10  
1 1 1 3   8   20 o 11 140.05  16.49  578.19    130.05   553.13   181.63   604.54    186.29   134.93  24.34  141.36  23.80  -6.43   34.05  
1 1 1 3   8   21 o 17 195.68  21.15  1134.72   233.83   1113.87  328.80   1156.05   332.60   190.49  31.14  194.24  30.86  -3.76   43.84  
1 1 1 3   8   22 o 12 121.35  23.59  448.08    158.42   448.08   158.42   0.00      0.00     121.35  23.59  ?       ?      0.00    23.59  
1 1 1 3   8   23 o 10 182.14  29.81  1025.96   300.90   1025.96  300.90   0.00      0.00     182.14  29.81  ?       ?      0.00    29.81  
1 1 1 3   8   24 o 6  241.71  41.27  1948.48   552.08   1948.48  552.08   0.00      0.00     241.71  41.27  ?       ?      0.00    41.27  
1 1 1 3   8   25 o 3  239.23  42.62  1986.27   563.89   1986.27  563.89   0.00      0.00     239.23  42.62  ?       ?      0.00    42.62  
1 1 1 3   8   26 o 12 61.83   20.66  111.28    86.14    142.49   128.93   86.12     115.77   70.97   25.21  61.23   23.49  9.74    34.46  
1 1 1 3   8   27 o 13 145.17  30.78  715.29    248.55   715.29   248.55   0.00      0.00     145.17  30.78  ?       ?      0.00    30.78  
1 1 1 3   8   28 o 13 84.55   21.93  232.83    107.34   197.53   171.88   255.39    137.45   79.55   29.00  87.41   25.69  -7.85   38.74  
1 1 1 3   8   29 o 19 104.10  20.61  350.92    118.81   335.56   195.00   359.99    149.84   96.24   31.03  102.58  25.54  -6.34   40.19  
1 1 1 3   8   30 o 13 95.34   22.08  305.69    118.44   359.04   192.51   273.21    150.23   97.52   30.77  87.45   27.12  10.06   41.01  
1 1 1 3   8   31 o 1  113.66  22.26  442.40    140.03   517.11   224.42   394.76    179.20   112.06  32.80  101.01  29.24  11.05   43.94  
1 1 1 3   9   0  o 11 202.28  30.93  1243.82   347.79   0.00     0.00     1243.82   347.79   ?       ?      202.28  30.93  0.00    30.93  
1 1 1 3   9   1  o 3  421.40  76.34  6384.47   1778.77  0.00     0.00     6384.47   1778.77  ?       ?      421.40  76.34  0.00    76.34  
1 1 1 3   9   2  o 14 213.99  32.92  1400.79   391.41   0.00     0.00     1400.79   391.41   ?       ?      213.99  32.92  0.00    32.92  
1 1 1 3   9   3  o 9  114.92  17.47  392.32    111.62   0.00     0.00     392.32    111.62   ?       ?      114.92  17.47  0.00    17.47  
1 1 1 3   9   4  o 11 111.35  17.01  368.27    105.31   0.00     0.00     368.27    105.31   ?       ?      111.35  17.01  0.00    17.01  
1 1 1 3   9   5  o 2  166.07  25.24  830.62    233.06   0.00     0.00     830.62    233.06   ?       ?      166.07  25.24  0.00    25.24  
1 1 1 3   9   6  o 17 330.30  55.02  3610.91   1006.58  0.00     0.00     3610.91   1006.58  ?       ?      330.30  55.02  0.00    55.02  
1 1 1 3   9   7  o 10 256.66  40.47  2065.83   576.60   0.00     0.00     2065.83   576.60   ?       ?      256.66  40.47  0.00    40.47  
1 1 1 3   9   8  o 10 129.15  19.58  497.14    140.63   0.00     0.00     497.14    140.63   ?       ?      129.15  19.58  0.00    19.58  
1 1 1 3   9   9  o 8  347.93  58.41  4037.14   1125.35  0.00     0.00     4037.14   1125.35  ?       ?      347.93  58.41  0.00    58.41  
1 1 1 3   9   10 o 16 284.55  45.24  2559.81   714.24   0.00     0.00     2559.81   714.24   ?       ?      284.55  45.24  0.00    45.24  
1 1 1 3   9   11 o 1  457.82  84.54  7681.28   2140.06  0.00     0.00     7681.28   2140.06  ?       ?      457.82  84.54  0.00    84.54  
1 1 1 3   9   12 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   9   13 o 5  208.72  31.71  1313.52   368.04   0.00     0.00     1313.52   368.04   ?       ?      208.72  31.71  0.00    31.71  
1 1 1 3   9   14 o 5  207.51  21.56  1264.69   253.08   1365.18  358.09   1164.39   357.73   213.52  30.04  196.06  32.95  17.45   44.59  
1 1 1 3   9   15 o 14 460.74  50.60  6586.30   1316.44  7355.69  1861.86  5817.13   1861.60  471.20  71.04  409.16  82.11  62.04   108.58 
1 1 1 3   9   16 f 0  281.86  29.68  2364.68   472.97   2592.51  669.18   2137.26   668.57   290.70  41.26  261.35  46.25  29.35   61.98  
1 1 1 3   9   17 o 9  237.49  24.55  1671.55   329.93   1589.11  465.78   1754.56   467.40   227.10  37.00  239.67  35.00  -12.57  50.93  
1 1 1 3   9   18 o 15 241.06  25.28  1733.14   344.67   1744.74  487.14   1721.51   487.73   237.01  37.01  235.24  37.37  1.78    52.59  
1 1 1 3   9   19 o 12 195.74  20.63  1134.85   228.34   1031.82  319.31   1242.67   326.67   182.83  31.56  202.05  28.99  -19.22  42.86  
1 1 1 3   9   20 o 6  175.43  28.70  939.19    279.09   939.19   279.09   0.00      0.00     175.43  28.70  ?       ?      0.00    28.70  
1 1 1 3   9   21 o 8  152.77  26.64  711.28    225.16   711.28   225.16   0.00      0.00     152.77  26.64  ?       ?      0.00    26.64  
1 1 1 3   9   22 o 4  210.77  34.58  1393.47   403.87   1393.47  403.87   0.00      0.00     210.77  34.58  ?       ?      0.00    34.58  
1 1 1 3   9   23 o 15 327.53  63.81  4130.75   1156.54  4130.75  1156.54  0.00      0.00     327.53  63.81  ?       ?      0.00    63.81  
1 1 1 3   9   24 o 12 129.96  17.48  508.15    127.10   497.82   174.63   519.79    185.34   125.77  25.07  128.16  26.08  -2.39   36.17  
1 1 1 3   9   25 o 10 214.27  24.26  1427.58   293.21   1407.40  413.74   1447.95   415.58   203.24  36.82  206.59  36.37  -3.35   51.75  
1 1 1 3   9   26 o 13 58.22   20.11  96.47     81.68    83.48    105.26   116.12    129.49   58.97   22.45  66.68   25.01  -7.70   33.61  
1 1 1 3   9   27 o 18 95.62   18.66  287.87    98.77    272.00   131.84   308.18    149.13   90.55   24.69  95.70   26.32  -5.15   36.09  
1 1 1 3   9   28 o 6  66.24   20.98  139.41    89.44    134.35   115.25   147.06    141.84   66.70   23.82  70.43   26.23  -3.74   35.43  
1 1 1 3   9   29 o 13 100.59  19.56  328.16    108.87   293.67   147.42   369.55    161.47   91.16   26.56  101.92  27.12  -10.75  37.96  
1 1 1 3   9   30 o 16 74.27   21.99  188.92    100.40   339.52   132.89   -11.39    153.26   98.47   23.78  53.27   23.95  45.20   33.75  
1 1 1 3   9   31 f 0  64.17   21.66  139.74    94.67    167.64   139.84   116.13    128.62   69.41   26.00  62.12   24.49  7.29    35.72  
1 1 1 3   10  0  o 18 12.91   4.99   3.03      5.26     3.03     5.26     0.00      0.00     12.91   4.99   ?       ?      0.00    4.99   
1 1 1 3   10  1  o 13 349.73  28.14  3624.12   560.29   3182.22  966.88   3847.53   687.48   313.84  55.71  357.97  33.86  -44.13  65.19  
1 1 1 3   10  2  o 5  465.31  57.56  6989.37   1504.73  0.00     0.00     6989.37   1504.73  ?       ?      465.31  57.56  0.00    57.56  
1 1 1 3   10  3  o 16 343.51  36.32  3578.18   705.35   3500.59  997.39   3655.80   997.64   329.19  54.70  337.48  53.26  -8.29   76.34  
1 1 1 3   10  4  f 0  419.57  45.52  5476.20   1078.76  5350.00  1525.52  5602.43   1525.69  395.46  69.75  406.65  67.74  -11.19  97.23  
1 1 1 3   10  5  o 16 248.59  38.60  1905.04   532.95   0.00     0.00     1905.04   532.95   ?       ?      248.59  38.60  0.00    38.60  
1 1 1 3   10  6  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   10  7  o 14 403.73  43.40  5029.12   990.15   4867.66  1400.10  5190.67   1400.48  380.38  66.54  395.19  63.91  -14.81  92.26  
1 1 1 3   10  8  o 2  133.35  14.24  519.57    107.29   471.55   150.38   569.36    153.12   125.49  21.66  138.60  19.81  -13.11  29.35  
1 1 1 3   10  9  o 19 386.03  40.91  4542.01   892.78   4311.75  1262.38  4772.41   1262.80  362.38  62.97  384.34  59.13  -21.96  86.37  
1 1 1 3   10  10 o 3  417.81  69.99  5808.70   1619.30  0.00     0.00     5808.70   1619.30  ?       ?      417.81  69.99  0.00    69.99  
1 1 1 3   10  11 o 6  357.86  37.49  3853.10   758.73   3781.69  1072.73  3924.58   1073.27  345.17  56.06  352.45  54.83  -7.28   78.41  
1 1 1 3   10  12 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   10  13 o 14 286.41  29.65  2433.94   480.52   2397.65  679.32   2470.27   679.80   279.06  43.85  283.65  43.10  -4.58   61.49  
1 1 1 3   10  14 o 17 529.50  58.28  8905.79   1742.32  8336.24  2463.63  9475.70   2464.41  479.11  92.93  519.58  85.60  -40.46  126.34 
1 1 1 3   10  15 o 8  151.98  16.09  675.98    138.21   632.04   192.63   722.60    198.42   145.20  23.94  155.74  22.87  -10.54  33.11  
1 1 1 3   10  16 f 0  353.28  59.31  4158.83   1160.17  4158.83  1160.17  0.00      0.00     353.28  59.31  ?       ?      0.00    59.31  
1 1 1 3   10  17 o 13 398.43  73.16  5780.51   1611.70  5780.51  1611.70  0.00      0.00     398.43  73.16  ?       ?      0.00    73.16  
1 1 1 3   10  18 o 14 139.15  22.45  582.98    173.24   582.98   173.24   0.00      0.00     139.15  22.45  ?       ?      0.00    22.45  
1 1 1 3   10  19 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   10  20 o 10 261.67  42.99  2187.05   623.44   2187.05  623.44   0.00      0.00     261.67  42.99  ?       ?      0.00    42.99  
1 1 1 3   10  21 o 1  150.54  26.13  694.68    217.60   694.68   217.60   0.00      0.00     150.54  26.13  ?       ?      0.00    26.13  
1 1 1 3   10  22 o 15 230.06  25.02  1612.48   325.11   1535.67  456.77   1691.35   462.83   216.63  38.12  228.69  36.48  -12.06  52.76  
1 1 1 3   10  23 o 17 394.85  50.46  5679.95   1117.68  5543.89  1579.82  5816.28   1581.44  331.71  83.14  344.78  81.24  -13.08  116.24 
1 1 1 3   10  24 o 14 51.58   19.55  60.32     79.60    85.38    108.00   30.53     117.78   60.11   22.78  54.45   22.70  5.66    32.16  
1 1 1 3   10  25 o 10 180.85  20.77  1010.36   211.76   848.54   294.64   1183.25   304.55   156.91  33.71  190.11  28.81  -33.20  44.35  
1 1 1 3   10  26 o 14 188.73  22.44  1130.16   238.36   1053.20  333.54   1210.49   340.76   171.02  35.15  185.70  33.18  -14.68  48.34  
1 1 1 3   10  27 o 1  132.02  19.25  549.77    141.58   472.59   193.56   638.59    207.64   115.78  29.15  136.60  27.43  -20.82  40.03  
1 1 1 3   10  28 o 3  120.99  19.66  470.85    131.85   412.61   176.99   543.48    197.64   107.09  28.35  123.31  28.49  -16.22  40.19  
1 1 1 3   10  29 o 18 138.67  20.80  634.57    160.49   653.69   222.85   613.97    231.31   131.72  30.13  125.29  32.04  6.43    43.98  
1 1 1 3   10  30 o 11 48.01   20.64  25.06     102.56   14.29    139.39   37.78     151.46   52.56   23.29  56.18   24.61  -3.62   33.88  
1 1 1 3   11  0  o 14 358.15  21.34  3730.00   436.74   777.58   747.31   5261.40   538.21   168.23  60.59  425.39  22.12  -257.16 64.50  
1 1 1 3   11  1  o 13 217.86  18.11  1381.49   224.44   1364.52  375.97   1390.89   279.76   213.54  31.62  217.76  22.71  -4.21   38.94  
1 1 1 3   11  2  o 2  233.47  19.54  1589.06   259.52   1013.75  345.96   2329.42   392.46   182.73  34.24  281.92  24.49  -99.19  42.10  
1 1 1 3   11  3  f 0  211.12  22.46  1308.74   268.07   1267.23  360.88   1359.85   400.43   205.48  31.60  212.33  34.00  -6.85   46.42  
1 1 1 3   11  4  o 18 398.07  64.29  5089.84   1418.98  5089.84  1418.98  0.00      0.00     398.07  64.29  ?       ?      0.00    64.29  
1 1 1 3   11  5  o 14 272.35  41.82  2263.93   633.05   2263.93  633.05   0.00      0.00     272.35  41.82  ?       ?      0.00    41.82  
1 1 1 3   11  6  o 2  524.58  93.06  9690.70   2699.75  9690.70  2699.75  0.00      0.00     524.58  93.06  ?       ?      0.00    93.06  
1 1 1 3   11  7  o 14 595.72  114.89 13594.10  3786.61  13594.10 3786.61  0.00      0.00     595.72  114.89 ?       ?      0.00    114.89 
1 1 1 3   11  8  o 1  378.33  60.51  4553.96   1269.88  4553.96  1269.88  0.00      0.00     378.33  60.51  ?       ?      0.00    60.51  
1 1 1 3   11  9  o 16 239.99  36.61  1741.71   488.47   1741.71  488.47   0.00      0.00     239.99  36.61  ?       ?      0.00    36.61  
1 1 1 3   11  10 o 1  440.16  73.28  6409.21   1786.47  6409.21  1786.47  0.00      0.00     440.16  73.28  ?       ?      0.00    73.28  
1 1 1 3   11  11 o 6  369.81  59.36  4364.80   1217.46  4364.80  1217.46  0.00      0.00     369.81  59.36  ?       ?      0.00    59.36  
1 1 1 3   11  12 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   11  13 o 7  321.24  51.46  3282.54   916.90   3282.54  916.90   0.00      0.00     321.24  51.46  ?       ?      0.00    51.46  
1 1 1 3   11  14 o 13 528.72  118.25 12560.54  3499.17  12560.54 3499.17  0.00      0.00     528.72  118.25 ?       ?      0.00    118.25 
1 1 1 3   11  15 o 7  162.42  25.50  796.51    229.92   796.51   229.92   0.00      0.00     162.42  25.50  ?       ?      0.00    25.50  
1 1 1 3   11  16 o 13 407.53  76.61  6190.12   1726.45  6190.12  1726.45  0.00      0.00     407.53  76.61  ?       ?      0.00    76.61  
1 1 1 3   11  17 o 14 185.50  29.06  1048.69   299.34   1048.69  299.34   0.00      0.00     185.50  29.06  ?       ?      0.00    29.06  
1 1 1 3   11  18 o 6  491.51  56.06  8022.43   1553.64  7126.36  2195.24  8921.66   2199.12  414.68  94.35  484.41  82.00  -69.73  125.00 
1 1 1 3   11  19 o 13 234.39  25.17  1645.84   333.40   1510.46  466.77   1786.86   476.38   218.47  38.63  239.53  35.74  -21.06  52.62  
1 1 1 3   11  20 o 8  294.44  31.97  2682.11   531.68   2545.90  748.76   2820.63   755.08   273.90  49.44  290.81  46.82  -16.91  68.09  
1 1 1 3   11  21 o 8  302.86  33.53  2913.33   573.24   2670.00  808.25   3159.63   813.15   270.59  53.93  300.58  48.80  -29.99  72.73  
1 1 1 3   11  22 o 11 217.09  24.40  1452.83   298.80   1431.86  420.53   1474.22   424.64   207.05  36.73  210.33  36.49  -3.28   51.77  
1 1 1 3   11  23 o 7  140.49  18.38  599.11    144.72   554.45   201.80   646.40    207.64   130.81  27.73  142.21  26.41  -11.40  38.29  
1 1 1 3   11  24 o 5  175.79  20.55  954.40    203.44   834.91   285.95   1076.86   289.49   156.06  32.95  181.11  28.81  -25.05  43.77  
1 1 1 3   11  25 o 17 86.07   20.12  236.94    97.62    280.98   128.72   177.32    149.77   92.32   24.05  76.01   27.15  16.31   36.27  
1 1 1 3   11  26 o 5  117.03  19.03  432.94    123.47   374.75   165.43   506.11    185.52   103.98  27.35  121.30  27.30  -17.32  38.65  
1 1 1 3   11  27 o 11 137.26  19.71  603.68    150.82   544.17   204.31   674.95    223.58   122.62  29.40  137.19  29.28  -14.57  41.50  
1 1 1 3   11  28 o 12 86.56   22.17  256.26    110.66   260.23   144.97   250.73    171.31   84.84   26.69  82.74   29.09  2.10    39.48  
1 1 1 3   11  29 o 11 73.05   23.10  188.90    108.48   185.23   140.53   194.32    170.64   72.08   26.23  73.69   28.45  -1.61   38.70  
1 1 1 3   11  30 o 3  115.69  22.09  470.91    141.37   316.64   188.76   667.99    213.35   86.33   30.52  129.38  29.39  -43.05  42.37  
1 1 1 3   12  0  o 4  224.46  18.26  1465.37   233.29   1354.09  383.22   1530.89   294.06   212.68  32.41  228.66  22.70  -15.98  39.57  
1 1 1 3   12  1  o 11 425.49  33.78  5348.36   818.29   4968.26  1408.03  5542.21   1005.54  395.94  64.14  430.25  41.21  -34.31  76.24  
1 1 1 3   12  2  o 11 351.48  36.64  3680.54   728.43   3809.97  1030.11  3551.08   1030.21  351.14  52.73  337.75  55.03  13.40   76.21  
1 1 1 3   12  3  o 2  304.43  26.47  2719.04   457.95   2832.33  779.64   2659.35   565.85   304.41  46.05  299.10  33.53  5.30    56.97  
1 1 1 3   12  4  o 16 612.71  52.80  11498.14  1839.07  11041.34 3181.36  11727.40  2253.80  554.66  103.73 608.82  65.52  -54.16  122.68 
1 1 1 3   12  5  o 2  503.41  54.34  7827.22   1545.44  8066.03  2185.56  7588.41   2185.61  492.04  80.13  474.44  83.28  17.60   115.57 
1 1 1 3   12  6  o 14 460.60  49.15  6492.69   1279.52  6467.76  1809.32  6517.63   1809.72  443.62  73.63  445.61  73.29  -1.98   103.89 
1 1 1 3   12  7  o 3  629.62  71.78  12921.02  2548.27  13136.33 3603.71  12705.69  3603.88  590.88  110.30 577.85  112.69 13.02   157.68 
1 1 1 3   12  8  o 2  282.13  29.31  2359.64   467.76   2389.75  661.23   2329.48   661.80   279.23  42.60  275.34  43.30  3.89    60.74  
1 1 1 3   12  9  o 6  409.89  43.58  5133.87   1009.79  4961.10  1427.73  5306.79   1428.38  388.18  66.46  403.71  63.75  -15.53  92.09  
1 1 1 3   12  10 o 10 599.15  70.18  12045.85  2368.06  11737.80 3348.78  12353.97  3349.10  535.32  112.55 555.06  109.00 -19.75  156.68 
1 1 1 3   12  11 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   12  12 o 5  192.34  20.17  1090.80   219.42   1028.61  308.96   1154.10   311.68   183.70  30.36  195.40  28.64  -11.70  41.73  
1 1 1 3   12  13 o 19 144.04  16.16  609.78    131.31   638.30   183.83   580.07    187.63   145.84  22.70  138.40  24.51  7.44    33.41  
1 1 1 3   12  14 o 16 104.40  14.10  321.28    82.37    285.50   114.86   359.16    118.19   96.91   21.23  109.33  19.55  -12.42  28.86  
1 1 1 3   12  15 o 9  310.54  32.82  2929.91   576.32   2778.47  814.56   3081.71   815.51   291.95  50.42  309.85  47.35  -17.91  69.17  
1 1 1 3   12  16 o 11 206.78  22.19  1268.17   259.25   1275.08  365.68   1261.19   367.60   203.83  32.33  202.53  32.73  1.29    46.01  
1 1 1 3   12  17 o 7  310.65  33.09  2946.44   580.96   2786.75  820.40   3107.07   822.82   290.73  51.02  309.62  47.83  -18.88  69.93  
1 1 1 3   12  18 o 4  249.29  26.98  1879.42   379.93   1863.76  534.18   1895.44   540.46   241.31  39.96  243.32  40.09  -2.00   56.60  
1 1 1 3   12  19 o 9  185.33  20.85  1029.71   218.00   933.51   301.24   1135.49   315.87   171.73  31.72  190.76  29.82  -19.03  43.54  
1 1 1 3   12  20 o 16 320.46  35.79  3330.71   647.25   2909.39  912.05   3758.20   918.69   272.92  59.86  322.57  51.33  -49.65  78.86  
1 1 1 3   12  21 o 10 242.92  27.02  1848.06   370.48   1721.87  519.86   1978.28   528.10   221.79  42.38  240.74  39.59  -18.96  57.99  
1 1 1 3   12  22 o 3  144.11  19.11  633.89    154.21   664.75   206.87   595.30    231.37   144.25  25.93  133.71  30.78  10.55   40.25  
1 1 1 3   12  23 o 1  114.58  19.02  407.32    120.74   357.02   155.39   483.95    191.79   104.09  26.07  120.34  28.25  -16.25  38.44  
1 1 1 3   12  24 o 16 89.12   20.15  254.32    100.67   267.46   140.15   240.31    144.71   89.41   25.85  85.00   26.66  4.41    37.13  
1 1 1 3   12  25 o 1  91.57   20.55  272.26    105.35   261.58   144.60   284.34    153.79   87.42   26.51  90.67   27.31  -3.25   38.06  
1 1 1 3   12  26 o 10 160.85  21.30  840.73    191.89   776.44   266.42   910.03    276.60   143.21  33.07  157.00  31.78  -13.80  45.87  
1 1 1 3   12  27 f 0  59.82   22.26  105.95    102.13   159.04   136.01   37.29     154.66   69.78   25.74  57.77   25.09  12.01   35.94  
1 1 1 3   12  28 o 5  110.24  30.06  485.14    195.46   485.14   195.46   0.00      0.00     110.24  30.06  ?       ?      0.00    30.06  
1 1 1 3   12  29 o 7  103.25  23.11  384.72    133.55   338.94   177.77   444.03    202.34   89.98   29.67  101.16  31.49  -11.18  43.26  
1 1 1 3   13  0  o 4  209.96  21.27  1294.78   252.79   1546.54  400.48   1128.03   325.93   226.80  31.62  193.49  30.34  33.32   43.82  
1 1 1 3   13  1  o 3  309.07  32.43  2854.96   566.77   2928.48  800.95   2781.23   802.11   306.73  46.98  298.01  48.56  8.72    67.56  
1 1 1 3   13  2  o 5  221.85  26.53  1461.44   331.21   1511.80  422.55   1381.20   533.39   223.40  34.02  209.34  45.67  14.06   56.95  
1 1 1 3   13  3  o 9  416.69  44.66  5332.16   1051.67  5316.60  1487.12  5347.74   1487.47  400.73  67.01  402.10  66.78  -1.37   94.60  
1 1 1 3   13  4  o 2  721.22  97.84  19414.92  3946.52  0.00     0.00     19414.92  3946.52  ?       ?      721.22  97.84  0.00    97.84  
1 1 1 3   13  5  o 10 124.39  14.49  453.05    101.57   485.44   143.12   420.20    144.16   127.71  20.19  118.24  22.05  9.47    29.90  
1 1 1 3   13  6  o 4  178.29  18.18  931.88    183.44   1074.74  289.15   835.65    237.32   189.30  27.40  167.00  25.57  22.31   37.48  
1 1 1 3   13  7  o 11 349.75  37.06  3719.00   732.86   3615.01  1035.97  3823.17   1036.86  333.42  56.12  344.33  54.25  -10.91  78.05  
1 1 1 3   13  8  o 3  235.71  24.74  1648.45   329.73   1677.00  465.42   1619.68   467.19   233.77  35.82  229.30  36.73  4.48    51.31  
1 1 1 3   13  9  o 4  407.53  44.55  5192.59   1025.21  5209.38  1449.59  5175.79   1450.14  389.18  67.32  387.61  67.63  1.57    95.42  
1 1 1 3   13  10 o 18 311.19  50.83  3132.31   876.72   3132.31  876.72   0.00      0.00     311.19  50.83  ?       ?      0.00    50.83  
1 1 1 3   13  11 o 11 454.26  87.97  7928.60   2211.15  0.00     0.00     7928.60   2211.15  ?       ?      454.26  87.97  0.00    87.97  
1 1 1 3   13  12 o 9  481.95  54.76  7559.88   1488.34  7448.84  2104.33  7671.03   2105.34  443.39  85.78  452.09  84.22  -8.70   120.21 
1 1 1 3   13  13 o 5  204.19  22.04  1234.44   254.22   1213.27  357.97   1255.98   361.09   199.00  32.45  202.68  32.10  -3.67   45.65  
1 1 1 3   13  14 o 8  145.79  18.00  627.75    147.45   694.23   204.84   556.24    212.43   151.80  24.33  134.48  28.41  17.32   37.40  
1 1 1 3   13  15 o 17 262.61  27.65  2073.24   410.54   1939.77  579.47   2207.75   581.72   246.70  42.45  265.25  39.40  -18.55  57.91  
1 1 1 3   13  16 o 8  188.89  20.38  1060.38   217.54   1044.78  306.78   1076.15   308.53   183.94  30.09  186.87  29.76  -2.94   42.32  
1 1 1 3   13  17 o 19 426.90  50.15  6222.68   1205.52  5555.41  1702.39  6893.85   1707.35  353.03  85.02  413.07  74.75  -60.04  113.21 
1 1 1 3   13  18 o 10 312.65  35.40  3142.68   624.11   3074.46  880.21   3211.66   885.08   288.88  55.09  296.73  53.94  -7.85   77.10  
1 1 1 3   13  19 o 12 215.26  24.19  1425.08   293.73   1421.38  410.74   1428.94   420.21   207.24  35.82  207.16  36.68  0.09    51.27  
1 1 1 3   13  20 f 0  246.48  27.59  1919.89   383.76   1755.59  537.34   2090.95   548.27   221.13  43.88  245.55  40.29  -24.43  59.57  
1 1 1 3   13  21 o 14 215.83  24.54  1465.30   298.61   1349.44  416.30   1588.08   428.57   195.34  38.49  214.71  36.05  -19.37  52.74  
1 1 1 3   13  22 o 1  45.30   19.27  10.40     87.70    40.94    107.16   -51.58    152.64   53.12   21.85  52.46   23.72  0.66    32.25  
1 1 1 3   13  23 o 9  101.68  20.02  329.74    112.68   314.66   142.56   354.85    183.94   96.75   25.36  100.64  29.76  -3.89   39.10  
1 1 1 3   13  24 o 2  54.77   21.19  72.57     94.78    56.84    113.16   109.54    173.50   55.29   22.56  68.55   27.95  -13.26  35.92  
1 1 1 3   13  25 o 4  142.19  20.00  651.78    158.72   504.11   211.16   843.56    240.64   115.78  31.11  154.37  28.19  -38.59  41.98  
1 1 1 3   13  26 o 10 68.25   22.11  156.48    98.94    148.79   125.71   168.99    160.39   67.68   24.78  71.90   27.63  -4.22   37.12  
1 1 1 3   13  27 o 16 133.19  21.27  604.68    157.16   493.80   207.96   752.34    239.99   109.12  31.47  136.88  31.23  -27.76  44.34  
1 1 1 3   13  28 o 19 113.55  34.33  594.19    242.74   0.00     0.00     594.19    242.74   ?       ?      113.55  34.33  0.00    34.33  
1 1 1 3   14  0  o 18 156.10  26.83  732.54    231.74   0.00     0.00     732.54    231.74   ?       ?      156.10  26.83  0.00    26.83  
1 1 1 3   14  1  o 8  180.64  29.21  982.41    292.55   0.00     0.00     982.41    292.55   ?       ?      180.64  29.21  0.00    29.21  
1 1 1 3   14  2  o 11 425.56  72.52  6118.57   1708.12  0.00     0.00     6118.57   1708.12  ?       ?      425.56  72.52  0.00    72.52  
1 1 1 3   14  3  o 1  541.18  67.53  9695.92   2052.35  0.00     0.00     9695.92   2052.35  ?       ?      541.18  67.53  0.00    67.53  
1 1 1 3   14  4  o 15 244.78  24.19  1768.69   335.49   1967.45  531.27   1636.86   432.67   253.67  37.62  232.52  33.37  21.14   50.29  
1 1 1 3   14  5  o 17 509.39  52.19  8187.10   1504.48  10117.47 2588.53  7202.35   1848.82  525.99  88.89  459.33  72.52  66.66   114.72 
1 1 1 3   14  6  o 7  294.64  28.84  2585.17   481.57   2868.22  791.78   2419.00   606.68   301.98  47.22  280.98  38.63  21.00   61.01  
1 1 1 3   14  7  o 18 526.57  80.88  9863.11   2366.85  12501.45 3328.57  7164.75   3366.22  553.53  108.63 376.21  129.14 177.32  168.75 
1 1 1 3   14  8  o 8  215.63  23.00  1374.44   280.26   1318.28  394.99   1431.38   397.73   207.53  34.36  216.93  32.97  -9.40   47.62  
1 1 1 3   14  9  o 3  195.79  21.77  1132.75   240.52   1269.46  340.99   997.37    339.32   205.00  29.85  179.90  34.10  25.09   45.32  
1 1 1 3   14  10 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   14  11 o 7  182.55  20.22  984.08    208.31   974.85   293.45   993.46    295.76   178.93  29.60  180.69  29.53  -1.76   41.81  
1 1 1 3   14  12 f 0  223.47  23.56  1485.01   297.64   1364.03  419.32   1607.87   422.56   209.26  36.22  228.96  33.11  -19.69  49.07  
1 1 1 3   14  13 o 16 179.93  19.65  959.21    199.69   880.74   279.56   1040.96   285.34   168.95  29.92  184.84  27.75  -15.89  40.81  
1 1 1 3   14  14 o 19 204.17  22.00  1246.36   253.82   1199.55  356.34   1294.58   361.62   195.64  32.89  203.86  31.95  -8.22   45.86  
1 1 1 3   14  15 o 9  89.79   16.02  242.64    79.56    213.15   104.31   283.64    123.00   83.17   21.64  95.71   22.73  -12.54  31.38  
1 1 1 3   14  16 o 4  226.47  24.53  1566.27   313.89   1491.34  440.83   1643.34   447.04   212.93  37.43  224.87  35.83  -11.94  51.82  
1 1 1 3   14  17 o 9  303.82  34.47  2991.53   590.62   2816.54  833.08   3168.36   837.45   272.19  55.21  293.72  51.54  -21.53  75.53  
1 1 1 3   14  18 o 13 177.86  21.33  966.95    213.45   1025.82  296.43   903.56    307.61   178.28  30.03  164.81  33.65  13.46   45.10  
1 1 1 3   14  19 o 1  70.51   21.72  153.25    96.57    198.31   127.84   93.38     147.36   79.59   25.07  66.30   26.20  13.28   36.26  
1 1 1 3   14  20 o 13 88.78   21.15  251.11    106.23   150.97   139.01   391.64    164.68   72.34   26.12  108.86  26.59  -36.52  37.27  
1 1 1 3   14  21 o 15 115.28  18.91  415.54    120.80   398.22   157.51   440.28    188.26   109.39  25.55  113.19  28.88  -3.80   38.56  
1 1 1 3   14  22 o 12 47.57   19.70  30.02     87.96    28.09    105.61   34.38     158.94   50.71   21.34  59.93   25.73  -9.23   33.43  
1 1 1 3   14  23 o 4  116.89  20.20  440.40    130.63   364.45   167.68   557.64    208.33   101.31  27.93  124.60  29.57  -23.28  40.68  
1 1 1 3   14  24 o 7  73.22   29.00  162.77    180.93   0.00     0.00     162.77    180.93   ?       ?      73.22   29.00  0.00    29.00  
1 1 1 3   14  25 f 0  61.44   26.89  51.54     180.66   0.00     0.00     51.54     180.66   ?       ?      61.44   26.89  0.00    26.89  
1 1 1 3   14  26 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   15  0  o 16 341.43  30.49  3487.10   591.28   3445.76  973.08   3511.30   744.48   326.25  53.83  338.37  39.04  -12.12  66.50  
1 1 1 3   15  1  o 3  186.03  20.21  1019.63   212.39   1212.28  311.62   852.50    290.25   200.94  27.75  166.84  31.46  34.10   41.95  
1 1 1 3   15  2  o 14 272.94  26.22  2210.65   405.82   2286.10  635.96   2158.82   527.09   270.90  42.27  266.22  35.36  4.68    55.11  
1 1 1 3   15  3  o 2  552.29  64.66  10174.67  2011.17  10322.89 2843.68  10026.33  2844.76  509.87  100.73 499.50  102.64 10.37   143.81 
1 1 1 3   15  4  o 17 372.05  39.76  4248.09   836.10   4137.53  1181.41  4359.02   1183.43  353.06  60.46  363.97  58.63  -10.91  84.22  
1 1 1 3   15  5  o 14 194.21  21.05  1113.52   230.97   1162.69  324.31   1062.92   329.01   195.91  29.77  186.44  31.88  9.46    43.62  
1 1 1 3   15  6  o 18 201.00  32.25  1235.61   359.56   0.00     0.00     1235.61   359.56   ?       ?      201.00  32.25  0.00    32.25  
1 1 1 3   15  7  o 13 385.88  68.57  5234.29   1463.31  0.00     0.00     5234.29   1463.31  ?       ?      385.88  68.57  0.00    68.57  
1 1 1 3   15  8  o 12 257.75  41.79  2106.06   597.20   0.00     0.00     2106.06   597.20   ?       ?      257.75  41.79  0.00    41.79  
1 1 1 3   15  9  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   15  10 o 11 293.57  49.89  2881.70   810.73   0.00     0.00     2881.70   810.73   ?       ?      293.57  49.89  0.00    49.89  
1 1 1 3   15  11 o 19 120.36  23.87  445.21    159.09   0.00     0.00     445.21    159.09   ?       ?      120.36  23.87  0.00    23.87  
1 1 1 3   15  12 o 2  216.41  36.05  1502.22   432.10   0.00     0.00     1502.22   432.10   ?       ?      216.41  36.05  0.00    36.05  
1 1 1 3   15  13 o 19 292.63  53.61  3086.59   867.42   0.00     0.00     3086.59   867.42   ?       ?      292.63  53.61  0.00    53.61  
1 1 1 3   15  14 o 7  224.65  38.67  1676.58   480.78   0.00     0.00     1676.58   480.78   ?       ?      224.65  38.67  0.00    38.67  
1 1 1 3   15  15 o 17 129.39  25.03  525.89    179.16   0.00     0.00     525.89    179.16   ?       ?      129.39  25.03  0.00    25.03  
1 1 1 3   15  16 o 15 240.64  44.65  2076.65   594.13   0.00     0.00     2076.65   594.13   ?       ?      240.64  44.65  0.00    44.65  
1 1 1 3   15  17 o 12 198.34  36.53  1354.18   400.61   0.00     0.00     1354.18   400.61   ?       ?      198.34  36.53  0.00    36.53  
1 1 1 3   15  18 o 6  71.83   27.14  137.44    153.11   0.00     0.00     137.44    153.11   ?       ?      71.83   27.14  0.00    27.14  
1 1 1 3   15  19 o 14 64.09   26.13  78.47     151.50   0.00     0.00     78.47     151.50   ?       ?      64.09   26.13  0.00    26.13  
1 1 1 3   15  20 o 1  101.65  29.51  361.85    182.30   0.00     0.00     361.85    182.30   ?       ?      101.65  29.51  0.00    29.51  
1 1 1 3   15  21 o 19 149.18  33.56  824.54    280.41   0.00     0.00     824.54    280.41   ?       ?      149.18  33.56  0.00    33.56  
1 1 1 3   15  22 o 12 77.30   29.25  194.79    178.00   0.00     0.00     194.79    178.00   ?       ?      77.30   29.25  0.00    29.25  
1 1 1 3   15  23 o 11 85.54   30.75  274.95    192.38   0.00     0.00     274.95    192.38   ?       ?      85.54   30.75  0.00    30.75  
1 1 1 3   15  24 o 13 134.11  36.84  802.89    292.31   0.00     0.00     802.89    292.31   ?       ?      134.11  36.84  0.00    36.84  
1 1 1 3   15  25 o 4  46.59   20.17  20.34     99.22    -9.03    115.52   102.96    193.76   46.41   20.84  64.90   28.14  -18.49  35.01  
1 1 1 3   16  0  o 14 158.23  23.83  756.57    209.77   736.74   220.75   941.15    673.45   155.52  25.62  166.81  57.74  -11.30  63.17  
1 1 1 3   16  1  o 8  66.68   19.84  132.42    81.53    125.03   82.26    547.46    616.25   65.18   20.04  139.97  54.07  -74.80  57.66  
1 1 1 3   16  2  o 16 276.77  38.54  2422.07   595.72   2685.46  740.08   1937.36   1003.97  285.84  46.71  224.08  70.20  61.76   84.32  
1 1 1 3   16  3  o 1  225.77  36.70  1610.74   459.32   1997.00  538.61   580.81    879.50   250.67  38.67  151.45  62.48  99.22   73.48  
1 1 1 3   16  4  o 4  259.60  42.74  2187.93   614.74   2187.93  614.74   0.00      0.00     259.60  42.74  ?       ?      0.00    42.74  
1 1 1 3   16  5  o 12 71.21   18.77  154.15    77.82    165.02   78.55    -426.32   574.11   73.61   18.59  91.71   43.04  -18.10  46.88  
1 1 1 3   16  6  o 16 236.64  32.02  1741.06   423.83   1790.30  502.70   1620.02   788.16   236.26  38.38  208.11  61.62  28.15   72.59  
1 1 1 3   16  7  o 15 128.33  15.92  487.99    114.78   495.78   158.24   479.34    166.75   127.51  22.44  124.80  24.15  2.71    32.96  
1 1 1 3   16  8  o 11 211.78  20.37  1337.88   244.64   1203.94  365.71   1446.36   329.14   194.51  33.99  217.33  26.96  -22.82  43.38  
1 1 1 3   16  9  x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   16  10 o 18 80.27   16.24  195.51    72.28    194.35   93.81    197.21    113.39   79.41   20.45  80.12   23.28  -0.71   30.99  
1 1 1 3   16  11 o 5  190.57  20.03  1091.33   215.89   1117.69  317.32   1068.62   294.57   187.66  30.50  184.36  28.77  3.30    41.93  
1 1 1 3   16  12 o 18 144.63  17.03  625.72    138.69   615.27   189.69   637.71    203.30   140.56  24.39  142.53  25.79  -1.98   35.50  
1 1 1 3   16  13 o 9  152.00  17.69  694.62    151.45   676.41   208.67   714.89    220.16   146.43  25.76  150.26  26.49  -3.83   36.95  
1 1 1 3   16  14 o 3  45.54   17.36  45.03     62.98    90.88    76.92    -48.19    109.68   56.88   19.52  44.54   20.12  12.35   28.04  
1 1 1 3   16  15 o 18 122.02  15.92  449.40    108.83   380.33   145.40   537.37    164.10   108.92  23.91  130.59  22.71  -21.67  32.98  
1 1 1 3   16  16 o 15 157.98  19.43  769.29    172.49   718.24   238.10   825.68    250.23   146.49  29.34  157.80  28.68  -11.32  41.03  
1 1 1 3   16  17 o 10 81.41   20.06  211.53    93.13    256.06   123.58   153.00    141.67   88.42   23.82  72.32   26.33  16.10   35.51  
1 1 1 3   16  18 o 15 125.06  19.44  491.66    135.01   562.63   183.83   408.56    198.92   130.15  25.52  107.43  30.71  22.72   39.93  
1 1 1 3   16  19 o 12 52.78   20.80  60.95     92.71    49.72    110.64   87.43     169.87   54.11   22.22  66.16   27.39  -12.05  35.27  
1 1 1 3   16  20 o 17 173.83  22.07  984.96    215.29   870.74   293.51   1117.99   316.75   150.69  34.65  173.56  33.00  -22.87  47.85  
1 1 1 3   16  21 o 5  47.91   20.27  26.40     96.08    61.43    118.34   -41.32    164.56   55.75   22.95  53.22   24.28  2.52    33.41  
1 1 1 3   16  22 o 17 118.55  22.10  479.05    144.89   482.80   188.65   473.66    226.23   112.47  29.02  106.41  33.32  6.05    44.19  
1 1 1 3   16  23 o 16 138.94  22.70  671.52    174.78   762.31   232.49   553.55    265.03   139.49  29.93  108.45  36.24  31.04   47.00  
1 1 1 3   17  0  o 7  90.93   14.64  247.12    73.81    224.33   96.55    279.17    114.50   85.41   20.04  95.12   21.48  -9.71   29.37  
1 1 1 3   17  1  o 17 70.41   15.48  150.47    60.85    148.21   77.37    154.13    98.55    69.70   18.87  71.65   21.92  -1.95   28.93  
1 1 1 3   17  2  o 16 233.75  24.94  1662.56   329.48   1857.99  502.39   1515.07   436.45   239.03  37.87  216.40  36.43  22.63   52.55  
1 1 1 3   17  3  o 19 160.20  17.55  763.55    158.80   744.97   223.96   782.33    225.20   155.06  26.08  159.23  25.50  -4.17   36.48  
1 1 1 3   17  4  o 7  97.90   15.00  286.39    81.63    269.41   108.54   308.48    123.83   93.48   20.77  99.80   22.19  -6.32   30.39  
1 1 1 3   17  5  o 14 148.16  17.12  654.06    142.92   641.25   195.86   668.65    209.01   144.01  24.57  146.63  25.77  -2.62   35.61  
1 1 1 3   17  6  o 14 164.71  18.21  811.10    169.35   778.13   234.38   847.12    244.95   157.75  26.84  164.75  26.82  -7.00   37.95  
1 1 1 3   17  7  o 19 58.35   16.66  102.89    58.59    86.55    72.63    133.30    99.12    55.79   18.97  67.52   22.15  -11.73  29.17  
1 1 1 3   17  8  o 17 256.57  46.19  2333.57   655.26   2333.57  655.26   0.00      0.00     256.57  46.19  ?       ?      0.00    46.19  
1 1 1 3   17  9  f 0  112.52  50.35  124.83    667.99   0.00     0.00     124.83    667.99   ?       ?      112.52  50.35  0.00    50.35  
1 1 1 3   17  10 o 1  123.92  22.06  477.92    151.18   496.96   154.63   65.43     719.75   126.39  22.12  111.62  50.87  14.77   55.47  
1 1 1 3   17  11 o 18 159.65  27.71  820.89    244.79   947.62   258.64   -268.58   758.35   172.18  27.06  102.27  48.44  69.91   55.49  
1 1 1 3   17  12 o 4  202.89  31.38  1364.70   353.70   1375.62  392.23   1317.20   818.23   200.18  35.43  161.91  62.36  38.27   71.72  
1 1 1 3   17  13 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   17  14 o 12 150.73  26.76  745.06    223.04   745.06   223.04   0.00      0.00     150.73  26.76  ?       ?      0.00    26.76  
1 1 1 3   17  15 o 4  55.49   19.37  87.52     75.86    87.52    75.86    0.00      0.00     55.49   19.37  ?       ?      0.00    19.37  
1 1 1 3   17  16 o 16 146.75  28.71  737.11    233.21   737.11   233.21   0.00      0.00     146.75  28.71  ?       ?      0.00    28.71  
1 1 1 3   17  17 o 13 118.96  26.04  481.56    172.85   481.56   172.85   0.00      0.00     118.96  26.04  ?       ?      0.00    26.04  
1 1 1 3   17  18 f 0  91.72   25.08  290.27    135.81   290.27   135.81   0.00      0.00     91.72   25.08  ?       ?      0.00    25.08  
1 1 1 3   17  19 o 4  50.93   21.59  32.02     109.35   32.02    109.35   0.00      0.00     50.93   21.59  ?       ?      0.00    21.59  
1 1 1 3   17  20 o 8  58.00   23.02  87.55     114.36   87.55    114.36   0.00      0.00     58.00   23.02  ?       ?      0.00    23.02  
1 1 1 3   17  21 o 1  65.31   24.78  138.18    127.93   138.18   127.93   0.00      0.00     65.31   24.78  ?       ?      0.00    24.78  
1 1 1 3   18  0  o 11 56.90   16.23  97.93     55.60    88.37    68.32    116.67    95.66    55.60   18.40  64.06   21.77  -8.46   28.51  
1 1 1 3   18  1  o 15 110.68  14.76  365.56    91.45    366.94   121.13   363.74    139.45   109.24  20.05  107.69  23.24  1.55    30.70  
1 1 1 3   18  2  f 0  72.49   15.73  160.50    63.59    195.98   79.97    99.52     104.85   79.77   17.90  62.12   22.65  17.66   28.87  
1 1 1 3   18  3  o 6  37.00   15.43  9.97      54.46    -10.62   66.35    52.46     95.32    37.43   16.34  53.30   21.06  -15.87  26.66  
1 1 1 3   18  4  o 13 146.11  17.54  642.33    144.16   719.16   200.15   559.51    207.82   152.01  23.71  131.60  28.35  20.41   36.95  
1 1 1 3   18  5  o 1  61.53   17.66  115.51    65.66    102.40   81.86    139.17    109.95   59.80   20.14  69.04   23.35  -9.24   30.84  
1 1 1 3   18  6  o 15 68.05   17.10  142.93    66.73    152.67   85.81    128.03    106.14   70.25   20.20  66.73   22.93  3.52    30.56  
1 1 1 3   18  7  o 12 164.42  18.76  820.46    173.89   899.91   244.90   739.66    246.95   168.23  26.21  150.20  29.69  18.03   39.61  
1 1 1 3   18  8  x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 3   18  9  o 11 144.67  17.51  635.50    142.50   717.95   198.48   547.79    204.71   150.69  23.73  128.71  28.46  21.98   37.06  
1 1 1 3   18  10 o 9  85.58   16.09  225.03    76.13    243.24   94.61    191.60    128.21   88.00   19.26  78.00   25.16  10.01   31.69  
1 1 1 3   18  11 o 7  156.17  18.47  748.43    162.35   797.14   225.28   695.78    234.18   156.60  25.97  143.81  29.36  12.79   39.20  
1 1 1 3   18  12 f 0  66.06   17.38  136.84    66.78    179.24   80.98    46.76     118.04   75.23   18.80  55.58   22.90  19.65   29.63  
1 1 1 3   18  13 o 18 114.14  16.16  399.61    102.93   304.65   132.11   546.29    164.19   95.94   24.04  130.06  22.82  -34.12  33.15  
1 1 1 3   18  14 o 19 54.11   18.15  86.84     66.47    110.19   77.69    23.04     128.43   59.94   19.61  54.15   23.19  5.80    30.36  
1 1 1 3   18  15 o 3  118.05  18.97  442.39    124.20   431.86   160.90   457.92    195.36   112.49  25.51  112.77  29.75  -0.28   39.19  
1 1 1 3   18  16 o 1  53.71   20.50  74.24     87.85    95.36    103.72   20.66     165.24   58.95   22.32  58.55   25.67  0.39    34.02  
1 1 1 3   18  17 o 17 110.41  19.82  398.91    121.02   362.86   155.55   454.21    192.66   100.40  26.58  109.78  29.81  -9.38   39.94  
1 1 1 3   18  18 o 10 63.51   21.56  131.87    93.78    89.41    115.47   214.15    160.74   58.43   23.16  77.35   28.07  -18.92  36.39  
1 1 1 3   19  0  o 16 51.42   20.96  38.46     97.45    0.00     0.00     38.46     97.45    ?       ?      51.42   20.96  0.00    20.96  
1 1 1 3   19  1  o 9  146.26  26.92  690.40    217.67   0.00     0.00     690.40    217.67   ?       ?      146.26  26.92  0.00    26.92  
1 1 1 3   19  2  o 2  104.45  23.97  349.90    140.65   0.00     0.00     349.90    140.65   ?       ?      104.45  23.97  0.00    23.97  
1 1 1 3   19  3  o 2  70.98   22.95  154.09    106.64   0.00     0.00     154.09    106.64   ?       ?      70.98   22.95  0.00    22.95  
1 1 1 3   19  4  o 6  61.42   16.71  116.51    60.49    140.11   73.81    68.22     105.56   67.10   18.55  56.87   22.26  10.23   28.97  
1 1 1 3   19  5  o 10 65.92   16.75  134.97    63.52    126.36   76.38    154.28    114.37   64.02   19.24  71.25   23.81  -7.23   30.61  
1 1 1 3   19  6  o 2  172.35  19.97  916.79    193.91   988.77   272.89   843.38    275.58   173.27  28.42  157.43  31.59  15.85   42.49  
1 1 1 3   19  7  o 7  46.71   18.59  39.50     74.77    39.50    74.77    0.00      0.00     46.71   18.59  ?       ?      0.00    18.59  
1 1 1 3   19  8  o 12 39.94   19.02  -135.30   120.04   0.00     0.00     -135.30   120.04   ?       ?      39.94   19.02  0.00    19.02  
1 1 1 3   19  9  o 15 240.99  27.01  1912.51   367.19   1911.71  546.16   1913.17   496.01   217.99  45.13  225.53  39.76  -7.54   60.15  
1 1 1 3   19  10 o 4  97.25   19.98  302.31    107.81   309.13   108.46   -259.99   985.20   98.41   19.88  101.16  49.63  -2.75   53.46  
1 1 1 3   19  11 o 11 115.33  16.36  410.87    105.29   358.58   136.00   489.07    166.33   103.99  23.36  120.97  24.79  -16.98  34.06  
1 1 1 3   19  12 o 10 45.95   17.30  51.90     62.04    63.48    71.73    17.49     123.64   49.78   18.63  52.41   22.60  -2.63   29.29  
1 1 1 3   19  13 o 6  81.46   17.51  212.15    79.43    249.23   96.56    134.58    139.67   87.40   19.72  67.84   25.86  19.56   32.52  
1 1 1 3   19  14 o 7  120.01  20.67  471.28    137.29   512.11   173.31   402.48    224.95   121.34  25.68  101.12  33.38  20.22   42.11  
1 1 1 4   -19 0  o 9  159.04  36.65  920.64    327.71   953.45   359.12   757.29    801.21   159.05  39.51  128.11  56.34  30.94   68.81  
1 1 1 4   -19 1  f 0  100.74  35.87  351.34    261.20   308.43   278.82   659.08    746.66   96.85   36.62  124.92  54.68  -28.07  65.81  
1 1 1 4   -19 2  o 15 104.20  36.96  381.43    277.10   381.43   277.10   0.00      0.00     104.20  36.96  ?       ?      0.00    36.96  
1 1 1 4   -19 3  x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   -18 0  o 6  107.65  33.91  391.20    233.92   325.33   253.47   769.50    607.44   100.28  35.37  138.25  53.60  -37.97  64.22  
1 1 1 4   -18 1  o 10 75.86   31.23  102.12    219.25   62.52    238.45   318.71    557.62   74.73   31.78  112.71  48.29  -37.97  57.81  
1 1 1 4   -18 2  o 19 133.42  33.46  605.43    255.80   687.42   281.98   224.40    607.88   141.43  34.94  110.72  48.87  30.72   60.07  
1 1 1 4   -18 3  x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   -18 4  o 1  124.43  31.26  518.74    222.99   518.74   222.99   0.00      0.00     124.43  31.26  ?       ?      0.00    31.26  
1 1 1 4   -18 5  o 18 149.28  32.48  749.72    270.44   749.72   270.44   0.00      0.00     149.28  32.48  ?       ?      0.00    32.48  
1 1 1 4   -18 6  o 1  192.04  63.23  1786.03   807.56   0.00     0.00     1786.03   807.56   ?       ?      192.04  63.23  0.00    63.23  
1 1 1 4   -18 7  o 1  136.50  54.68  764.98    650.69   0.00     0.00     764.98    650.69   ?       ?      136.50  54.68  0.00    54.68  
1 1 1 4   -18 8  o 4  89.00   30.10  251.35    182.82   221.69   190.16   613.39    664.39   85.54   30.59  128.52  53.76  -42.98  61.86  
1 1 1 4   -17 0  o 11 286.07  58.13  3206.62   922.00   3206.62  922.00   0.00      0.00     286.07  58.13  ?       ?      0.00    58.13  
1 1 1 4   -17 1  o 1  276.45  41.26  2604.67   634.84   3255.59  849.03   1779.31   956.05   297.09  51.66  195.40  68.72  101.69  85.97  
1 1 1 4   -17 2  x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   -17 3  x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   -17 4  o 6  88.18   27.89  241.61    158.15   250.87   165.41   142.89    539.90   89.76   28.54  106.91  46.65  -17.15  54.69  
1 1 1 4   -17 5  o 1  149.97  27.10  711.29    224.72   831.60   246.89   130.05    542.67   162.23  27.49  106.35  46.58  55.88   54.09  
1 1 1 4   -17 6  o 7  256.62  33.42  2134.51   480.60   2053.72  610.59   2266.06   779.16   240.13  45.97  239.15  57.47  0.98    73.59  
1 1 1 4   -17 7  o 11 138.85  27.54  615.12    211.74   643.67   231.27   467.19    526.49   141.15  29.49  123.12  49.23  18.04   57.39  
1 1 1 4   -17 8  o 19 182.81  29.22  1068.18   296.37   1185.57  342.49   718.21    591.35   190.62  32.46  139.47  53.19  51.15   62.31  
1 1 1 4   -17 9  o 10 109.52  45.48  297.01    470.31   0.00     0.00     297.01    470.31   ?       ?      109.52  45.48  0.00    45.48  
1 1 1 4   -17 10 o 5  83.47   37.97  -86.02    398.69   0.00     0.00     -86.02    398.69   ?       ?      83.47   37.97  0.00    37.97  
1 1 1 4   -17 11 o 10 132.19  26.96  563.20    197.64   671.56   219.85   106.77    451.22   144.33  27.54  96.71   42.41  47.62   50.57  
1 1 1 4   -17 12 o 8  98.88   26.60  316.93    154.24   390.30   166.15   -140.62   414.92   109.69  26.65  82.15   37.88  27.54   46.31  
1 1 1 4   -16 0  o 1  207.26  30.15  1336.08   348.18   1377.92  433.32   1259.87   584.89   206.11  38.02  187.86  52.31  18.25   64.67  
1 1 1 4   -16 1  o 2  266.04  47.41  2402.00   697.44   2402.00  697.44   0.00      0.00     266.04  47.41  ?       ?      0.00    47.41  
1 1 1 4   -16 2  x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   -16 3  o 18 167.00  31.03  879.78    286.54   879.78   286.54   0.00      0.00     167.00  31.03  ?       ?      0.00    31.03  
1 1 1 4   -16 4  o 12 136.55  25.35  576.99    191.40   642.81   212.05   287.60    444.64   143.81  26.67  111.86  45.06  31.95   52.36  
1 1 1 4   -16 5  o 14 217.88  29.83  1479.42   363.27   1691.76  455.37   1107.80   602.42   229.52  35.72  173.74  54.37  55.78   65.06  
1 1 1 4   -16 6  o 16 77.22   26.78  168.13    144.95   130.18   156.48   397.58    384.76   73.23   27.49  115.97  43.19  -42.75  51.20  
1 1 1 4   -16 7  o 16 107.98  26.17  367.50    160.54   360.35   182.08   392.49    340.21   106.42  29.01  113.36  40.87  -6.94   50.12  
1 1 1 4   -16 8  o 7  170.22  26.09  898.07    246.86   1107.09  300.90   467.84    431.71   187.91  28.81  122.65  45.74  65.26   54.06  
1 1 1 4   -16 9  o 9  267.09  35.59  2309.92   532.15   2865.95  725.25   1661.44   783.22   288.44  45.29  202.03  61.79  86.42   76.61  
1 1 1 4   -16 10 o 3  82.94   26.92  208.27    146.56   130.78   161.41   572.09    349.76   73.52   27.85  129.71  41.53  -56.19  50.01  
1 1 1 4   -16 11 o 4  205.08  27.91  1318.44   320.02   1517.05  411.93   1016.10   508.25   215.77  34.41  165.39  49.61  50.38   60.37  
1 1 1 4   -16 12 o 11 79.16   35.41  -49.41    330.17   0.00     0.00     -49.41    330.17   ?       ?      79.16   35.41  0.00    35.41  
1 1 1 4   -16 13 o 8  189.08  47.98  1334.94   521.50   0.00     0.00     1334.94   521.50   ?       ?      189.08  47.98  0.00    47.98  
1 1 1 4   -16 14 o 4  27.91   12.11  -4.90     36.01    -8.93    36.21    361.31    345.29   27.26   11.98  107.73  40.75  -80.47  42.47  
1 1 1 4   -16 15 o 2  67.19   24.55  120.04    123.27   149.34   131.75   -85.74    349.17   72.37   25.51  78.43   35.62  -6.06   43.81  
1 1 1 4   -15 0  o 18 318.70  60.59  3530.19   1068.11  0.00     0.00     3530.19   1068.11  ?       ?      318.70  60.59  0.00    60.59  
1 1 1 4   -15 1  x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   -15 2  o 12 288.78  33.43  2564.35   544.06   2507.50  725.48   2637.41   822.44   276.79  47.36  279.72  53.16  -2.93   71.20  
1 1 1 4   -15 3  o 5  163.04  24.97  805.30    226.23   859.57   264.76   658.49    435.47   167.27  28.60  143.08  46.39  24.19   54.50  
1 1 1 4   -15 4  o 9  269.48  45.52  2369.68   679.18   2369.68  679.18   0.00      0.00     269.48  45.52  ?       ?      0.00    45.52  
1 1 1 4   -15 5  o 1  408.19  83.32  6743.02   1886.31  6743.02  1886.31  0.00      0.00     408.19  83.32  ?       ?      0.00    83.32  
1 1 1 4   -15 6  o 5  111.10  27.88  384.50    177.49   384.50   177.49   0.00      0.00     111.10  27.88  ?       ?      0.00    27.88  
1 1 1 4   -15 7  f 0  153.77  23.47  716.14    200.62   691.40   243.89   767.92    352.80   148.92  29.57  153.37  39.75  -4.45   49.54  
1 1 1 4   -15 8  o 3  209.81  26.78  1341.25   315.24   1564.53  418.35   1047.91   479.52   223.33  33.68  175.56  46.75  47.77   57.62  
1 1 1 4   -15 9  o 1  303.34  36.63  2921.35   624.99   3312.05  867.36   2499.41   901.37   310.95  50.31  258.56  61.61  52.39   79.54  
1 1 1 4   -15 10 f 0  254.83  31.95  2032.48   457.20   2446.13  621.58   1544.87   674.86   273.13  40.90  204.73  55.87  68.39   69.24  
1 1 1 4   -15 11 o 8  103.11  23.54  330.60    136.25   380.71   155.02   160.42    285.69   110.37  25.04  89.90   36.15  20.47   43.98  
1 1 1 4   -15 12 o 16 112.48  23.29  392.44    145.44   477.42   165.61   105.94    304.10   124.06  24.12  87.26   36.43  36.81   43.69  
1 1 1 4   -15 13 o 19 43.18   19.48  -47.40    102.31   -190.17  108.33   1132.43   311.40   34.58   16.86  189.54  29.58  -154.96 34.05  
1 1 1 4   -15 14 o 9  124.17  41.14  516.98    341.58   0.00     0.00     516.98    341.58   ?       ?      124.17  41.14  0.00    41.14  
1 1 1 4   -15 15 f 0  105.65  39.95  327.25    331.92   0.00     0.00     327.25    331.92   ?       ?      105.65  39.95  0.00    39.95  
1 1 1 4   -15 16 o 2  242.64  53.18  2273.01   720.23   0.00     0.00     2273.01   720.23   ?       ?      242.64  53.18  0.00    53.18  
1 1 1 4   -15 17 o 14 191.97  26.42  1161.93   283.40   1109.28  350.07   1262.05   482.75   181.81  34.81  184.66  45.77  -2.85   57.50  
1 1 1 4   -14 0  o 7  478.95  88.45  8379.71   2342.38  8379.71  2342.38  0.00      0.00     478.95  88.45  ?       ?      0.00    88.45  
1 1 1 4   -14 1  o 13 76.55   37.74  -1201.01  593.66   0.00     0.00     -1201.01  593.66   ?       ?      76.55   37.74  0.00    37.74  
1 1 1 4   -14 2  o 10 460.92  84.47  7622.78   2152.62  0.00     0.00     7622.78   2152.62  ?       ?      460.92  84.47  0.00    84.47  
1 1 1 4   -14 3  o 8  346.93  59.59  3938.04   1143.97  0.00     0.00     3938.04   1143.97  ?       ?      346.93  59.59  0.00    59.59  
1 1 1 4   -14 4  o 6  152.05  38.87  725.51    340.55   0.00     0.00     725.51    340.55   ?       ?      152.05  38.87  0.00    38.87  
1 1 1 4   -14 5  f 0  410.45  48.60  5330.50   1122.92  6320.08  1578.54  4316.73   1597.72  431.88  65.74  340.03  82.66  91.84   105.62 
1 1 1 4   -14 6  o 3  423.58  49.37  5733.06   1178.08  6337.15  1657.10  5115.74   1675.15  424.95  70.39  369.73  81.15  55.22   107.43 
1 1 1 4   -14 7  o 12 117.06  26.94  421.82    177.27   421.82   177.27   0.00      0.00     117.06  26.94  ?       ?      0.00    26.94  
1 1 1 4   -14 8  o 12 98.25   26.67  296.49    154.23   296.49   154.23   0.00      0.00     98.25   26.67  ?       ?      0.00    26.67  
1 1 1 4   -14 9  o 1  243.91  40.31  1888.96   544.75   1888.96  544.75   0.00      0.00     243.91  40.31  ?       ?      0.00    40.31  
1 1 1 4   -14 10 o 4  77.48   24.53  176.39    122.32   154.50   138.17   255.68    263.00   75.30   26.15  98.21   35.86  -22.91  44.38  
1 1 1 4   -14 11 o 11 244.19  28.54  1816.76   392.56   1926.28  529.81   1683.44   584.54   245.83  38.83  224.57  46.86  21.26   60.86  
1 1 1 4   -14 12 o 6  133.93  22.43  545.04    166.33   546.77   195.87   540.58    315.00   132.79  26.62  129.32  39.11  3.47    47.31  
1 1 1 4   -14 13 o 2  32.63   13.60  6.77      42.30    -4.63    42.85    440.14    264.22   30.73   13.28  117.32  35.89  -86.59  38.27  
1 1 1 4   -14 14 o 8  291.13  52.68  3008.38   848.06   3008.38  848.06   0.00      0.00     291.13  52.68  ?       ?      0.00    52.68  
1 1 1 4   -14 15 o 9  73.76   23.20  162.83    109.58   161.44   118.87   170.68    282.79   74.10   24.25  90.23   36.08  -16.13  43.47  
1 1 1 4   -14 16 o 14 124.87  22.17  479.86    153.13   425.87   177.47   637.15    302.91   115.81  27.17  137.86  37.35  -22.04  46.19  
1 1 1 4   -14 17 o 16 86.63   35.08  150.53    271.03   0.00     0.00     150.53    271.03   ?       ?      86.63   35.08  0.00    35.08  
1 1 1 4   -14 18 o 1  121.30  40.25  503.38    326.93   0.00     0.00     503.38    326.93   ?       ?      121.30  40.25  0.00    40.25  
1 1 1 4   -14 19 o 8  173.97  24.22  943.23    235.32   1102.01  293.52   657.52    393.73   185.65  28.45  134.50  44.15  51.15   52.52  
1 1 1 4   -13 0  x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   -13 1  o 17 234.94  25.55  1637.37   339.00   1355.65  458.11   1978.36   504.01   208.78  39.67  255.02  35.38  -46.24  53.16  
1 1 1 4   -13 2  o 10 249.07  39.63  1910.80   547.72   1910.80  547.72   0.00      0.00     249.07  39.63  ?       ?      0.00    39.63  
1 1 1 4   -13 3  o 3  224.23  26.01  1491.92   328.57   1565.80  442.55   1401.17   490.47   226.90  35.11  212.04  41.78  14.86   54.57  
1 1 1 4   -13 4  o 9  249.43  28.79  1851.69   404.69   2189.52  555.07   1468.35   591.27   268.62  36.98  214.87  49.02  53.76   61.40  
1 1 1 4   -13 5  o 6  340.93  57.61  3722.23   1087.36  0.00     0.00     3722.23   1087.36  ?       ?      340.93  57.61  0.00    57.61  
1 1 1 4   -13 6  o 12 419.40  71.84  5876.75   1667.52  0.00     0.00     5876.75   1667.52  ?       ?      419.40  71.84  0.00    71.84  
1 1 1 4   -13 7  o 12 459.63  81.28  7327.44   2066.24  0.00     0.00     7327.44   2066.24  ?       ?      459.63  81.28  0.00    81.28  
1 1 1 4   -13 8  o 17 687.16  85.87  16819.02  3313.52  16743.07 4682.44  16895.20  4689.62  597.02  139.20 600.77  138.77 -3.75   196.56 
1 1 1 4   -13 9  o 16 290.56  46.92  2667.00   755.91   2667.00  755.91   0.00      0.00     290.56  46.92  ?       ?      0.00    46.92  
1 1 1 4   -13 10 o 13 80.92   25.53  191.31    132.54   191.31   132.54   0.00      0.00     80.92   25.53  ?       ?      0.00    25.53  
1 1 1 4   -13 11 o 7  82.28   23.49  204.45    116.41   204.45   116.41   0.00      0.00     82.28   23.49  ?       ?      0.00    23.49  
1 1 1 4   -13 12 o 3  420.79  83.73  6942.79   1951.43  0.00     0.00     6942.79   1951.43  ?       ?      420.79  83.73  0.00    83.73  
1 1 1 4   -13 13 o 14 112.96  34.76  394.78    247.35   0.00     0.00     394.78    247.35   ?       ?      112.96  34.76  0.00    34.76  
1 1 1 4   -13 14 o 18 91.71   20.56  257.08    105.59   272.27   118.53   198.68    232.35   94.14   22.28  89.49   33.52  4.65    40.25  
1 1 1 4   -13 15 o 10 289.92  33.45  2627.07   546.48   2918.61  759.28   2313.73   787.15   295.49  46.28  254.75  55.41  40.74   72.19  
1 1 1 4   -13 16 o 18 146.78  21.05  651.07    172.28   621.47   212.25   708.21    294.93   141.12  27.19  147.48  35.31  -6.36   44.56  
1 1 1 4   -13 17 o 5  56.86   21.91  67.28     101.02   83.40    112.28   -1.15     231.38   61.06   23.20  70.74   30.71  -9.68   38.49  
1 1 1 4   -13 18 f 0  305.27  35.92  3016.54   617.44   3131.12  859.46   2894.34   887.61   293.01  53.05  275.72  57.92  17.29   78.54  
1 1 1 4   -13 19 f 0  203.52  41.64  1427.78   470.09   0.00     0.00     1427.78   470.09   ?       ?      203.52  41.64  0.00    41.64  
1 1 1 4   -13 20 o 12 157.09  38.64  855.71    346.03   0.00     0.00     855.71    346.03   ?       ?      157.09  38.64  0.00    38.64  
1 1 1 4   -13 21 o 17 78.75   33.05  89.06     252.30   0.00     0.00     89.06     252.30   ?       ?      78.75   33.05  0.00    33.05  
1 1 1 4   -12 0  o 3  366.79  59.69  4310.52   1213.66  0.00     0.00     4310.52   1213.66  ?       ?      366.79  59.69  0.00    59.69  
1 1 1 4   -12 1  o 18 209.07  23.33  1288.56   275.23   1445.96  380.52   1115.87   398.58   219.55  31.06  190.41  37.80  29.13   48.92  
1 1 1 4   -12 2  o 4  215.42  24.04  1369.54   292.25   1599.59  405.10   1119.85   422.03   230.96  31.36  190.06  39.95  40.90   50.79  
1 1 1 4   -12 3  o 8  194.63  21.60  1114.99   237.33   1078.33  325.35   1156.70   346.97   188.93  31.08  195.54  32.02  -6.62   44.62  
1 1 1 4   -12 4  o 19 307.96  32.56  2837.33   566.93   2790.39  795.39   2885.81   808.28   298.58  48.03  303.79  47.94  -5.21   67.86  
1 1 1 4   -12 5  o 4  533.93  60.50  9184.16   1821.77  9389.21  2573.69  8978.25   2579.06  506.75  91.85  491.90  94.77  14.86   131.98 
1 1 1 4   -12 6  o 14 299.22  32.06  2678.57   542.17   2710.45  757.53   2645.09   776.30   294.86  46.28  290.23  48.29  4.63    66.88  
1 1 1 4   -12 7  o 17 191.60  22.29  1082.77   240.57   921.33   321.40   1288.46   362.79   173.64  33.46  206.71  31.57  -33.08  46.00  
1 1 1 4   -12 8  o 12 599.58  123.49 14722.97  4108.83  0.00     0.00     14722.97  4108.83  ?       ?      599.58  123.49 0.00    123.49 
1 1 1 4   -12 9  o 16 314.61  51.81  3104.83   903.24   0.00     0.00     3104.83   903.24   ?       ?      314.61  51.81  0.00    51.81  
1 1 1 4   -12 10 o 14 154.92  18.75  705.30    163.33   1146.86  196.28   -288.91   294.52   198.33  17.42  65.82   30.87  132.50  35.45  
1 1 1 4   -12 11 o 6  233.53  25.76  1615.29   339.57   1640.85  462.87   1585.50   499.67   232.15  35.89  226.68  39.85  5.47    53.63  
1 1 1 4   -12 12 o 5  17.83   7.22   3.68      11.50    3.68     11.50    0.00      0.00     17.83   7.22   ?       ?      0.00    7.22   
1 1 1 4   -12 13 o 16 240.35  38.35  1797.75   511.38   1797.75  511.38   0.00      0.00     240.35  38.35  ?       ?      0.00    38.35  
1 1 1 4   -12 14 o 3  198.79  32.13  1216.23   354.16   1216.23  354.16   0.00      0.00     198.79  32.13  ?       ?      0.00    32.13  
1 1 1 4   -12 15 o 9  141.09  20.48  595.35    161.03   522.80   200.71   726.42    269.78   130.05  27.73  152.49  31.85  -22.45  42.23  
1 1 1 4   -12 16 o 3  133.55  19.79  534.51    147.14   532.96   182.71   537.37    248.20   131.81  25.06  130.13  33.14  1.67    41.55  
1 1 1 4   -12 17 o 3  259.82  29.22  2073.73   428.30   2121.54  594.42   2022.10   617.65   254.34  42.19  245.81  45.44  8.53    62.01  
1 1 1 4   -12 18 o 6  78.71   22.53  189.68    106.97   219.20   127.90   120.97    195.14   84.46   24.77  76.84   30.21  7.62    39.07  
1 1 1 4   -12 19 f 0  142.90  21.02  619.63    167.26   585.14   212.40   675.95    271.39   136.09  28.12  144.18  33.44  -8.09   43.69  
1 1 1 4   -12 20 o 16 177.81  22.15  961.95    221.22   922.82   293.98   1013.03   335.91   169.53  31.36  175.98  34.49  -6.44   46.61  
1 1 1 4   -12 21 o 9  101.19  21.80  319.32    122.90   280.01   147.96   406.83    220.73   93.86   26.37  111.28  32.52  -17.42  41.87  
1 1 1 4   -12 22 o 14 80.34   32.03  142.78    222.15   0.00     0.00     142.78    222.15   ?       ?      80.34   32.03  0.00    32.03  
1 1 1 4   -11 0  o 1  284.95  43.92  2476.32   695.38   2476.32  695.38   0.00      0.00     284.95  43.92  ?       ?      0.00    43.92  
1 1 1 4   -11 1  o 3  423.85  68.47  5766.48   1609.27  5766.48  1609.27  0.00      0.00     423.85  68.47  ?       ?      0.00    68.47  
1 1 1 4   -11 2  o 3  588.73  106.55 12447.60  3468.64  12447.60 3468.64  0.00      0.00     588.73  106.55 ?       ?      0.00    106.55 
1 1 1 4   -11 3  o 12 658.57  128.96 16872.84  4700.76  16872.84 4700.76  0.00      0.00     658.57  128.96 ?       ?      0.00    128.96 
1 1 1 4   -11 4  o 10 330.98  34.52  3255.02   646.28   3248.54  911.42   3261.57   916.56   324.59  50.56  325.17  50.76  -0.58   71.64  
1 1 1 4   -11 5  o 6  557.32  61.24  9734.18   1927.00  9984.46  2724.15  9483.52   2726.22  538.76  91.34  521.88  94.47  16.88   131.41 
1 1 1 4   -11 6  o 19 138.70  17.20  564.45    134.06   499.39   178.47   648.68    203.07   128.82  25.04  147.30  24.90  -18.48  35.31  
1 1 1 4   -11 7  o 5  130.29  17.13  499.21    124.99   464.93   164.33   546.27    192.54   124.33  23.89  134.62  25.85  -10.29  35.20  
1 1 1 4   -11 8  o 2  754.02  95.94  20661.39  4058.72  20206.58 5739.00  21116.49  5740.78  635.52  157.98 658.68  154.51 -23.17  220.98 
1 1 1 4   -11 9  o 2  369.26  39.41  4132.00   822.48   4237.21  1159.19  4025.32   1167.17  363.82  57.40  352.99  59.73  10.83   82.84  
1 1 1 4   -11 10 o 9  547.19  104.78 11363.19  3171.69  0.00     0.00     11363.19  3171.69  ?       ?      547.19  104.78 0.00    104.78 
1 1 1 4   -11 11 o 8  342.74  55.35  3710.36   1051.93  0.00     0.00     3710.36   1051.93  ?       ?      342.74  55.35  0.00    55.35  
1 1 1 4   -11 12 o 1  357.97  58.29  4076.46   1156.71  0.00     0.00     4076.46   1156.71  ?       ?      357.97  58.29  0.00    58.29  
1 1 1 4   -11 13 o 19 325.01  34.30  3164.26   630.26   2906.36  883.67   3431.29   899.19   303.06  52.70  331.99  48.62  -28.93  71.71  
1 1 1 4   -11 14 f 0  545.53  62.42  9772.87   1919.60  9195.99  2712.09  10352.00  2717.37  483.50  100.98 523.61  93.85  -40.11  137.85 
1 1 1 4   -11 15 o 6  292.40  47.71  2737.73   773.18   2737.73  773.18   0.00      0.00     292.40  47.71  ?       ?      0.00    47.71  
1 1 1 4   -11 16 o 12 101.21  24.48  314.25    140.67   314.25   140.67   0.00      0.00     101.21  24.48  ?       ?      0.00    24.48  
1 1 1 4   -11 17 o 7  116.28  19.71  406.48    126.88   380.49   160.88   449.24    206.34   111.05  25.74  119.93  30.04  -8.88   39.56  
1 1 1 4   -11 18 o 15 134.81  19.35  543.98    145.49   487.75   187.88   628.22    229.94   125.34  26.91  141.88  29.21  -16.54  39.72  
1 1 1 4   -11 19 o 10 206.15  23.38  1282.75   271.83   1303.02  376.43   1260.67   392.95   202.84  33.50  198.14  35.87  4.70    49.07  
1 1 1 4   -11 20 o 10 71.08   21.38  152.44    94.33    161.43   114.95   133.89    165.10   73.91   23.82  74.69   28.19  -0.78   36.91  
1 1 1 4   -11 21 o 3  87.98   20.52  239.41    101.75   305.35   126.17   116.79    172.06   99.01   22.69  73.22   28.49  25.79   36.42  
1 1 1 4   -11 22 o 17 140.84  19.28  600.57    151.80   596.79   197.87   605.98    236.66   137.65  25.99  136.47  30.93  1.18    40.40  
1 1 1 4   -11 23 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   -11 24 o 17 72.43   28.39  119.44    171.87   0.00     0.00     119.44    171.87   ?       ?      72.43   28.39  0.00    28.39  
1 1 1 4   -10 0  o 19 418.89  69.91  5813.99   1621.81  5813.99  1621.81  0.00      0.00     418.89  69.91  ?       ?      0.00    69.91  
1 1 1 4   -10 1  o 1  598.02  70.00  11683.17  2357.75  13771.83 3334.60  9595.11   3334.11  617.64  97.26  485.70  120.23 131.94  154.64 
1 1 1 4   -10 2  o 7  339.62  35.36  3445.66   679.35   3318.50  958.96   3573.78   962.55   325.54  53.15  339.12  51.02  -13.58  73.67  
1 1 1 4   -10 3  o 11 122.72  21.15  448.75    143.64   448.75   143.64   0.00      0.00     122.72  21.15  ?       ?      0.00    21.15  
1 1 1 4   -10 4  o 3  656.08  129.78 16924.70  4714.76  16924.70 4714.76  0.00      0.00     656.08  129.78 ?       ?      0.00    129.78 
1 1 1 4   -10 5  o 8  330.00  34.24  3230.81   639.29   3178.14  902.40   3283.88   905.78   321.33  50.59  327.05  49.82  -5.72   71.00  
1 1 1 4   -10 6  o 19 414.25  43.35  5152.84   1015.64  5029.17  1435.07  5276.96   1437.59  398.80  64.92  409.65  63.16  -10.85  90.57  
1 1 1 4   -10 7  o 7  651.02  72.36  13504.08  2658.62  13342.64 3759.28  13665.62  3760.43  608.54  111.73 617.85  110.06 -9.30   156.83 
1 1 1 4   -10 8  o 16 424.28  44.71  5427.19   1072.67  5484.15  1515.71  5370.04   1518.26  415.59  65.71  410.59  66.70  5.00    93.63  
1 1 1 4   -10 9  o 1  88.31   15.17  231.30    74.13    229.05   91.59    235.56    126.23   87.33   18.82  88.58   24.16  -1.25   30.63  
1 1 1 4   -10 10 o 11 348.28  36.73  3637.94   723.39   3961.56  1022.21  3313.26   1023.86  356.67  51.41  322.63  57.38  34.04   77.04  
1 1 1 4   -10 11 o 7  283.47  28.61  2382.20   459.19   9.94     643.23   4847.56   655.73   118.82  51.39  405.43  28.35  -286.61 58.69  
1 1 1 4   -10 12 o 4  399.77  42.79  4871.93   966.77   5209.28  1366.09  4533.45   1368.35  402.06  61.11  370.83  66.73  31.23   90.48  
1 1 1 4   -10 13 o 3  46.17   21.37  -110.13   133.74   0.00     0.00     -110.13   133.74   ?       ?      46.17   21.37  0.00    21.37  
1 1 1 4   -10 14 o 2  218.06  35.66  1442.18   431.01   0.00     0.00     1442.18   431.01   ?       ?      218.06  35.66  0.00    35.66  
1 1 1 4   -10 15 o 3  504.99  55.71  8038.60   1588.18  8143.88  2245.08  7933.15   2246.98  482.81  84.05  474.90  85.57  7.91    119.94 
1 1 1 4   -10 16 o 15 254.57  27.21  1929.70   391.47   1950.09  551.18   1908.94   556.11   251.14  39.54  248.03  40.45  3.11    56.56  
1 1 1 4   -10 17 o 17 263.54  42.57  2194.47   622.10   2194.47  622.10   0.00      0.00     263.54  42.57  ?       ?      0.00    42.57  
1 1 1 4   -10 18 o 16 73.28   23.12  156.86    108.74   156.86   108.74   0.00      0.00     73.28   23.12  ?       ?      0.00    23.12  
1 1 1 4   -10 19 o 10 316.42  34.62  3103.22   618.59   3116.17  871.95   3090.10   877.72   304.10  51.80  302.22  52.49  1.88    73.75  
1 1 1 4   -10 20 o 15 152.94  18.63  696.81    160.16   749.55   217.49   634.33    236.74   156.55  25.05  141.98  29.99  14.57   39.07  
1 1 1 4   -10 21 o 1  255.46  28.27  2012.13   407.61   2062.95  571.42   1959.47   581.60   249.53  41.34  241.32  43.59  8.20    60.07  
1 1 1 4   -10 22 o 1  308.37  35.18  3057.43   611.67   3119.84  861.33   2993.93   868.79   292.93  53.18  284.54  55.18  8.39    76.63  
1 1 1 4   -10 23 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   -10 24 f 0  159.18  20.01  771.21    178.78   653.91   240.28   916.68    267.58   141.30  30.52  169.16  28.57  -27.86  41.80  
1 1 1 4   -10 25 o 1  98.81   19.34  302.76    105.77   359.37   134.52   211.13    171.17   106.61  22.68  83.52   29.10  23.08   36.89  
1 1 1 4   -9  0  o 15 439.07  80.48  7009.42   1953.88  0.00     0.00     7009.42   1953.88  ?       ?      439.07  80.48  0.00    80.48  
1 1 1 4   -9  1  x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   -9  2  o 18 234.51  36.34  1685.59   473.36   0.00     0.00     1685.59   473.36   ?       ?      234.51  36.34  0.00    36.34  
1 1 1 4   -9  3  o 11 291.74  30.70  2544.71   506.50   2828.11  716.25   2261.24   716.34   302.56  42.40  267.13  48.50  35.43   64.42  
1 1 1 4   -9  4  o 13 296.69  30.97  2626.30   519.78   2576.71  733.88   2676.23   736.30   287.55  46.01  293.58  45.13  -6.02   64.45  
1 1 1 4   -9  5  o 5  139.80  22.09  581.78    171.38   581.78   171.38   0.00      0.00     139.80  22.09  ?       ?      0.00    22.09  
1 1 1 4   -9  6  o 9  382.51  61.31  4661.70   1300.76  4661.70  1300.76  0.00      0.00     382.51  61.31  ?       ?      0.00    61.31  
1 1 1 4   -9  7  o 12 583.80  105.71 12247.33  3412.33  12247.33 3412.33  0.00      0.00     583.80  105.71 ?       ?      0.00    105.71 
1 1 1 4   -9  8  o 7  110.41  13.65  356.44    84.69    360.92   116.74   351.47    123.05   110.19  19.15  108.47  20.51  1.72    28.06  
1 1 1 4   -9  9  o 9  151.61  16.47  670.76    141.05   684.75   196.92   656.02    202.14   151.99  23.31  148.44  24.58  3.54    33.88  
1 1 1 4   -9  10 o 10 210.42  21.96  1296.09   261.37   470.43   365.07   2164.35   374.37   128.42  42.53  272.04  24.22  -143.62 48.94  
1 1 1 4   -9  11 o 16 341.95  35.06  3476.38   678.53   554.32   956.65   6434.57   962.55   166.43  66.42  465.74  36.29  -299.32 75.69  
1 1 1 4   -9  12 o 8  216.81  22.75  1381.04   278.96   1393.34  392.60   1368.50   396.44   215.20  32.82  213.03  33.52  2.17    46.91  
1 1 1 4   -9  13 o 13 91.05   15.31  245.94    77.21    265.42   102.89   220.83    116.81   93.93   19.71  85.64   23.19  8.29    30.44  
1 1 1 4   -9  14 f 0  309.14  32.49  2853.13   567.93   2819.38  801.74   2887.12   804.61   300.70  48.06  304.60  47.57  -3.90   67.62  
1 1 1 4   -9  15 o 15 505.34  89.64  8974.71   2505.13  0.00     0.00     8974.71   2505.13  ?       ?      505.34  89.64  0.00    89.64  
1 1 1 4   -9  16 o 12 360.60  58.18  4139.32   1163.35  0.00     0.00     4139.32   1163.35  ?       ?      360.60  58.18  0.00    58.18  
1 1 1 4   -9  17 o 7  377.10  40.26  4331.91   858.05   4278.52  1211.88  4385.59   1215.07  362.43  60.37  367.53  59.63  -5.10   84.85  
1 1 1 4   -9  18 o 13 353.64  38.05  3836.01   760.34   3700.26  1073.13  3972.86   1077.44  333.85  58.10  347.89  55.84  -14.04  80.58  
1 1 1 4   -9  19 f 0  135.41  23.73  555.30    177.74   555.30   177.74   0.00      0.00     135.41  23.73  ?       ?      0.00    23.73  
1 1 1 4   -9  20 o 1  109.85  22.42  368.17    136.62   368.17   136.62   0.00      0.00     109.85  22.42  ?       ?      0.00    22.42  
1 1 1 4   -9  21 o 14 81.48   17.59  201.69    79.87    237.13   99.66    138.02    133.57   88.02   20.16  72.14   25.66  15.88   32.63  
1 1 1 4   -9  22 o 8  232.76  39.36  1776.27   507.17   1776.27  507.17   0.00      0.00     232.76  39.36  ?       ?      0.00    39.36  
1 1 1 4   -9  23 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   -9  24 o 17 80.26   21.39  200.29    100.32   200.29   100.32   0.00      0.00     80.26   21.39  ?       ?      0.00    21.39  
1 1 1 4   -9  25 o 2  189.14  34.82  1195.40   364.16   0.00     0.00     1195.40   364.16   ?       ?      189.14  34.82  0.00    34.82  
1 1 1 4   -9  26 o 19 51.56   19.37  62.69     77.76    93.34    93.25    -7.22     140.86   59.23   21.39  54.63   23.83  4.60    32.03  
1 1 1 4   -8  0  o 2  223.46  23.33  1482.01   294.87   1621.42  416.88   1342.42   417.15   230.52  32.40  207.84  36.28  22.68   48.64  
1 1 1 4   -8  1  o 5  269.80  28.35  2182.54   432.59   2368.24  611.74   1996.80   611.82   275.77  39.79  250.63  44.13  25.14   59.42  
1 1 1 4   -8  2  o 16 483.85  55.48  7654.38   1513.11  8549.79  2139.97  6759.15   2139.75  482.34  80.09  412.00  92.72  70.34   122.52 
1 1 1 4   -8  3  o 2  153.75  23.78  709.47    203.13   0.00     0.00     709.47    203.13   ?       ?      153.75  23.78  0.00    23.78  
1 1 1 4   -8  4  o 5  166.35  25.68  832.38    237.37   0.00     0.00     832.38    237.37   ?       ?      166.35  25.68  0.00    25.68  
1 1 1 4   -8  5  o 11 375.15  40.27  4321.96   853.61   4809.24  1207.41  3835.02   1206.98  384.65  56.35  336.64  64.81  48.02   85.88  
1 1 1 4   -8  6  o 13 468.37  51.67  6931.64   1366.28  6878.70  1932.12  6984.58   1932.31  441.35  79.17  445.58  78.40  -4.23   111.42 
1 1 1 4   -8  7  o 15 173.69  18.23  884.03    179.11   963.80   253.66   804.71    252.94   179.84  25.27  163.35  27.98  16.49   37.70  
1 1 1 4   -8  8  f 0  263.49  40.65  2122.20   595.07   2122.20  595.07   0.00      0.00     263.49  40.65  ?       ?      0.00    40.65  
1 1 1 4   -8  9  o 9  506.06  86.83  8725.70   2431.81  8725.70  2431.81  0.00      0.00     506.06  86.83  ?       ?      0.00    86.83  
1 1 1 4   -8  10 o 3  600.06  66.30  11336.06  2245.93  3.57     3174.06  22699.49  3178.39  240.20  108.42 851.77  65.50  -611.57 126.67 
1 1 1 4   -8  11 o 2  763.20  88.24  19268.59  3795.08  19538.05 5366.98  18999.12  5367.12  708.12  136.98 694.60  139.45 13.52   195.47 
1 1 1 4   -8  12 o 15 804.48  95.33  21918.32  4317.31  21733.65 6105.49  22103.00  6105.70  723.00  151.94 731.83  150.36 -8.83   213.76 
1 1 1 4   -8  13 o 12 347.73  36.27  3604.32   713.41   3256.16  1008.42  3953.16   1009.40  322.04  56.61  358.49  50.44  -36.45  75.82  
1 1 1 4   -8  14 o 15 582.98  65.46  10923.17  2152.91  10866.60 3044.48  10979.76  3044.86  544.25  101.17 547.90  100.51 -3.65   142.61 
1 1 1 4   -8  15 f 0  169.89  18.48  846.19    177.34   869.94   249.43   821.90    252.19   170.52  26.33  165.34  27.54  5.18    38.10  
1 1 1 4   -8  16 o 3  463.59  50.17  6658.03   1313.85  6750.81  1857.52  6565.14   1858.60  448.01  74.86  440.53  76.25  7.49    106.86 
1 1 1 4   -8  17 o 9  185.52  30.56  1036.69   314.14   0.00     0.00     1036.69   314.14   ?       ?      185.52  30.56  0.00    30.56  
1 1 1 4   -8  18 f 0  287.22  45.39  2558.97   723.59   0.00     0.00     2558.97   723.59   ?       ?      287.22  45.39  0.00    45.39  
1 1 1 4   -8  19 o 14 120.62  15.91  428.71    107.50   463.62   145.20   386.39    159.90   124.41  21.08  112.51  25.36  11.90   32.98  
1 1 1 4   -8  20 o 14 63.35   17.90  120.10    67.98    99.57    86.50    153.25    109.93   60.62   20.70  72.77   23.28  -12.15  31.16  
1 1 1 4   -8  21 f 0  250.86  40.84  2009.38   567.94   2009.38  567.94   0.00      0.00     250.86  40.84  ?       ?      0.00    40.84  
1 1 1 4   -8  22 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   -8  23 o 13 215.49  23.62  1406.67   287.38   1423.16  402.92   1389.59   410.02   210.86  34.48  207.56  35.70  3.29    49.63  
1 1 1 4   -8  24 o 6  163.91  18.90  805.80    174.57   832.97   241.39   776.02    252.75   163.40  26.65  156.38  29.23  7.02    39.56  
1 1 1 4   -8  25 o 5  257.66  28.94  2091.62   420.60   2190.05  592.03   1991.31   597.65   251.73  42.48  236.79  45.62  14.94   62.34  
1 1 1 4   -8  26 o 12 108.42  16.90  356.48    101.79   379.23   135.55   327.06    154.13   109.97  22.24  100.72  26.36  9.26    34.48  
1 1 1 4   -8  27 o 5  164.56  19.63  829.11    181.81   928.36   250.50   718.65    264.28   170.17  26.51  145.59  32.45  24.58   41.90  
1 1 1 4   -7  0  o 9  609.33  76.12  13221.92  2604.72  13722.46 3683.63  12721.39  3683.63  546.95  120.57 515.19  125.69 31.76   174.17 
1 1 1 4   -7  1  o 11 255.63  26.63  1948.17   385.03   2077.72  544.46   1818.57   544.56   259.52  37.64  241.07  40.80  18.45   55.52  
1 1 1 4   -7  2  o 3  283.05  29.62  2404.00   474.15   2740.65  670.63   2067.54   670.45   297.23  40.34  253.77  47.78  43.46   62.53  
1 1 1 4   -7  3  o 7  258.75  26.96  1998.42   394.54   2149.61  557.92   1847.19   558.01   263.76  37.94  242.48  41.58  21.29   56.29  
1 1 1 4   -7  4  o 12 334.96  35.53  3421.08   672.70   3997.26  951.69   2845.75   950.99   354.25  48.03  290.89  58.97  63.36   76.06  
1 1 1 4   -7  5  o 6  473.00  93.64  8802.94   2452.70  0.00     0.00     8802.94   2452.70  ?       ?      473.00  93.64  0.00    93.64  
1 1 1 4   -7  6  o 12 293.26  46.98  2736.31   764.15   0.00     0.00     2736.31   764.15   ?       ?      293.26  46.98  0.00    46.98  
1 1 1 4   -7  7  f 0  388.74  41.86  4673.35   919.44   5094.45  1300.52  4252.55   1300.05  392.53  59.58  352.35  66.71  40.18   89.45  
1 1 1 4   -7  8  o 17 351.18  37.20  3748.98   738.59   3995.26  1044.47  3502.64   1044.58  352.97  53.20  327.17  57.73  25.80   78.50  
1 1 1 4   -7  9  o 2  156.46  16.94  717.11    149.73   254.10   208.88   1206.47   214.74   95.33   32.18  203.08  18.63  -107.74 37.18  
1 1 1 4   -7  10 o 4  18.65   9.35   -124.97   43.11    -124.97  43.11    0.00      0.00     18.65   9.35   ?       ?      0.00    9.35   
1 1 1 4   -7  11 o 13 271.17  41.50  2236.18   625.54   2236.18  625.54   0.00      0.00     271.17  41.50  ?       ?      0.00    41.50  
1 1 1 4   -7  12 o 5  853.48  104.72 25534.64  5023.36  26327.39 7104.16  24741.91  7104.05  770.61  165.53 734.67  171.57 35.94   238.40 
1 1 1 4   -7  13 o 17 247.14  25.48  1792.52   356.27   1817.52  503.22   1767.39   504.46   246.06  36.75  242.38  37.46  3.69    52.48  
1 1 1 4   -7  14 o 16 162.98  17.26  775.32    158.99   799.07   223.25   750.89    226.47   164.15  24.43  158.75  25.73  5.40    35.48  
1 1 1 4   -7  15 o 2  220.44  33.97  1464.19   416.10   0.00     0.00     1464.19   416.10   ?       ?      220.44  33.97  0.00    33.97  
1 1 1 4   -7  16 o 7  217.46  22.72  1391.62   279.39   1369.78  394.34   1413.64   395.91   212.78  33.38  216.37  32.91  -3.60   46.88  
1 1 1 4   -7  17 o 9  514.25  56.97  8382.27   1653.73  8303.37  2338.35  8461.22   2339.11  483.10  87.54  488.83  86.52  -5.73   123.08 
1 1 1 4   -7  18 o 13 363.95  38.44  3991.43   791.01   3933.88  1117.46  4049.23   1119.87  351.61  57.34  357.33  56.47  -5.72   80.47  
1 1 1 4   -7  19 o 13 99.60   23.94  300.82    135.20   0.00     0.00     300.82    135.20   ?       ?      99.60   23.94  0.00    23.94  
1 1 1 4   -7  20 f 0  472.46  89.93  8421.88   2350.02  0.00     0.00     8421.88   2350.02  ?       ?      472.46  89.93  0.00    89.93  
1 1 1 4   -7  21 f 0  198.48  31.63  1210.21   348.30   1210.21  348.30   0.00      0.00     198.48  31.63  ?       ?      0.00    31.63  
1 1 1 4   -7  22 o 1  136.69  25.02  570.94    189.11   0.00     0.00     570.94    189.11   ?       ?      136.69  25.02  0.00    25.02  
1 1 1 4   -7  23 o 16 328.05  60.13  3894.04   1090.73  3894.04  1090.73  0.00      0.00     328.05  60.13  ?       ?      0.00    60.13  
1 1 1 4   -7  24 o 3  94.62   21.65  276.94    115.02   276.94   115.02   0.00      0.00     94.62   21.65  ?       ?      0.00    21.65  
1 1 1 4   -7  25 o 4  44.19   17.54  32.57     66.32    11.02    86.37    63.53     103.51   45.72   19.27  56.57   22.07  -10.84  29.30  
1 1 1 4   -7  26 o 17 197.27  21.99  1188.61   244.75   1265.22  344.11   1110.18   348.17   197.83  31.34  183.05  34.40  14.78   46.53  
1 1 1 4   -7  27 o 5  217.40  24.23  1472.92   297.21   1657.95  419.01   1285.55   421.64   223.04  33.78  190.91  39.76  32.13   52.18  
1 1 1 4   -7  28 o 11 153.22  19.74  722.65    169.58   753.27   236.70   690.37    243.07   151.48  28.26  143.43  30.46  8.04    41.55  
1 1 1 4   -6  0  o 13 187.77  19.27  1034.90   204.75   1121.31  289.49   948.40    289.62   193.66  26.75  177.04  29.54  16.62   39.85  
1 1 1 4   -6  1  o 3  498.85  55.53  7947.43   1563.33  8332.49  2210.91  7562.38   2210.87  483.54  82.61  454.42  87.93  29.12   120.65 
1 1 1 4   -6  2  o 13 270.68  28.03  2180.44   429.31   2397.32  607.18   1963.62   607.08   279.62  38.88  250.49  43.81  29.13   58.57  
1 1 1 4   -6  3  o 6  129.53  19.80  498.90    142.53   498.90   142.53   0.00      0.00     129.53  19.80  ?       ?      0.00    19.80  
1 1 1 4   -6  4  o 4  84.56   9.75   208.65    46.45    232.72   64.58    182.85    66.87    88.84   13.05  78.13   15.46  10.70   20.23  
1 1 1 4   -6  5  o 4  393.25  42.38  4785.77   941.73   5164.33  1331.85  4407.26   1331.77  394.58  60.74  358.83  67.12  35.75   90.52  
1 1 1 4   -6  6  o 12 214.19  22.16  1355.81   268.53   1438.91  379.69   1272.64   379.82   217.78  31.26  203.73  33.65  14.06   45.93  
1 1 1 4   -6  7  o 15 95.75   16.11  272.95    85.41    0.00     0.00     272.95    85.41    ?       ?      95.75   16.11  0.00    16.11  
1 1 1 4   -6  8  o 5  63.08   14.27  119.66    50.47    0.00     0.00     119.66    50.47    ?       ?      63.08   14.27  0.00    14.27  
1 1 1 4   -6  9  o 17 60.98   10.78  110.36    36.36    -1.56    45.06    319.38    61.58    32.18   13.75  104.76  10.38  -72.58  17.23  
1 1 1 4   -6  10 o 8  316.33  33.23  3012.93   594.51   3151.72  840.45   2873.95   841.07   316.16  47.80  300.07  50.62  16.09   69.62  
1 1 1 4   -6  11 o 19 114.12  18.16  386.69    115.02   386.69   115.02   0.00      0.00     114.12  18.16  ?       ?      0.00    18.16  
1 1 1 4   -6  12 o 19 481.66  83.09  7946.29   2214.58  7946.29  2214.58  0.00      0.00     481.66  83.09  ?       ?      0.00    83.09  
1 1 1 4   -6  13 o 13 188.29  28.61  1057.28   299.56   1057.28  299.56   0.00      0.00     188.29  28.61  ?       ?      0.00    28.61  
1 1 1 4   -6  14 o 2  144.40  15.51  608.06    126.58   588.30   176.54   628.98    181.60   140.77  22.61  145.69  22.43  -4.93   31.85  
1 1 1 4   -6  15 f 0  246.94  25.56  1790.85   357.15   1606.09  504.32   1976.74   505.86   230.08  39.61  257.13  35.19  -27.06  52.99  
1 1 1 4   -6  16 o 16 194.87  20.32  1112.04   223.93   1118.09  315.14   1105.87   318.26   193.39  29.30  192.18  29.81  1.21    41.80  
1 1 1 4   -6  17 o 10 391.85  41.60  4667.91   921.52   4700.44  1302.99  4635.35   1303.45  381.25  61.64  378.18  62.20  3.07    87.57  
1 1 1 4   -6  18 f 0  356.21  37.74  3836.26   760.09   3688.60  1074.37  3984.22   1075.48  338.62  57.31  353.79  54.72  -15.17  79.24  
1 1 1 4   -6  19 o 8  469.20  50.99  6838.16   1351.43  6645.67  1910.54  7030.91   1911.88  441.29  78.28  456.51  75.60  -15.22  108.83 
1 1 1 4   -6  20 o 16 107.07  23.22  346.78    138.60   0.00     0.00     346.78    138.60   ?       ?      107.07  23.22  0.00    23.22  
1 1 1 4   -6  21 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   -6  22 o 19 290.11  48.03  2742.28   771.92   0.00     0.00     2742.28   771.92   ?       ?      290.11  48.03  0.00    48.03  
1 1 1 4   -6  23 o 1  64.62   16.91  126.32    63.47    118.41   85.83    135.86    94.27    64.09   20.58  68.19   21.53  -4.11   29.79  
1 1 1 4   -6  24 o 15 235.85  25.39  1687.26   338.39   1786.14  477.39   1587.41   479.72   236.49  36.32  220.88  39.27  15.61   53.49  
1 1 1 4   -6  25 o 4  254.52  44.54  2218.31   627.04   2218.31  627.04   0.00      0.00     254.52  44.54  ?       ?      0.00    44.54  
1 1 1 4   -6  26 o 10 145.44  25.71  663.51    206.82   663.51   206.82   0.00      0.00     145.44  25.71  ?       ?      0.00    25.71  
1 1 1 4   -6  27 o 13 65.19   18.67  130.30    73.42    152.72   96.32    99.21     113.41   70.66   21.68  63.00   23.45  7.66    31.94  
1 1 1 4   -6  28 o 14 106.53  18.43  349.54    108.61   371.40   146.83   323.14    161.39   107.50  24.36  99.25   27.42  8.25    36.68  
1 1 1 4   -6  29 o 5  138.47  19.36  592.63    149.67   607.06   209.37   577.54    214.03   135.36  27.87  131.12  29.19  4.24    40.36  
1 1 1 4   -5  0  o 5  354.73  56.22  3971.72   1106.80  3971.72  1106.80  0.00      0.00     354.73  56.22  ?       ?      0.00    56.22  
1 1 1 4   -5  1  o 15 221.03  33.45  1471.70   411.11   1471.70  411.11   0.00      0.00     221.03  33.45  ?       ?      0.00    33.45  
1 1 1 4   -5  2  o 8  425.60  45.34  5532.69   1090.72  5802.12  1542.53  5263.27   1542.49  422.81  65.68  399.46  69.80  23.34   95.85  
1 1 1 4   -5  3  o 9  334.32  34.94  3349.52   660.72   3503.43  934.41   3195.61   934.38   334.91  50.14  318.11  53.03  16.80   72.98  
1 1 1 4   -5  4  o 10 179.17  18.42  940.36    186.73   946.16   264.14   934.58    264.00   177.82  26.70  176.66  26.88  1.16    37.89  
1 1 1 4   -5  5  o 17 364.70  38.65  4039.64   796.88   4252.30  1126.98  3826.99   1126.95  364.15  55.68  342.72  59.43  21.44   81.44  
1 1 1 4   -5  6  o 5  287.74  30.01  2474.24   488.36   2516.70  690.63   2431.79   690.65   284.21  43.73  278.84  44.65  5.38    62.50  
1 1 1 4   -5  7  o 8  333.66  35.29  3376.62   665.81   3349.89  941.51   3403.36   941.68   322.30  52.71  325.23  52.20  -2.94   74.18  
1 1 1 4   -5  8  o 7  145.35  15.31  618.50    125.82   -4.79    175.44   1278.66   180.56   62.91   27.02  209.60  15.11  -146.69 30.96  
1 1 1 4   -5  9  o 14 538.88  130.24 14302.66  3983.88  0.00     0.00     14302.66  3983.88  ?       ?      538.88  130.24 0.00    130.24 
1 1 1 4   -5  10 o 14 102.20  16.83  310.91    95.32    0.00     0.00     310.91    95.32    ?       ?      102.20  16.83  0.00    16.83  
1 1 1 4   -5  11 o 12 346.05  36.77  3645.71   719.34   3760.14  1017.31  3531.28   1017.28  341.08  53.73  328.91  55.87  12.17   77.52  
1 1 1 4   -5  12 o 14 141.93  14.96  588.79    120.05   515.24   168.87   663.93    170.70   130.93  23.32  149.74  20.39  -18.80  30.98  
1 1 1 4   -5  13 o 4  577.92  115.12 13227.77  3685.00  13227.77 3685.00  0.00      0.00     577.92  115.12 ?       ?      0.00    115.12 
1 1 1 4   -5  14 o 4  144.24  22.24  617.37    178.23   617.37   178.23   0.00      0.00     144.24  22.24  ?       ?      0.00    22.24  
1 1 1 4   -5  15 o 12 532.80  57.26  8751.75   1723.97  9113.13  2438.09  8390.39   2438.03  524.50  83.79  499.37  88.27  25.14   121.71 
1 1 1 4   -5  16 o 4  438.26  46.16  5800.36   1144.03  5775.19  1617.80  5825.55   1618.00  425.26  68.60  427.36  68.25  -2.10   96.77  
1 1 1 4   -5  17 o 9  508.67  88.17  8901.35   2481.27  0.00     0.00     8901.35   2481.27  ?       ?      508.67  88.17  0.00    88.17  
1 1 1 4   -5  18 o 14 263.04  27.45  2050.00   408.39   1936.44  577.23   2163.83   577.88   250.66  41.57  266.31  38.95  -15.65  56.97  
1 1 1 4   -5  19 o 12 488.86  53.97  7551.06   1489.47  7522.90  2106.25  7579.23   2106.61  461.82  82.47  463.96  82.10  -2.14   116.37 
1 1 1 4   -5  20 o 12 352.18  56.72  3959.19   1107.82  3959.19  1107.82  0.00      0.00     352.18  56.72  ?       ?      0.00    56.72  
1 1 1 4   -5  21 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   -5  22 o 12 57.05   20.43  81.26     84.82    0.00     0.00     81.26     84.82    ?       ?      57.05   20.43  0.00    20.43  
1 1 1 4   -5  23 o 16 325.45  56.20  3612.67   1012.01  0.00     0.00     3612.67   1012.01  ?       ?      325.45  56.20  0.00    56.20  
1 1 1 4   -5  24 o 2  105.98  21.65  343.26    127.26   0.00     0.00     343.26    127.26   ?       ?      105.98  21.65  0.00    21.65  
1 1 1 4   -5  25 o 17 149.69  17.36  666.54    146.41   622.93   206.84   710.34    207.28   141.50  26.43  152.07  24.58  -10.57  36.10  
1 1 1 4   -5  26 o 4  155.99  26.86  763.75    231.85   763.75   231.85   0.00      0.00     155.99  26.86  ?       ?      0.00    26.86  
1 1 1 4   -5  27 o 18 169.48  29.40  922.55    275.70   922.55   275.70   0.00      0.00     169.48  29.40  ?       ?      0.00    29.40  
1 1 1 4   -5  28 o 7  308.34  36.91  3234.36   640.38   3400.36  906.54   3069.02   904.74   288.07  56.84  267.63  60.33  20.44   82.89  
1 1 1 4   -5  29 o 12 226.06  26.27  1639.12   334.54   1763.44  473.70   1515.42   472.52   222.17  38.54  201.67  42.17  20.51   57.13  
1 1 1 4   -4  0  f 0  585.94  64.27  10784.30  2126.33  11594.84 3007.11  9973.80   3007.05  582.19  93.11  530.43  102.46 51.76   138.45 
1 1 1 4   -4  1  f 0  607.54  111.73 13476.89  3753.28  13476.89 3753.28  0.00      0.00     607.54  111.73 ?       ?      0.00    111.73 
1 1 1 4   -4  2  o 2  191.42  28.70  1092.40   305.62   1092.40  305.62   0.00      0.00     191.42  28.70  ?       ?      0.00    28.70  
1 1 1 4   -4  3  o 14 417.74  44.03  5273.39   1040.03  5700.26  1470.87  4846.57   1470.77  424.51  62.20  387.05  68.71  37.46   92.68  
1 1 1 4   -4  4  o 10 369.23  38.65  4089.86   807.16   4618.44  1141.59  3561.45   1141.42  385.72  52.95  333.41  61.91  52.31   81.47  
1 1 1 4   -4  5  o 10 308.26  31.98  2826.41   557.74   3044.02  788.83   2608.87   788.72   314.96  44.90  289.31  49.25  25.65   66.65  
1 1 1 4   -4  6  o 17 213.88  21.98  1344.60   266.07   1472.82  376.28   1216.40   376.27   221.72  30.36  200.07  33.97  21.65   45.56  
1 1 1 4   -4  7  o 16 218.47  22.49  1406.14   278.05   1538.97  393.01   1273.02   393.43   226.16  31.09  204.13  34.82  22.02   46.68  
1 1 1 4   -4  8  o 18 173.22  18.10  880.36    177.30   -0.49    248.95   1787.01   252.57   75.10   32.22  247.50  17.90  -172.39 36.86  
1 1 1 4   -4  9  o 1  370.89  39.94  4227.75   837.08   1478.13  1183.00  6984.89   1184.62  208.92  76.09  474.47  43.99  -265.54 87.89  
1 1 1 4   -4  10 o 17 177.71  27.16  952.85    268.28   0.00     0.00     952.85    268.28   ?       ?      177.71  27.16  0.00    27.16  
1 1 1 4   -4  11 o 6  177.65  27.17  952.26    268.32   0.00     0.00     952.26    268.32   ?       ?      177.65  27.17  0.00    27.17  
1 1 1 4   -4  12 o 16 326.74  53.34  3462.10   965.96   0.00     0.00     3462.10   965.96   ?       ?      326.74  53.34  0.00    53.34  
1 1 1 4   -4  13 o 3  563.19  125.74 14224.31  3962.30  0.00     0.00     14224.31  3962.30  ?       ?      563.19  125.74 0.00    125.74 
1 1 1 4   -4  14 o 7  274.33  28.45  2232.58   441.49   2285.76  624.08   2179.30   624.65   273.02  41.09  265.96  42.33  7.06    58.99  
1 1 1 4   -4  15 o 13 228.97  34.81  1578.69   443.19   1578.69  443.19   0.00      0.00     228.97  34.81  ?       ?      0.00    34.81  
1 1 1 4   -4  16 o 16 254.78  38.78  1958.96   549.37   1958.96  549.37   0.00      0.00     254.78  38.78  ?       ?      0.00    38.78  
1 1 1 4   -4  17 o 10 442.09  46.67  5916.00   1166.53  5924.43  1649.64  5907.56   1649.79  429.82  69.21  429.12  69.33  0.70    97.96  
1 1 1 4   -4  18 o 7  300.19  31.16  2675.45   529.23   2702.73  748.20   2648.13   748.69   296.43  45.41  293.12  46.01  3.31    64.64  
1 1 1 4   -4  19 o 5  195.19  20.38  1119.21   224.98   1201.55  317.90   1036.58   318.45   200.26  28.45  184.99  31.09  15.27   42.14  
1 1 1 4   -4  20 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   -4  21 o 2  201.22  31.66  1223.19   353.62   0.00     0.00     1223.19   353.62   ?       ?      201.22  31.66  0.00    31.66  
1 1 1 4   -4  22 o 15 171.30  18.70  861.92    180.91   839.19   255.16   884.91    256.55   166.81  27.61  171.58  26.93  -4.77   38.57  
1 1 1 4   -4  23 o 19 395.99  43.38  4937.70   970.10   5249.40  1372.12  4626.18   1371.74  390.21  63.43  360.75  68.75  29.47   93.54  
1 1 1 4   -4  24 o 6  175.82  28.51  950.43    277.93   0.00     0.00     950.43    277.93   ?       ?      175.82  28.51  0.00    28.51  
1 1 1 4   -4  25 o 7  144.07  24.70  636.80    196.94   0.00     0.00     636.80    196.94   ?       ?      144.07  24.70  0.00    24.70  
1 1 1 4   -4  26 o 8  265.27  47.00  2448.35   689.50   0.00     0.00     2448.35   689.50   ?       ?      265.27  47.00  0.00    47.00  
1 1 1 4   -4  27 o 7  169.72  19.61  870.72    187.55   981.61   267.57   763.62    262.96   176.45  27.30  153.31  30.95  23.14   41.26  
1 1 1 4   -4  28 o 1  156.28  29.69  796.00    256.62   796.00   256.62   0.00      0.00     156.28  29.69  ?       ?      0.00    29.69  
1 1 1 4   -4  29 o 1  203.92  38.39  1472.83   432.92   1472.83  432.92   0.00      0.00     203.92  38.39  ?       ?      0.00    38.39  
1 1 1 4   -4  30 o 5  146.37  19.27  663.87    158.02   813.10   231.38   533.44    216.32   157.44  26.54  124.37  30.53  33.07   40.45  
1 1 1 4   -3  0  o 5  214.58  21.93  1346.49   266.30   1422.16  376.59   1270.82   376.62   218.69  30.85  206.00  32.96  12.69   45.15  
1 1 1 4   -3  1  o 13 310.85  31.99  2852.74   562.73   2936.66  795.80   2768.81   795.84   311.05  45.95  301.28  47.59  9.77    66.15  
1 1 1 4   -3  2  o 9  252.47  38.05  1916.25   534.41   1916.25  534.41   0.00      0.00     252.47  38.05  ?       ?      0.00    38.05  
1 1 1 4   -3  3  o 17 100.87  15.30  299.91    85.82    299.91   85.82    0.00      0.00     100.87  15.30  ?       ?      0.00    15.30  
1 1 1 4   -3  4  o 5  537.67  92.05  9834.72   2739.19  9834.72  2739.19  0.00      0.00     537.67  92.05  ?       ?      0.00    92.05  
1 1 1 4   -3  5  o 18 431.60  45.49  5636.22   1110.07  5514.92  1569.82  5757.54   1569.93  414.18  68.41  424.49  66.62  -10.31  95.49  
1 1 1 4   -3  6  o 11 265.84  27.35  2084.72   411.38   2155.04  581.68   2014.35   581.88   266.72  39.16  257.14  40.78  9.57    56.53  
1 1 1 4   -3  7  o 9  508.45  90.72  9157.15   2550.79  0.00     0.00     9157.15   2550.79  ?       ?      508.45  90.72  0.00    90.72  
1 1 1 4   -3  8  o 16 266.32  27.70  2105.08   417.37   0.44     588.96   4228.23   591.54   113.27  49.08  378.48  27.41  -265.21 56.22  
1 1 1 4   -3  9  o 5  370.30  39.39  4184.26   824.55   4443.46  1166.06  3925.04   1166.13  370.72  56.58  344.92  61.13  25.81   83.30  
1 1 1 4   -3  10 o 2  277.94  43.88  2424.65   676.95   0.00     0.00     2424.65   676.95   ?       ?      277.94  43.88  0.00    43.88  
1 1 1 4   -3  11 o 17 231.45  24.01  1589.65   314.35   1693.28  444.57   1486.03   444.55   235.33  33.88  219.09  36.64  16.25   49.90  
1 1 1 4   -3  12 o 6  396.43  69.79  5489.76   1530.20  0.00     0.00     5489.76   1530.20  ?       ?      396.43  69.79  0.00    69.79  
1 1 1 4   -3  13 o 2  353.27  59.04  4141.85   1155.20  0.00     0.00     4141.85   1155.20  ?       ?      353.27  59.04  0.00    59.04  
1 1 1 4   -3  14 o 13 510.18  57.52  8403.26   1655.34  8546.48  2341.00  8260.05   2341.00  481.79  87.88  471.15  89.83  10.64   125.67 
1 1 1 4   -3  15 f 0  183.40  28.03  1008.33   285.78   0.00     0.00     1008.33   285.78   ?       ?      183.40  28.03  0.00    28.03  
1 1 1 4   -3  16 o 19 427.15  69.65  5914.95   1649.22  5914.95  1649.22  0.00      0.00     427.15  69.65  ?       ?      0.00    69.65  
1 1 1 4   -3  17 o 16 227.54  34.51  1553.93   436.61   1553.93  436.61   0.00      0.00     227.54  34.51  ?       ?      0.00    34.51  
1 1 1 4   -3  18 o 2  355.78  37.07  3778.70   745.94   3793.71  1054.83  3763.68   1055.01  349.10  54.41  347.55  54.68  1.54    77.14  
1 1 1 4   -3  19 o 5  424.20  45.25  5508.35   1084.99  5734.18  1534.48  5282.55   1534.34  419.13  65.95  399.48  69.42  19.65   95.76  
1 1 1 4   -3  20 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   -3  21 o 14 99.93   13.92  293.89    77.68    310.30   108.28   276.49    111.50   101.74  19.24  95.66   20.89  6.08    28.40  
1 1 1 4   -3  22 o 18 214.72  22.78  1359.47   276.50   1352.34  390.96   1366.61   391.08   211.05  33.38  212.25  33.18  -1.20   47.06  
1 1 1 4   -3  23 o 10 220.17  34.67  1487.73   423.70   0.00     0.00     1487.73   423.70   ?       ?      220.17  34.67  0.00    34.67  
1 1 1 4   -3  24 o 10 130.87  15.50  504.69    114.19   520.41   160.22   488.46    162.80   131.28  22.04  126.77  23.23  4.51    32.02  
1 1 1 4   -3  25 o 2  61.74   20.69  106.70    86.33    0.00     0.00     106.70    86.33    ?       ?      61.74   20.69  0.00    20.69  
1 1 1 4   -3  26 o 5  372.07  86.43  6475.45   1810.66  0.00     0.00     6475.45   1810.66  ?       ?      372.07  86.43  0.00    86.43  
1 1 1 4   -3  27 o 12 194.92  22.39  1159.05   245.95   1113.56  345.75   1205.66   349.95   184.35  33.92  192.73  32.80  -8.38   47.19  
1 1 1 4   -3  28 o 1  54.82   20.34  73.45     85.18    62.42    124.50   83.15     116.79   59.52   23.89  61.09   23.55  -1.57   33.55  
1 1 1 4   -3  29 o 10 223.48  42.75  1826.49   528.50   1826.49  528.50   0.00      0.00     223.48  42.75  ?       ?      0.00    42.75  
1 1 1 4   -3  30 o 19 156.44  31.48  838.45    272.92   838.45   272.92   0.00      0.00     156.44  31.48  ?       ?      0.00    31.48  
1 1 1 4   -3  31 f 0  72.73   24.46  166.35    120.74   0.00     0.00     166.35    120.74   ?       ?      72.73   24.46  0.00    24.46  
1 1 1 4   -2  0  o 17 450.57  71.71  6436.46   1792.77  0.00     0.00     6436.46   1792.77  ?       ?      450.57  71.71  0.00    71.71  
1 1 1 4   -2  1  o 16 803.60  92.92  21345.13  4207.65  22275.06 5950.52  20415.20  5950.52  760.83  141.45 716.58  149.50 44.25   205.81 
1 1 1 4   -2  2  o 11 266.27  27.25  2081.12   410.72   2168.70  580.80   1993.50   580.90   268.97  38.73  257.10  40.71  11.87   56.19  
1 1 1 4   -2  3  f 0  400.82  62.79  5016.05   1397.35  5016.05  1397.35  0.00      0.00     400.82  62.79  ?       ?      0.00    62.79  
1 1 1 4   -2  4  o 18 414.50  65.48  5407.29   1506.35  5407.29  1506.35  0.00      0.00     414.50  65.48  ?       ?      0.00    65.48  
1 1 1 4   -2  5  f 0  725.31  150.50 21764.47  6060.91  21764.47 6060.91  0.00      0.00     725.31  150.50 ?       ?      0.00    150.50 
1 1 1 4   -2  6  o 9  388.88  40.61  4532.08   893.31   4642.78  1263.31  4421.37   1263.35  385.08  59.03  374.69  60.82  10.39   84.75  
1 1 1 4   -2  7  o 9  347.93  54.58  3782.65   1054.25  0.00     0.00     3782.65   1054.25  ?       ?      347.93  54.58  0.00    54.58  
1 1 1 4   -2  8  o 11 480.46  83.30  7949.26   2214.41  0.00     0.00     7949.26   2214.41  ?       ?      480.46  83.30  0.00    83.30  
1 1 1 4   -2  9  o 14 590.17  68.77  11567.19  2286.28  13295.08 3233.42  9839.57   3233.16  594.88  98.10  483.22  117.67 111.66  153.20 
1 1 1 4   -2  10 o 13 275.03  43.06  2356.34   657.52   2356.34  657.52   0.00      0.00     275.03  43.06  ?       ?      0.00    43.06  
1 1 1 4   -2  11 o 15 388.15  41.97  4665.32   920.26   4876.00  1301.45  4454.64   1301.45  382.03  61.42  361.87  65.04  20.16   89.46  
1 1 1 4   -2  12 f 0  442.29  49.31  6245.09   1230.81  6335.82  1740.63  6154.35   1740.62  419.94  74.95  412.21  76.37  7.74    107.01 
1 1 1 4   -2  13 o 10 169.33  25.94  864.14    244.12   0.00     0.00     864.14    244.12   ?       ?      169.33  25.94  0.00    25.94  
1 1 1 4   -2  14 o 7  315.53  51.17  3207.48   895.18   0.00     0.00     3207.48   895.18   ?       ?      315.53  51.17  0.00    51.17  
1 1 1 4   -2  15 o 13 708.39  92.64  18674.13  3676.98  19350.34 5200.09  17997.96  5199.99  615.19  148.87 578.66  153.88 36.53   214.11 
1 1 1 4   -2  16 o 6  509.97  55.95  8173.36   1611.06  8029.02  2278.30  8317.72   2278.46  479.16  85.99  489.75  84.07  -10.59  120.25 
1 1 1 4   -2  17 o 19 132.82  20.75  523.11    153.05   523.11   153.05   0.00      0.00     132.82  20.75  ?       ?      0.00    20.75  
1 1 1 4   -2  18 o 8  621.45  117.60 14508.92  4041.93  14508.92 4041.93  0.00      0.00     621.45  117.60 ?       ?      0.00    117.60 
1 1 1 4   -2  19 o 7  393.29  63.49  4962.24   1384.54  4962.24  1384.54  0.00      0.00     393.29  63.49  ?       ?      0.00    63.49  
1 1 1 4   -2  20 o 10 415.40  70.57  5816.79   1622.80  0.00     0.00     5816.79   1622.80  ?       ?      415.40  70.57  0.00    70.57  
1 1 1 4   -2  21 o 6  587.46  69.50  11677.44  2298.57  11910.95 3250.68  11443.94  3250.65  539.13  108.79 523.82  111.52 15.31   155.79 
1 1 1 4   -2  22 o 7  474.92  52.16  7110.00   1398.63  7415.87  1977.96  6804.12   1977.96  462.27  77.26  438.12  81.65  24.15   112.41 
1 1 1 4   -2  23 o 6  225.94  23.90  1510.60   305.25   1445.85  430.92   1575.82   432.45   217.05  35.83  227.42  34.18  -10.37  49.52  
1 1 1 4   -2  24 o 7  192.73  30.71  1138.62   328.39   0.00     0.00     1138.62   328.39   ?       ?      192.73  30.71  0.00    30.71  
1 1 1 4   -2  25 o 5  128.16  15.59  485.52    112.37   429.77   159.86   539.96    157.98   118.12  24.38  133.71  21.30  -15.58  32.37  
1 1 1 4   -2  26 o 16 221.41  37.47  1588.55   459.29   0.00     0.00     1588.55   459.29   ?       ?      221.41  37.47  0.00    37.47  
1 1 1 4   -2  27 o 14 267.02  49.07  2557.13   724.45   0.00     0.00     2557.13   724.45   ?       ?      267.02  49.07  0.00    49.07  
1 1 1 4   -2  28 o 19 196.31  35.03  1289.68   380.25   1289.68  380.25   0.00      0.00     196.31  35.03  ?       ?      0.00    35.03  
1 1 1 4   -2  29 o 11 121.92  18.52  455.53    125.53   396.89   176.20   515.97    178.88   109.76  27.91  126.66  25.48  -16.90  37.79  
1 1 1 4   -2  30 o 19 102.63  27.37  351.66    164.16   351.66   164.16   0.00      0.00     102.63  27.37  ?       ?      0.00    27.37  
1 1 1 4   -2  31 f 0  84.16   26.95  235.72    147.25   235.72   147.25   0.00      0.00     84.16   26.95  ?       ?      0.00    26.95  
1 1 1 4   -1  0  o 4  562.03  93.84  10488.97  2921.09  0.00     0.00     10488.97  2921.09  ?       ?      562.03  93.84  0.00    93.84  
1 1 1 4   -1  1  o 12 389.59  60.45  4695.88   1308.11  0.00     0.00     4695.88   1308.11  ?       ?      389.59  60.45  0.00    60.45  
1 1 1 4   -1  2  o 2  284.99  29.17  2386.60   470.53   2441.19  665.42   2332.01   665.44   284.88  41.94  277.96  43.10  6.91    60.14  
1 1 1 4   -1  3  o 17 229.59  23.40  1541.95   304.13   1554.18  430.09   1529.71   430.12   228.24  33.85  226.32  34.17  1.92    48.10  
1 1 1 4   -1  4  o 10 572.18  97.30  11065.49  3081.76  11065.49 3081.76  0.00      0.00     572.18  97.30  ?       ?      0.00    97.30  
1 1 1 4   -1  5  o 1  829.36  214.90 37038.31  10313.78 37038.31 10313.78 0.00      0.00     829.36  214.90 ?       ?      0.00    214.90 
1 1 1 4   -1  6  o 9  8.78    4.33   -17.19    7.83     -17.19   7.83     0.00      0.00     8.78    4.33   ?       ?      0.00    4.33   
1 1 1 4   -1  7  o 9  316.11  32.30  2959.69   577.86   1.43     816.30   5931.23   818.13   133.69  57.86  448.68  31.97  -314.99 66.10  
1 1 1 4   -1  8  o 15 422.42  44.69  5417.40   1067.32  5434.88  1509.35  5399.90   1509.50  410.41  66.33  408.88  66.60  1.53    93.99  
1 1 1 4   -1  9  o 6  448.64  48.27  6211.34   1223.62  6182.01  1730.42  6240.67   1730.51  429.75  72.73  432.17  72.30  -2.42   102.56 
1 1 1 4   -1  10 o 7  186.97  19.21  1025.98   203.30   1026.92  287.34   1025.03   287.67   184.86  27.95  184.67  28.01  0.19    39.57  
1 1 1 4   -1  11 o 11 379.89  40.79  4442.92   875.69   4529.18  1238.35  4356.65   1238.48  369.61  60.45  361.19  61.96  8.42    86.56  
1 1 1 4   -1  12 o 11 367.27  39.50  4158.78   819.82   4568.36  1159.50  3749.33   1159.30  373.08  55.85  331.75  63.18  41.32   84.33  
1 1 1 4   -1  13 o 11 310.31  32.86  2921.47   576.54   3182.98  815.72   2660.43   814.99   316.13  46.32  285.23  51.68  30.91   69.40  
1 1 1 4   -1  14 o 1  288.43  46.29  2653.57   740.59   0.00     0.00     2653.57   740.59   ?       ?      288.43  46.29  0.00    46.29  
1 1 1 4   -1  15 o 12 150.84  23.01  680.46    192.96   0.00     0.00     680.46    192.96   ?       ?      150.84  23.01  0.00    23.01  
1 1 1 4   -1  16 f 0  174.21  18.09  889.32    178.28   1007.27  253.40   773.70    250.88   184.04  24.60  159.94  28.36  24.10   37.55  
1 1 1 4   -1  17 o 5  319.20  49.89  3165.17   884.31   3165.17  884.31   0.00      0.00     319.20  49.89  ?       ?      0.00    49.89  
1 1 1 4   -1  18 o 6  290.81  44.77  2584.77   723.48   2584.77  723.48   0.00      0.00     290.81  44.77  ?       ?      0.00    44.77  
1 1 1 4   -1  19 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   -1  20 o 17 537.19  103.21 11005.94  3067.23  11005.94 3067.23  0.00      0.00     537.19  103.21 ?       ?      0.00    103.21 
1 1 1 4   -1  21 o 15 186.25  19.81  1020.72   208.57   915.76   296.09   1124.09   293.86   173.29  30.90  193.59  27.19  -20.29  41.16  
1 1 1 4   -1  22 o 2  438.04  47.84  6004.06   1183.56  6132.57  1674.32  5875.71   1673.29  422.68  71.55  411.78  73.48  10.90   102.56 
1 1 1 4   -1  23 o 11 228.97  24.22  1551.55   313.53   1614.52  446.08   1490.08   440.76   230.08  34.86  220.41  36.08  9.67    50.17  
1 1 1 4   -1  24 f 0  298.97  31.81  2707.74   537.53   2760.58  761.01   2655.13   759.35   293.50  46.73  287.10  47.75  6.40    66.81  
1 1 1 4   -1  25 o 15 250.60  26.75  1900.03   378.84   2030.65  538.04   1771.59   533.51   252.78  38.27  234.07  41.21  18.71   56.24  
1 1 1 4   -1  26 o 13 197.64  21.79  1173.63   243.13   1184.35  344.00   1162.94   343.67   193.79  32.04  191.83  32.36  1.96    45.54  
1 1 1 4   -1  27 o 12 136.94  25.66  586.71    194.32   0.00     0.00     586.71    194.32   ?       ?      136.94  25.66  0.00    25.66  
1 1 1 4   -1  28 o 19 64.14   23.18  109.62    109.54   0.00     0.00     109.62    109.54   ?       ?      64.14   23.18  0.00    23.18  
1 1 1 4   -1  29 o 18 155.02  28.73  785.40    246.25   0.00     0.00     785.40    246.25   ?       ?      155.02  28.73  0.00    28.73  
1 1 1 4   -1  30 o 6  101.68  18.76  322.18    105.46   323.99   146.41   320.22    152.05   99.23   25.55  98.36   26.38  0.87    36.73  
1 1 1 4   -1  31 o 9  81.98   21.83  218.66    104.59   198.57   148.88   238.22    146.95   78.68   27.15  84.54   26.91  -5.86   38.23  
1 1 1 4   0   0  o 5  567.12  94.69  10679.61  2974.15  0.00     0.00     10679.61  2974.15  ?       ?      567.12  94.69  0.00    94.69  
1 1 1 4   0   1  o 18 637.47  111.25 14088.27  3923.29  0.00     0.00     14088.27  3923.29  ?       ?      637.47  111.25 0.00    111.25 
1 1 1 4   0   2  o 15 523.24  55.42  8314.09   1639.48  9077.86  2318.61  7550.38   2318.52  533.49  78.01  479.82  87.39  53.67   117.15 
1 1 1 4   0   3  o 1  465.78  48.85  6527.23   1286.84  6787.19  1819.88  6267.27   1819.85  464.13  70.52  443.72  74.05  20.41   102.26 
1 1 1 4   0   4  o 19 333.78  51.09  3401.77   947.83   3401.77  947.83   0.00      0.00     333.78  51.09  ?       ?      0.00    51.09  
1 1 1 4   0   5  o 8  622.69  110.46 13659.90  3804.14  13659.90 3804.14  0.00      0.00     622.69  110.46 ?       ?      0.00    110.46 
1 1 1 4   0   6  o 4  7.34    2.97   0.63      1.94     0.63     1.94     0.00      0.00     7.34    2.97   ?       ?      0.00    2.97   
1 1 1 4   0   7  o 2  231.03  23.26  1563.93   304.31   -26.94   429.47   3168.08   431.26   97.20   42.02  329.69  22.93  -232.49 47.87  
1 1 1 4   0   8  f 0  545.63  59.57  9321.87   1835.72  9065.13  2596.05  9578.64   2596.15  510.69  91.93  528.27  88.75  -17.58  127.78 
1 1 1 4   0   9  o 8  578.67  65.00  10778.16  2122.01  11492.88 3001.02  10063.48  3000.92  564.49  96.04  517.75  104.57 46.74   141.98 
1 1 1 4   0   10 o 6  346.67  36.48  3630.56   715.07   3862.70  1011.28  3398.43   1011.25  349.20  52.03  324.65  56.30  24.55   76.66  
1 1 1 4   0   11 o 19 220.64  22.76  1437.89   284.14   1433.42  401.76   1442.36   401.91   216.92  33.33  217.65  33.22  -0.73   47.06  
1 1 1 4   0   12 o 8  476.90  53.88  7364.35   1449.39  7976.35  2049.83  6752.43   2049.68  468.38  79.05  419.71  87.89  48.67   118.21 
1 1 1 4   0   13 o 5  165.58  25.34  826.36    233.21   0.00     0.00     826.36    233.21   ?       ?      165.58  25.34  0.00    25.34  
1 1 1 4   0   14 o 1  252.57  26.32  1905.91   376.01   2097.95  531.83   1713.97   531.68   260.63  36.55  232.93  41.27  27.70   55.13  
1 1 1 4   0   15 o 1  118.04  18.56  414.92    121.63   0.00     0.00     414.92    121.63   ?       ?      118.04  18.56  0.00    18.56  
1 1 1 4   0   16 o 19 566.88  129.28 14767.35  4113.42  0.00     0.00     14767.35  4113.42  ?       ?      566.88  129.28 0.00    129.28 
1 1 1 4   0   17 o 9  447.02  47.88  6155.51   1209.64  6733.74  1710.90  5577.57   1710.49  453.17  67.85  405.27  76.32  47.90   102.12 
1 1 1 4   0   18 o 13 315.70  49.06  3080.15   860.25   3080.15  860.25   0.00      0.00     315.70  49.06  ?       ?      0.00    49.06  
1 1 1 4   0   19 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   0   20 o 9  197.71  30.33  1175.38   333.28   1175.38  333.28   0.00      0.00     197.71  30.33  ?       ?      0.00    30.33  
1 1 1 4   0   21 o 7  213.29  33.06  1384.95   391.69   1384.95  391.69   0.00      0.00     213.29  33.06  ?       ?      0.00    33.06  
1 1 1 4   0   22 o 17 99.41   13.34  290.59    74.21    310.36   103.96   270.06    105.97   101.81  18.47  94.53   20.14  7.28    27.33  
1 1 1 4   0   23 o 12 220.89  23.23  1442.28   290.17   1508.67  410.02   1375.67   410.71   222.82  33.05  211.90  34.98  10.93   48.13  
1 1 1 4   0   24 o 6  65.75   15.85  130.36    59.11    104.21   82.42    158.07    84.83    61.12   20.21  72.45   19.82  -11.34  28.31  
1 1 1 4   0   25 o 9  350.85  39.19  3888.47   775.88   3653.29  1097.17  4123.72   1097.34  319.52  62.05  344.64  57.49  -25.12  84.59  
1 1 1 4   0   26 o 9  175.70  20.29  924.43    200.90   843.59   283.11   1006.43   285.12   163.26  31.35  180.01  28.54  -16.75  42.39  
1 1 1 4   0   27 o 13 311.87  35.69  3145.50   627.56   3100.11  887.90   3190.80   887.12   288.19  55.68  293.77  54.61  -5.58   78.00  
1 1 1 4   0   28 o 5  195.75  34.59  1275.76   374.52   0.00     0.00     1275.76   374.52   ?       ?      195.75  34.59  0.00    34.59  
1 1 1 4   0   29 o 17 92.44   24.53  275.36    132.31   0.00     0.00     275.36    132.31   ?       ?      92.44   24.53  0.00    24.53  
1 1 1 4   0   30 o 2  73.64   24.40  168.24    120.19   0.00     0.00     168.24    120.19   ?       ?      73.64   24.40  0.00    24.40  
1 1 1 4   0   31 o 4  175.37  21.71  976.15    213.88   990.42   307.97   962.86    297.24   166.56  33.37  164.97  32.54  1.59    46.61  
1 1 1 4   0   32 o 6  178.38  22.86  1035.73   228.70   995.83   330.25   1072.50   317.01   160.77  36.61  170.74  33.54  -9.96   49.65  
1 1 1 4   1   0  o 4  366.04  56.36  4115.44   1146.42  0.00     0.00     4115.44   1146.42  ?       ?      366.04  56.36  0.00    56.36  
1 1 1 4   1   1  o 13 523.04  55.29  8305.24   1635.02  8227.62  2312.25  8382.86   2312.28  504.50  82.70  509.96  81.75  -5.45   116.28 
1 1 1 4   1   2  o 16 401.21  41.65  4793.52   945.26   5037.34  1336.81  4549.70   1336.78  404.24  59.37  382.15  63.14  22.10   86.67  
1 1 1 4   1   3  o 17 464.74  48.71  6498.68   1280.31  6549.71  1810.62  6447.65   1810.64  455.01  71.69  451.00  72.38  4.02    101.87 
1 1 1 4   1   4  o 19 391.89  61.07  4771.34   1329.14  4771.34  1329.14  0.00      0.00     391.89  61.07  ?       ?      0.00    61.07  
1 1 1 4   1   5  o 10 8.27    4.08   -15.99    7.07     -15.99   7.07     0.00      0.00     8.27    4.08   ?       ?      0.00    4.08   
1 1 1 4   1   6  o 19 7.05    2.89   0.47      1.86     0.47     1.86     0.00      0.00     7.05    2.89   ?       ?      0.00    2.89   
1 1 1 4   1   7  o 11 536.64  57.98  8913.43   1757.74  9492.00  2485.85  8334.87   2485.80  534.23  83.81  494.19  90.97  40.04   123.69 
1 1 1 4   1   8  o 19 407.03  42.84  5002.98   986.03   5074.65  1394.44  4931.29   1394.47  399.15  62.94  392.70  64.06  6.45    89.81  
1 1 1 4   1   9  o 12 635.61  73.58  13360.80  2635.43  13892.21 3727.07  12829.40  3727.06  600.09  112.32 568.12  118.13 31.98   163.01 
1 1 1 4   1   10 o 4  344.16  36.22  3575.44   704.93   3606.69  996.88   3544.18   996.97   336.52  53.38  333.19  53.97  3.33    75.91  
1 1 1 4   1   11 o 2  278.93  29.06  2324.37   458.43   2314.30  648.23   2334.44   648.41   272.31  42.88  273.62  42.67  -1.31   60.50  
1 1 1 4   1   12 f 0  115.85  12.08  391.66    79.16    380.11   111.36   403.45    112.55   113.04  17.75  116.61  17.34  -3.58   24.81  
1 1 1 4   1   13 o 6  109.35  11.50  349.01    71.13    350.68   100.31   347.32    100.89   108.66  16.61  108.09  16.81  0.58    23.63  
1 1 1 4   1   14 o 11 165.91  17.20  808.96    161.43   870.50   228.98   748.14    227.62   170.36  24.08  157.10  26.16  13.26   35.56  
1 1 1 4   1   15 o 5  90.29   14.71  242.12    73.63    0.00     0.00     242.12    73.63    ?       ?      90.29   14.71  0.00    14.71  
1 1 1 4   1   16 o 9  421.97  74.59  6246.39   1740.83  0.00     0.00     6246.39   1740.83  ?       ?      421.97  74.59  0.00    74.59  
1 1 1 4   1   17 o 8  392.61  64.85  5059.59   1410.60  0.00     0.00     5059.59   1410.60  ?       ?      392.61  64.85  0.00    64.85  
1 1 1 4   1   18 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   1   19 o 16 164.97  17.33  795.19    161.67   740.94   228.07   849.98    229.21   157.39  26.16  169.25  24.29  -11.86  35.70  
1 1 1 4   1   20 o 11 373.48  60.47  4486.69   1252.11  4486.69  1252.11  0.00      0.00     373.48  60.47  ?       ?      0.00    60.47  
1 1 1 4   1   21 o 6  148.04  23.45  656.28    192.65   656.28   192.65   0.00      0.00     148.04  23.45  ?       ?      0.00    23.45  
1 1 1 4   1   22 o 2  304.62  32.22  2800.82   554.89   2816.24  784.92   2785.42   784.54   297.31  47.59  295.47  47.89  1.84    67.52  
1 1 1 4   1   23 o 1  240.52  37.79  1783.37   504.53   1783.37  504.53   0.00      0.00     240.52  37.79  ?       ?      0.00    37.79  
1 1 1 4   1   24 o 11 93.52   14.49  259.03    75.27    210.18   106.20   308.33    106.68   83.24   21.92  101.29  19.05  -18.05  29.04  
1 1 1 4   1   25 o 4  206.41  22.46  1272.37   261.87   1194.86  374.08   1346.86   366.70   194.93  34.70  208.68  31.60  -13.76  46.93  
1 1 1 4   1   26 o 8  293.65  32.47  2699.21   538.20   2697.65  763.79   2700.76   758.48   279.38  49.43  279.97  48.98  -0.59   69.59  
1 1 1 4   1   27 o 18 43.92   18.77  1.75      83.83    40.09    123.13   -31.37    114.46   57.01   23.43  47.54   21.08  9.47    31.52  
1 1 1 4   1   28 o 12 199.43  22.97  1225.29   258.16   1207.64  368.40   1242.33   361.87   189.89  35.09  193.64  33.78  -3.75   48.71  
1 1 1 4   1   29 f 0  194.37  35.94  1306.39   386.26   0.00     0.00     1306.39   386.26   ?       ?      194.37  35.94  0.00    35.94  
1 1 1 4   1   30 o 7  125.72  27.77  528.06    195.06   0.00     0.00     528.06    195.06   ?       ?      125.72  27.77  0.00    27.77  
1 1 1 4   1   31 o 1  221.82  27.35  1640.70   340.89   1637.09  486.16   1644.20   478.12   202.00  43.23  203.84  42.25  -1.85   60.45  
1 1 1 4   1   32 o 10 66.97   22.83  141.63    105.15   182.52   165.48   113.95    136.17   75.92   28.32  65.20   25.35  10.72   38.01  
1 1 1 4   2   0  o 17 764.03  86.37  18939.26  3722.04  18297.15 5263.73  19581.38  5263.80  695.19  136.77 727.11  130.92 -31.93  189.33 
1 1 1 4   2   1  o 3  439.51  45.94  5790.20   1141.95  5948.31  1614.95  5632.08   1614.96  435.84  66.66  422.71  68.92  13.13   95.89  
1 1 1 4   2   2  o 8  96.53   9.93   270.72    54.24    280.38   76.65    261.03    76.76    97.68   14.07  94.09   14.69  3.60    20.34  
1 1 1 4   2   3  o 15 305.13  46.39  2824.22   786.97   2824.22  786.97   0.00      0.00     305.13  46.39  ?       ?      0.00    46.39  
1 1 1 4   2   4  o 8  506.03  83.09  8365.97   2330.04  8365.97  2330.04  0.00      0.00     506.03  83.09  ?       ?      0.00    83.09  
1 1 1 4   2   5  o 6  6.81    2.74   0.58      1.64     0.58     1.64     0.00      0.00     6.81    2.74   ?       ?      0.00    2.74   
1 1 1 4   2   6  o 2  9.27    4.62   -25.65    9.83     -25.65   9.83     0.00      0.00     9.27    4.62   ?       ?      0.00    4.62   
1 1 1 4   2   7  o 7  510.70  54.88  8041.44   1583.75  8035.81  2239.73  8047.07   2239.79  490.62  82.44  491.03  82.37  -0.41   116.54 
1 1 1 4   2   8  o 2  352.45  36.78  3717.57   733.16   3783.97  1036.83  3651.17   1036.86  348.00  53.62  341.13  54.80  6.87    76.67  
1 1 1 4   2   9  o 18 470.11  50.93  6863.84   1352.63  6973.40  1912.90  6754.27   1912.92  454.18  76.05  445.50  77.62  8.67    108.67 
1 1 1 4   2   10 o 8  223.46  23.02  1473.29   291.07   1518.90  411.63   1427.68   411.64   223.85  33.02  216.47  34.26  7.38    47.59  
1 1 1 4   2   11 o 2  346.91  36.86  3666.13   722.92   3755.99  1022.37  3576.28   1022.36  340.51  54.11  330.98  55.79  9.54    77.72  
1 1 1 4   2   12 o 17 118.91  12.36  412.81    83.11    414.68   117.34   410.92    117.74   118.13  17.86  117.54  18.02  0.58    25.37  
1 1 1 4   2   13 o 19 238.36  24.83  1693.84   334.85   1736.43  473.52   1651.23   473.58   236.78  35.97  230.27  37.08  6.50    51.66  
1 1 1 4   2   14 o 8  198.22  20.63  1161.73   231.28   1322.48  327.63   1002.06   326.53   209.22  27.98  179.95  32.82  29.26   43.13  
1 1 1 4   2   15 f 0  308.96  32.76  2895.86   572.20   3067.57  809.36   2724.29   809.05   309.78  46.98  289.39  50.54  20.40   69.00  
1 1 1 4   2   16 o 1  568.27  148.30 17551.50  4888.53  0.00     0.00     17551.50  4888.53  ?       ?      568.27  148.30 0.00    148.30 
1 1 1 4   2   17 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   2   18 o 19 138.33  21.27  567.99    163.47   0.00     0.00     567.99    163.47   ?       ?      138.33  21.27  0.00    21.27  
1 1 1 4   2   19 o 18 701.96  83.01  16656.63  3280.57  16838.15 4639.47  16475.10  4639.39  640.53  130.61 630.57  132.39 9.95    185.97 
1 1 1 4   2   20 o 8  552.11  106.57 11682.87  3255.25  11682.87 3255.25  0.00      0.00     552.11  106.57 ?       ?      0.00    106.57 
1 1 1 4   2   21 o 3  179.36  28.01  970.75    279.02   970.75   279.02   0.00      0.00     179.36  28.01  ?       ?      0.00    28.01  
1 1 1 4   2   22 o 15 443.57  83.88  7377.89   2057.63  7377.89  2057.63  0.00      0.00     443.57  83.88  ?       ?      0.00    83.88  
1 1 1 4   2   23 o 2  274.50  28.97  2255.38   449.68   2227.35  636.47   2283.32   635.43   266.46  43.08  270.21  42.35  -3.76   60.41  
1 1 1 4   2   24 o 3  233.99  25.08  1630.83   331.70   1555.44  466.75   1707.77   471.48   223.54  37.71  235.19  36.07  -11.65  52.18  
1 1 1 4   2   25 o 13 105.45  24.57  343.13    145.98   343.13   145.98   0.00      0.00     105.45  24.57  ?       ?      0.00    24.57  
1 1 1 4   2   26 o 18 200.96  21.99  1216.08   249.59   1277.79  358.09   1157.78   348.08   201.06  32.10  190.73  32.98  10.33   46.03  
1 1 1 4   2   27 o 16 276.21  51.39  2774.96   784.91   2774.96  784.91   0.00      0.00     276.21  51.39  ?       ?      0.00    51.39  
1 1 1 4   2   28 o 5  51.98   18.89  68.56     72.90    121.07   126.18   42.25     89.31    67.69   24.82  50.52   20.25  17.17   32.03  
1 1 1 4   2   29 o 12 175.88  20.86  956.05    206.53   901.83   300.40   1004.64   284.41   162.32  33.35  174.61  29.42  -12.29  44.47  
1 1 1 4   2   30 f 0  65.06   22.62  124.69    103.38   0.00     0.00     124.69    103.38   ?       ?      65.06   22.62  0.00    22.62  
1 1 1 4   2   31 o 18 71.08   25.84  152.00    136.34   0.00     0.00     152.00    136.34   ?       ?      71.08   25.84  0.00    25.84  
1 1 1 4   2   32 o 12 200.24  26.03  1361.53   292.10   1303.15  417.35   1417.59   408.96   174.82  42.09  187.08  39.33  -12.26  57.61  
1 1 1 4   3   0  o 5  277.63  42.00  2326.84   648.47   2326.84  648.47   0.00      0.00     277.63  42.00  ?       ?      0.00    42.00  
1 1 1 4   3   1  o 11 150.41  22.33  668.87    186.98   668.87   186.98   0.00      0.00     150.41  22.33  ?       ?      0.00    22.33  
1 1 1 4   3   2  o 12 275.56  41.68  2291.68   638.73   2291.68  638.73   0.00      0.00     275.56  41.68  ?       ?      0.00    41.68  
1 1 1 4   3   3  o 7  618.32  110.33 13546.04  3772.39  13546.04 3772.39  0.00      0.00     618.32  110.33 ?       ?      0.00    110.33 
1 1 1 4   3   4  o 3  8.73    4.34   -20.90    8.42     -20.90   8.42     0.00      0.00     8.73    4.34   ?       ?      0.00    4.34   
1 1 1 4   3   5  o 11 229.87  22.26  1545.48   290.01   0.44     409.33   3102.80   410.96   96.51   41.36  326.49  22.06  -229.98 46.87  
1 1 1 4   3   6  o 2  406.43  42.68  4972.76   980.88   5091.08  1387.15  4854.43   1387.19  401.34  62.22  390.69  64.07  10.65   89.31  
1 1 1 4   3   7  o 4  81.21   8.63   191.77    39.64    219.11   56.03    164.38    56.08    86.47   11.58  74.36   13.64  12.11   17.89  
1 1 1 4   3   8  o 14 248.14  25.53  1815.88   358.45   1852.34  506.90   1779.41   506.96   247.22  36.84  241.90  37.74  5.31    52.74  
1 1 1 4   3   9  o 13 514.01  57.24  8421.11   1660.32  8646.38  2348.04  8195.84   2348.05  492.24  86.24  475.72  89.26  16.52   124.11 
1 1 1 4   3   10 o 6  524.11  59.81  8963.87   1767.36  9159.11  2499.40  8768.62   2499.46  493.14  91.66  478.95  94.26  14.19   131.48 
1 1 1 4   3   11 o 1  561.63  67.12  10777.04  2121.23  10613.29 2999.83  10940.80  2999.92  499.02  107.87 510.27  105.88 -11.25  151.15 
1 1 1 4   3   12 o 12 110.16  11.50  354.11    71.63    365.90   101.19   342.27    101.40   111.11  16.35  107.24  17.04  3.86    23.62  
1 1 1 4   3   13 o 18 280.57  29.60  2375.79   469.56   2514.32  664.08   2237.27   664.03   281.92  42.34  263.83  45.49  18.09   62.14  
1 1 1 4   3   14 o 16 249.25  26.18  1859.40   368.97   2114.70  522.20   1604.89   521.40   261.66  35.69  224.36  42.03  37.29   55.14  
1 1 1 4   3   15 o 19 124.05  13.22  450.02    92.71    533.42   132.52   370.07    129.75   134.32  17.61  110.71  21.19  23.61   27.55  
1 1 1 4   3   16 o 2  190.36  29.04  1095.02   307.34   0.00     0.00     1095.02   307.34   ?       ?      190.36  29.04  0.00    29.04  
1 1 1 4   3   17 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   3   18 o 1  166.86  17.40  813.91    164.25   919.59   233.38   710.20    231.21   176.21  23.67  153.68  27.20  22.54   36.06  
1 1 1 4   3   19 o 14 75.29   10.76  166.46    45.19    173.33   68.47    161.15    60.15    76.03   16.18  73.43   14.78  2.60    21.92  
1 1 1 4   3   20 o 19 429.77  46.26  5696.21   1123.26  5819.15  1588.56  5573.28   1588.51  418.26  68.53  407.66  70.42  10.60   98.27  
1 1 1 4   3   21 o 13 271.91  43.11  2319.07   650.49   2319.07  650.49   0.00      0.00     271.91  43.11  ?       ?      0.00    43.11  
1 1 1 4   3   22 o 9  198.63  31.24  1204.77   344.43   1204.77  344.43   0.00      0.00     198.63  31.24  ?       ?      0.00    31.24  
1 1 1 4   3   23 o 1  257.62  27.11  1981.08   394.91   2107.59  558.82   1854.86   558.16   261.02  38.44  243.18  41.47  17.83   56.55  
1 1 1 4   3   24 o 11 82.55   18.86  206.47    87.40    160.50   119.82   258.74    127.76   74.86   24.34  92.06   23.95  -17.21  34.15  
1 1 1 4   3   25 o 19 146.67  18.10  639.00    149.13   546.60   210.74   731.68    211.06   132.35  28.58  155.08  24.52  -22.73  37.65  
1 1 1 4   3   26 o 13 99.60   24.71  310.36    140.62   310.36   140.62   0.00      0.00     99.60   24.71  ?       ?      0.00    24.71  
1 1 1 4   3   27 o 11 74.92   20.31  173.41    89.51    169.33   125.96   177.57    127.23   75.55   24.98  76.96   25.09  -1.41   35.40  
1 1 1 4   3   28 o 11 93.55   19.54  272.16    101.57   285.16   149.25   260.95    138.63   94.02   26.51  90.24   25.59  3.78    36.85  
1 1 1 4   3   29 o 13 94.54   19.16  279.73    100.42   381.06   150.52   198.46    134.80   108.26  24.76  79.29   25.82  28.97   35.77  
1 1 1 4   3   30 o 6  114.32  18.23  406.13    115.60   501.68   184.87   344.79    148.12   122.29  27.05  101.80  25.42  20.49   37.12  
1 1 1 4   3   31 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   3   32 o 4  125.52  26.80  552.60    187.21   0.00     0.00     552.60    187.21   ?       ?      125.52  26.80  0.00    26.80  
1 1 1 4   4   0  f 0  525.60  89.30  9328.76   2598.10  9328.76  2598.10  0.00      0.00     525.60  89.30  ?       ?      0.00    89.30  
1 1 1 4   4   1  o 16 446.15  46.89  6018.47   1183.00  5726.50  1672.96  6310.48   1673.06  421.51  71.70  445.51  67.53  -24.00  98.50  
1 1 1 4   4   2  f 0  297.33  30.59  2610.53   514.66   2661.02  727.82   2560.03   727.87   295.90  44.20  289.75  45.24  6.15    63.24  
1 1 1 4   4   3  o 6  459.34  48.58  6408.62   1261.55  6299.91  1784.07  6517.34   1784.14  440.98  73.03  449.68  71.51  -8.70   102.21 
1 1 1 4   4   4  o 5  148.74  14.41  643.70    121.50   0.29     170.87   1301.80   172.80   62.96   26.85  212.03  14.28  -149.06 30.41  
1 1 1 4   4   5  o 4  310.19  29.60  2840.59   520.70   -16.00   735.56   5709.86   737.19   126.34  54.80  440.82  29.30  -314.48 62.14  
1 1 1 4   4   6  o 17 572.22  63.52  10418.05  2051.60  10409.05 2901.36  10427.05  2901.45  539.16  97.32  539.75  97.22  -0.59   137.56 
1 1 1 4   4   7  f 0  369.97  39.03  4131.38   816.44   4345.01  1154.63  3917.75   1154.62  370.42  56.05  349.27  59.73  21.15   81.91  
1 1 1 4   4   8  o 4  121.16  12.47  427.83    85.53    435.52   120.82   420.10    121.10   121.32  17.88  119.02  18.31  2.30    25.59  
1 1 1 4   4   9  o 11 335.82  35.62  3414.63   676.16   3650.91  956.25   3178.37   956.23   338.84  50.72  313.02  55.23  25.82   74.99  
1 1 1 4   4   10 o 17 311.66  32.86  2934.74   579.12   2984.67  818.97   2884.81   819.04   305.99  48.22  300.12  49.25  5.88    68.92  
1 1 1 4   4   11 o 16 254.93  26.58  1941.60   383.27   1953.34  541.94   1929.86   542.11   250.33  38.98  248.64  39.28  1.68    55.34  
1 1 1 4   4   12 o 12 375.95  40.97  4416.62   870.03   4380.69  1230.33  4452.56   1230.47  356.63  62.36  360.19  61.73  -3.56   87.75  
1 1 1 4   4   13 o 7  126.05  13.14  464.68    93.67    492.11   132.19   437.02    132.75   128.66  18.42  120.77  19.84  7.89    27.07  
1 1 1 4   4   14 o 12 94.84   10.70  262.78    57.26    318.01   83.11    212.87    79.00    103.81  14.33  84.10   16.95  19.71   22.19  
1 1 1 4   4   15 o 7  446.79  85.16  7553.27   2104.55  0.00     0.00     7553.27   2104.55  ?       ?      446.79  85.16  0.00    85.16  
1 1 1 4   4   16 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   4   17 o 16 242.04  37.07  1783.23   498.72   0.00     0.00     1783.23   498.72   ?       ?      242.04  37.07  0.00    37.07  
1 1 1 4   4   18 o 18 518.14  57.02  8426.85   1668.13  9413.93  2359.38  7440.25   2358.82  527.10  80.52  455.91  93.27  71.19   123.22 
1 1 1 4   4   19 o 14 575.60  64.78  10670.16  2103.52  10821.62 2974.80  10518.70  2974.86  543.43  99.00  533.46  100.83 9.97    141.31 
1 1 1 4   4   20 o 7  229.96  23.90  1562.63   310.91   1521.54  439.71   1603.71   439.69   223.16  35.51  229.63  34.41  -6.47   49.45  
1 1 1 4   4   21 o 19 144.40  23.27  626.48    186.36   626.48   186.36   0.00      0.00     144.40  23.27  ?       ?      0.00    23.27  
1 1 1 4   4   22 o 5  171.07  27.36  887.16    259.68   887.16   259.68   0.00      0.00     171.07  27.36  ?       ?      0.00    27.36  
1 1 1 4   4   23 o 15 206.29  22.37  1260.78   260.65   1156.84  363.82   1370.39   373.60   193.66  33.96  212.05  31.66  -18.39  46.43  
1 1 1 4   4   24 o 19 69.55   18.19  146.22    73.43    165.14   92.95    114.80    119.76   74.06   20.94  67.43   24.26  6.63    32.04  
1 1 1 4   4   25 o 15 299.49  33.06  2792.73   559.01   2521.84  788.37   3066.65   792.76   269.04  52.93  302.59  47.18  -33.55  70.90  
1 1 1 4   4   26 o 9  199.01  22.30  1199.66   250.42   1094.77  351.80   1307.40   356.55   183.53  34.66  202.80  31.66  -19.27  46.94  
1 1 1 4   4   27 o 4  149.73  18.93  677.61    159.11   657.73   223.70   697.97    226.37   143.36  28.19  148.06  27.65  -4.70   39.48  
1 1 1 4   4   28 o 1  61.89   21.30  109.45    91.63    37.88    132.19   175.64    127.12   57.62   24.03  75.82   25.09  -18.19  34.75  
1 1 1 4   4   29 o 8  80.93   27.29  207.61    150.21   207.61   150.21   0.00      0.00     80.93   27.29  ?       ?      0.00    27.29  
1 1 1 4   4   30 o 10 349.06  72.29  7031.10   1400.91  6625.98  1981.54  7435.93   1980.84  211.16  90.75  234.24  94.84  -23.08  131.27 
1 1 1 4   4   31 o 3  128.10  29.40  583.15    211.61   0.00     0.00     583.15    211.61   ?       ?      128.10  29.40  0.00    29.40  
1 1 1 4   4   32 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   5   0  o 5  150.17  15.33  657.64    130.32   701.76   184.27   613.49    184.33   154.08  21.41  143.51  23.16  10.56   31.54  
1 1 1 4   5   1  o 7  267.64  27.61  2114.90   418.09   2316.20  591.31   1913.65   591.23   276.89  38.22  249.67  42.79  27.22   57.37  
1 1 1 4   5   2  o 12 321.50  33.35  3076.89   606.63   3109.89  857.89   3043.89   857.93   317.12  48.68  313.39  49.32  3.73    69.29  
1 1 1 4   5   3  o 18 21.62   7.06   12.89     10.09    -37.12   12.30    115.45    17.61    9.82    4.93   63.21   4.89   -53.39  6.95   
1 1 1 4   5   4  o 6  73.53   8.23   157.39    34.13    2.24     46.39    340.39    50.38    33.37   14.10  108.50  8.15   -75.14  16.28  
1 1 1 4   5   5  o 5  107.54  11.08  336.56    67.41    342.35   94.93    330.68    95.72    107.72  15.82  105.74  16.29  1.97    22.71  
1 1 1 4   5   6  o 12 601.13  69.88  11994.47  2366.68  12394.91 3346.99  11594.04  3347.00  563.84  107.32 538.33  111.96 25.51   155.09 
1 1 1 4   5   7  o 14 313.02  32.82  2942.72   580.93   2997.39  821.53   2888.03   821.59   308.61  47.93  302.23  49.03  6.38    68.56  
1 1 1 4   5   8  o 15 181.30  18.62  965.05    191.03   971.46   270.13   958.63    270.18   179.75  27.01  178.47  27.23  1.28    38.36  
1 1 1 4   5   9  o 4  161.45  16.57  764.14    151.43   761.23   214.03   767.04    214.29   159.31  24.16  159.95  24.08  -0.64   34.11  
1 1 1 4   5   10 o 4  133.26  13.73  519.18    103.50   513.98   146.18   524.41    146.57   131.25  20.04  132.65  19.86  -1.39   28.21  
1 1 1 4   5   11 o 10 252.40  26.50  1907.42   378.21   2020.16  534.85   1794.66   534.89   254.71  37.72  238.42  40.53  16.30   55.36  
1 1 1 4   5   12 o 12 207.26  21.53  1273.05   252.43   1321.63  356.90   1224.41   357.09   207.95  30.83  199.44  32.29  8.51    44.64  
1 1 1 4   5   13 f 0  413.65  46.60  5470.66   1087.39  6179.87  1538.04  4761.90   1537.56  419.97  65.97  355.43  77.54  64.54   101.81 
1 1 1 4   5   14 o 7  249.73  39.25  1948.16   544.16   0.00     0.00     1948.16   544.16   ?       ?      249.73  39.25  0.00    39.25  
1 1 1 4   5   15 o 2  102.21  16.02  309.90    90.92    0.00     0.00     309.90    90.92    ?       ?      102.21  16.02  0.00    16.02  
1 1 1 4   5   16 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   5   17 o 15 494.67  87.78  8618.52   2401.47  0.00     0.00     8618.52   2401.47  ?       ?      494.67  87.78  0.00    87.78  
1 1 1 4   5   18 o 9  233.49  24.20  1605.21   319.71   1749.98  452.88   1461.40   451.39   241.23  33.62  218.93  37.25  22.30   50.17  
1 1 1 4   5   19 o 13 710.87  88.40  17933.37  3529.87  17561.70 4991.86  18305.07  4992.11  611.11  144.57 631.33  141.28 -20.22  202.14 
1 1 1 4   5   20 o 14 255.56  40.10  2027.39   568.92   2027.39  568.92   0.00      0.00     255.56  40.10  ?       ?      0.00    40.10  
1 1 1 4   5   21 o 1  354.82  60.92  4283.98   1196.26  4283.98  1196.26  0.00      0.00     354.82  60.92  ?       ?      0.00    60.92  
1 1 1 4   5   22 o 14 342.76  57.96  3934.05   1099.81  3934.05  1099.81  0.00      0.00     342.76  57.96  ?       ?      0.00    57.96  
1 1 1 4   5   23 o 3  213.26  23.22  1351.25   279.71   1504.78  398.39   1202.00   392.81   221.93  32.21  196.38  36.18  25.55   48.44  
1 1 1 4   5   24 o 5  253.06  27.19  1932.95   388.85   1964.28  550.71   1901.79   549.13   248.45  39.97  244.01  40.63  4.44    56.99  
1 1 1 4   5   25 o 15 228.92  25.11  1593.19   324.62   1612.24  457.72   1573.92   460.46   223.43  36.98  220.19  37.79  3.25    52.87  
1 1 1 4   5   26 o 5  106.66  17.05  343.28    100.87   360.89   133.18   319.58    154.49   107.81  22.26  100.36  26.45  7.44    34.57  
1 1 1 4   5   27 o 2  100.52  17.42  308.08    96.85    240.53   127.47   400.34    148.97   87.12   24.48  112.54  23.80  -25.42  34.14  
1 1 1 4   5   28 o 18 61.27   19.58  113.03    77.78    101.76   99.20    131.02    125.33   61.17   22.07  68.48   24.79  -7.31   33.19  
1 1 1 4   5   29 o 15 165.48  20.70  856.80    192.39   744.22   265.19   981.87    279.52   145.63  32.54  170.47  29.64  -24.83  44.02  
1 1 1 4   5   30 o 12 124.85  18.92  489.93    131.38   425.80   177.47   567.70    195.42   110.88  27.91  129.03  27.24  -18.15  39.00  
1 1 1 4   5   31 o 13 81.62   27.96  230.38    157.79   0.00     0.00     230.38    157.79   ?       ?      81.62   27.96  0.00    27.96  
1 1 1 4   5   32 o 17 101.11  29.95  391.31    186.18   0.00     0.00     391.31    186.18   ?       ?      101.11  29.95  0.00    29.95  
1 1 1 4   6   0  o 13 400.39  42.77  4914.27   967.96   5031.11  1368.90  4797.44   1368.90  391.47  63.06  380.69  64.97  10.78   90.54  
1 1 1 4   6   1  o 14 256.71  26.52  1952.65   385.18   2001.90  544.72   1903.40   544.75   255.82  38.26  248.87  39.44  6.96    54.95  
1 1 1 4   6   2  o 15 447.80  48.64  6243.59   1230.29  6348.13  1739.88  6139.04   1739.89  432.17  72.71  423.47  74.28  8.70    103.94 
1 1 1 4   6   3  o 10 318.98  31.76  3042.68   573.93   2.69     810.78   6095.85   812.53   130.79  57.12  452.63  31.47  -321.84 65.21  
1 1 1 4   6   4  o 19 51.01   6.74   76.11     19.25    -13.51   25.16    202.56    29.89    21.41   9.66   83.72   6.26   -62.31  11.51  
1 1 1 4   6   5  o 2  399.82  43.09  4931.15   973.35   5101.57  1376.52  4760.72   1376.54  391.97  63.33  376.17  66.16  15.80   91.59  
1 1 1 4   6   6  o 14 180.71  18.63  958.98    190.46   1049.60  269.25   868.22    269.45   187.33  25.72  169.20  28.77  18.12   38.59  
1 1 1 4   6   7  o 13 482.76  54.60  7545.44   1486.52  7573.32  2102.21  7517.55   2102.30  451.17  84.26  448.97  84.67  2.20    119.46 
1 1 1 4   6   8  o 12 251.85  26.30  1892.44   374.71   1994.64  529.90   1790.23   529.94   253.93  37.48  239.16  40.01  14.77   54.82  
1 1 1 4   6   9  o 19 160.28  16.43  753.88    149.01   719.76   210.53   788.14    210.93   154.52  24.55  162.20  23.32  -7.68   33.86  
1 1 1 4   6   10 o 1  397.10  44.20  4989.86   990.59   5375.23  1401.02  4604.62   1400.79  393.48  64.24  357.07  70.84  36.41   95.63  
1 1 1 4   6   11 o 19 113.20  12.30  374.73    78.62    450.60   112.64   302.65    109.80   123.49  16.29  100.07  19.81  23.41   25.65  
1 1 1 4   6   12 o 8  341.50  37.21  3601.76   717.70   3980.86  1015.16  3222.91   1014.82  347.87  52.46  306.74  59.78  41.14   79.54  
1 1 1 4   6   13 o 3  130.71  19.94  509.78    144.86   0.00     0.00     509.78    144.86   ?       ?      130.71  19.94  0.00    19.94  
1 1 1 4   6   14 o 18 148.54  22.55  659.77    186.27   0.00     0.00     659.77    186.27   ?       ?      148.54  22.55  0.00    22.55  
1 1 1 4   6   15 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   6   16 o 19 518.67  95.54  9834.48   2739.95  0.00     0.00     9834.48   2739.95  ?       ?      518.67  95.54  0.00    95.54  
1 1 1 4   6   17 o 3  334.89  35.30  3358.41   668.42   3658.17  945.72   3059.20   944.86   343.22  49.42  310.62  55.00  32.60   73.94  
1 1 1 4   6   18 o 17 90.02   12.12  237.74    61.07    243.56   86.96    232.08    85.79    90.24   17.42  88.01   17.60  2.23    24.76  
1 1 1 4   6   19 f 0  534.85  61.15  9353.99   1843.75  9376.55  2607.39  9331.43   2607.52  496.18  95.00  494.56  95.30  1.61    134.56 
1 1 1 4   6   20 o 17 446.50  86.27  7645.09   2131.25  7645.09  2131.25  0.00      0.00     446.50  86.27  ?       ?      0.00    86.27  
1 1 1 4   6   21 o 7  386.03  69.51  5316.07   1483.71  5316.07  1483.71  0.00      0.00     386.03  69.51  ?       ?      0.00    69.51  
1 1 1 4   6   22 o 15 168.05  27.19  856.30    253.32   856.30   253.32   0.00      0.00     168.05  27.19  ?       ?      0.00    27.19  
1 1 1 4   6   23 o 9  165.53  19.09  810.42    178.13   748.67   252.10   871.99    251.72   156.04  29.22  169.53  26.75  -13.49  39.61  
1 1 1 4   6   24 o 7  207.91  22.79  1296.62   267.59   1396.46  380.26   1198.68   376.62   211.50  32.34  194.33  35.05  17.17   47.69  
1 1 1 4   6   25 o 1  104.17  16.65  326.40    96.24    317.26   142.48   334.08    130.51   100.53  24.84  103.74  22.56  -3.21   33.55  
1 1 1 4   6   26 o 11 202.33  22.64  1251.83   258.51   1245.44  367.23   1258.12   363.97   194.71  34.10  196.11  33.54  -1.40   47.82  
1 1 1 4   6   27 o 7  210.96  24.19  1390.21   287.69   1297.69  405.25   1484.22   408.49   193.05  37.92  209.18  35.27  -16.13  51.79  
1 1 1 4   6   28 o 7  162.36  20.55  820.03    187.26   813.51   262.69   826.76    267.03   154.85  30.64  155.91  30.93  -1.06   43.53  
1 1 1 4   6   29 o 10 49.38   20.14  38.72     90.11    -0.84    122.41   85.53     133.14   50.91   22.21  62.23   24.80  -11.32  33.29  
1 1 1 4   6   30 o 8  137.58  20.42  605.44    156.37   539.72   217.60   675.61    224.85   121.82  31.03  138.52  29.20  -16.70  42.61  
1 1 1 4   6   31 o 3  64.53   22.94  130.71    106.76   38.78    147.26   232.57    155.01   57.39   24.70  81.10   27.72  -23.71  37.13  
1 1 1 4   6   32 o 16 85.96   29.28  282.44    172.97   0.00     0.00     282.44    172.97   ?       ?      85.96   29.28  0.00    29.28  
1 1 1 4   7   0  o 9  238.74  24.68  1690.12   333.39   1728.42  471.50   1651.83   471.47   237.49  35.69  231.67  36.67  5.82    51.17  
1 1 1 4   7   1  o 6  508.73  57.98  8442.98   1663.03  8378.15  2351.87  8507.82   2351.90  469.49  90.54  474.34  89.65  -4.85   127.42 
1 1 1 4   7   2  f 0  63.49   7.95   117.79    28.34    -38.45   38.28    307.30    42.16    23.89   11.18  103.12  7.17   -79.23  13.28  
1 1 1 4   7   3  o 10 245.88  24.93  1794.22   347.05   1.12     489.80   3602.21   491.83   103.16  44.73  349.31  24.69  -246.15 51.09  
1 1 1 4   7   4  o 8  329.29  35.06  3296.37   652.51   3639.24  922.87   2953.62   922.70   337.70  49.04  299.40  55.73  38.30   74.24  
1 1 1 4   7   5  o 16 160.09  16.64  751.71    150.67   861.94   213.47   642.27    212.70   170.17  22.39  145.43  26.45  24.75   34.66  
1 1 1 4   7   6  o 4  247.49  26.00  1827.14   363.90   2059.64  514.81   1594.95   514.45   258.92  35.57  224.73  41.40  34.19   54.59  
1 1 1 4   7   7  o 17 286.77  30.35  2481.68   492.02   2682.41  695.90   2281.06   695.73   291.59  42.85  265.95  47.30  25.63   63.83  
1 1 1 4   7   8  o 19 76.14   8.90   169.27    38.16    191.96   54.90    148.06    53.08    80.60   12.25  70.35   13.64  10.26   18.33  
1 1 1 4   7   9  o 12 296.84  48.37  2853.56   795.90   0.00     0.00     2853.56   795.90   ?       ?      296.84  48.37  0.00    48.37  
1 1 1 4   7   10 o 18 226.39  35.28  1587.63   443.56   0.00     0.00     1587.63   443.56   ?       ?      226.39  35.28  0.00    35.28  
1 1 1 4   7   11 o 10 340.24  57.39  3877.90   1081.13  0.00     0.00     3877.90   1081.13  ?       ?      340.24  57.39  0.00    57.39  
1 1 1 4   7   12 o 1  364.41  62.26  4505.05   1255.81  0.00     0.00     4505.05   1255.81  ?       ?      364.41  62.26  0.00    62.26  
1 1 1 4   7   13 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   7   14 o 18 89.53   14.49  237.46    71.94    0.00     0.00     237.46    71.94    ?       ?      89.53   14.49  0.00    14.49  
1 1 1 4   7   15 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   7   16 o 6  631.67  74.73  13258.94  2657.37  15119.74 3758.24  11398.44  3757.94  633.20  107.21 521.09  126.84 112.12  166.08 
1 1 1 4   7   17 o 19 557.00  62.60  9964.42   1966.91  10118.89 2781.48  9809.91   2781.77  527.21  95.42  516.70  97.35  10.50   136.31 
1 1 1 4   7   18 o 7  223.42  23.24  1473.35   293.70   1492.97  415.08   1453.68   415.64   221.70  33.67  218.50  34.26  3.20    48.04  
1 1 1 4   7   19 o 2  492.14  103.06 10113.84  2818.30  10113.84 2818.30  0.00      0.00     492.14  103.06 ?       ?      0.00    103.06 
1 1 1 4   7   20 o 7  255.40  40.91  2060.07   579.62   2060.07  579.62   0.00      0.00     255.40  40.91  ?       ?      0.00    40.91  
1 1 1 4   7   21 o 6  119.68  22.45  433.47    148.59   433.47   148.59   0.00      0.00     119.68  22.45  ?       ?      0.00    22.45  
1 1 1 4   7   22 o 1  159.99  20.30  760.12    182.28   876.99   265.60   656.07    250.60   169.62  28.27  145.43  30.97  24.19   41.93  
1 1 1 4   7   23 o 2  80.53   20.86  197.95    97.17    182.36   149.79   209.28    127.69   80.35   27.25  83.25   24.84  -2.90   36.87  
1 1 1 4   7   24 o 6  303.36  34.12  2911.61   583.83   3057.95  827.75   2766.74   823.60   295.79  50.56  278.12  53.53  17.67   73.63  
1 1 1 4   7   25 o 14 62.92   20.61  115.13    85.84    146.96   129.79   90.39     114.45   72.35   25.33  62.13   23.47  10.22   34.53  
1 1 1 4   7   26 o 14 252.62  28.64  2031.83   408.09   1853.13  577.08   2210.58   577.16   224.48  46.32  251.07  41.49  -26.59  62.18  
1 1 1 4   7   27 o 5  157.61  19.35  762.86    171.37   691.54   246.22   829.87    238.67   143.12  30.88  159.89  26.96  -16.76  40.99  
1 1 1 4   7   28 o 2  213.71  25.45  1482.48   306.07   1462.66  436.26   1501.69   429.52   196.76  39.99  201.12  38.61  -4.36   55.58  
1 1 1 4   7   29 o 9  85.20   20.98  236.68    101.93   253.68   154.69   223.63    135.51   86.19   27.62  81.69   25.82  4.50    37.81  
1 1 1 4   7   30 o 3  118.88  21.12  462.10    138.87   428.59   196.90   495.26    195.90   107.46  30.50  116.83  29.27  -9.37   42.28  
1 1 1 4   7   31 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   8   0  o 2  257.42  40.28  2063.39   575.71   0.00     0.00     2063.39   575.71   ?       ?      257.42  40.28  0.00    40.28  
1 1 1 4   8   1  o 3  161.20  24.42  779.75    218.88   0.00     0.00     779.75    218.88   ?       ?      161.20  24.42  0.00    24.42  
1 1 1 4   8   2  o 14 193.41  29.52  1134.86   317.42   0.00     0.00     1134.86   317.42   ?       ?      193.41  29.52  0.00    29.52  
1 1 1 4   8   3  o 8  210.93  32.43  1360.05   380.13   0.00     0.00     1360.05   380.13   ?       ?      210.93  32.43  0.00    32.43  
1 1 1 4   8   4  o 5  321.97  52.93  3387.22   944.30   0.00     0.00     3387.22   944.30   ?       ?      321.97  52.93  0.00    52.93  
1 1 1 4   8   5  o 1  215.10  33.18  1419.13   396.54   0.00     0.00     1419.13   396.54   ?       ?      215.10  33.18  0.00    33.18  
1 1 1 4   8   6  o 3  137.32  20.84  563.39    159.13   0.00     0.00     563.39    159.13   ?       ?      137.32  20.84  0.00    20.84  
1 1 1 4   8   7  o 10 496.05  111.51 11122.11  3097.99  0.00     0.00     11122.11  3097.99  ?       ?      496.05  111.51 0.00    111.51 
1 1 1 4   8   8  o 9  159.01  24.17  760.00    213.68   0.00     0.00     760.00    213.68   ?       ?      159.01  24.17  0.00    24.17  
1 1 1 4   8   9  o 14 281.68  45.01  2521.03   703.38   0.00     0.00     2521.03   703.38   ?       ?      281.68  45.01  0.00    45.01  
1 1 1 4   8   10 o 18 402.25  71.27  5689.10   1585.44  0.00     0.00     5689.10   1585.44  ?       ?      402.25  71.27  0.00    71.27  
1 1 1 4   8   11 o 6  147.53  15.35  637.01    128.12   647.72   181.76   626.43    180.62   147.29  22.18  144.73  22.47  2.56    31.57  
1 1 1 4   8   12 o 3  366.44  39.44  4098.83   816.56   4577.98  1154.94  3619.93   1154.64  377.57  54.89  329.38  63.36  48.19   83.83  
1 1 1 4   8   13 o 14 425.41  46.39  5582.58   1114.67  6290.75  1576.57  4874.75   1576.19  438.52  64.56  376.85  75.49  61.67   99.33  
1 1 1 4   8   14 f 0  675.94  194.15 28476.47  7930.48  28476.47 7930.48  0.00      0.00     675.94  194.15 ?       ?      0.00    194.15 
1 1 1 4   8   15 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   8   16 o 1  379.99  40.12  4374.59   861.87   4330.62  1218.63  4418.60   1219.12  366.82  59.94  371.05  59.22  -4.23   84.26  
1 1 1 4   8   17 o 3  103.98  18.48  323.03    106.26   323.03   106.26   0.00      0.00     103.98  18.48  ?       ?      0.00    18.48  
1 1 1 4   8   18 o 16 405.69  72.46  5829.00   1625.66  5829.00  1625.66  0.00      0.00     405.69  72.46  ?       ?      0.00    72.46  
1 1 1 4   8   19 o 15 198.11  31.32  1203.95   344.36   1203.95  344.36   0.00      0.00     198.11  31.32  ?       ?      0.00    31.32  
1 1 1 4   8   20 o 9  357.27  62.00  4387.98   1225.50  4387.98  1225.50  0.00      0.00     357.27  62.00  ?       ?      0.00    62.00  
1 1 1 4   8   21 o 8  189.86  20.74  1067.20   222.36   978.01   307.24   1165.31   322.23   178.33  31.14  195.59  29.63  -17.26  42.98  
1 1 1 4   8   22 f 0  96.52   17.74  280.18    94.68    319.89   126.63   229.82    142.59   102.33  22.20  87.29   26.30  15.04   34.41  
1 1 1 4   8   23 f 0  119.07  16.79  423.06    111.60   305.36   149.70   570.34    167.45   98.90   26.02  136.98  22.04  -38.08  34.10  
1 1 1 4   8   24 o 3  135.49  17.55  550.69    133.28   503.35   182.60   604.68    194.99   126.37  26.04  139.10  25.35  -12.73  36.34  
1 1 1 4   8   25 o 13 87.03   20.89  236.81    103.05   162.62   156.00   294.25    137.25   76.51   27.66  96.14   24.73  -19.63  37.11  
1 1 1 4   8   26 o 13 52.02   20.88  46.43     95.12    -0.63    145.58   81.49     125.65   55.97   24.33  61.75   24.25  -5.79   34.35  
1 1 1 4   8   27 o 11 57.58   21.86  81.64     99.62    63.64    156.98   93.78     128.91   63.33   26.28  63.13   24.63  0.19    36.02  
1 1 1 4   8   28 o 19 62.74   22.83  112.18    106.51   148.83   167.80   87.45     137.83   73.04   28.21  62.82   25.16  10.22   37.80  
1 1 1 4   8   29 o 17 164.56  22.39  883.72    206.07   917.57   303.47   854.76    280.73   155.08  34.93  151.41  33.21  3.67    48.20  
1 1 1 4   8   30 o 19 77.48   22.78  205.44    108.03   178.52   190.50   218.20    131.16   74.98   29.73  78.93   25.45  -3.94   39.14  
1 1 1 4   8   31 o 5  161.59  39.15  1182.43   359.30   0.00     0.00     1182.43   359.30   ?       ?      161.59  39.15  0.00    39.15  
1 1 1 4   9   0  o 15 370.14  39.41  4182.13   824.48   4266.64  1165.92  4097.61   1166.05  362.01  58.06  353.59  59.56  8.42    83.18  
1 1 1 4   9   1  o 1  489.00  54.74  7666.28   1510.29  7660.62  2135.80  7671.94   2135.95  458.57  84.24  459.00  84.16  -0.43   119.08 
1 1 1 4   9   2  o 15 166.27  17.59  811.24    165.36   0.47     231.31   1658.78   236.49   72.49   31.08  238.45  17.40  -165.95 35.62  
1 1 1 4   9   3  o 7  247.77  25.72  1824.06   360.45   1791.71  509.61   1856.44   509.89   240.83  38.13  245.56  37.35  -4.73   53.37  
1 1 1 4   9   4  o 17 363.04  38.89  4040.37   797.98   4497.58  1128.74  3583.53   1128.28  372.63  54.37  326.12  62.54  46.51   82.87  
1 1 1 4   9   5  o 5  345.78  36.95  3646.96   722.10   4130.08  1021.46  3164.33   1020.94  359.23  50.96  307.77  59.94  51.46   78.68  
1 1 1 4   9   6  o 4  503.35  57.16  8247.94   1622.38  7977.16  2294.26  8518.78   2294.52  457.26  90.61  477.71  86.87  -20.45  125.52 
1 1 1 4   9   7  x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   9   8  o 6  494.99  96.37  9476.14   2639.90  9476.14  2639.90  0.00      0.00     494.99  96.37  ?       ?      0.00    96.37  
1 1 1 4   9   9  o 17 408.10  69.81  5656.46   1576.71  0.00     0.00     5656.46   1576.71  ?       ?      408.10  69.81  0.00    69.81  
1 1 1 4   9   10 f 0  574.97  66.02  10873.75  2139.77  10752.84 3025.94  10994.69  3026.25  526.43  103.82 534.44  102.36 -8.01   145.80 
1 1 1 4   9   11 o 8  173.55  18.08  881.77    177.52   899.80   249.47   863.29    252.65   173.63  25.81  169.74  26.82  3.88    37.22  
1 1 1 4   9   12 o 10 739.51  91.46  19325.32  3800.15  19021.19 5374.03  19629.50  5374.41  640.34  149.00 656.24  146.39 -15.90  208.88 
1 1 1 4   9   13 o 19 538.77  98.66  10549.90  2939.09  10549.90 2939.09  0.00      0.00     538.77  98.66  ?       ?      0.00    98.66  
1 1 1 4   9   14 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   9   15 o 7  485.16  87.03  8379.04   2334.86  8379.04  2334.86  0.00      0.00     485.16  87.03  ?       ?      0.00    87.03  
1 1 1 4   9   16 o 17 219.95  33.99  1476.10   415.42   1476.10  415.42   0.00      0.00     219.95  33.99  ?       ?      0.00    33.99  
1 1 1 4   9   17 o 10 349.52  59.15  4100.22   1144.45  4100.22  1144.45  0.00      0.00     349.52  59.15  ?       ?      0.00    59.15  
1 1 1 4   9   18 o 4  316.55  52.89  3317.31   927.28   3317.31  927.28   0.00      0.00     316.55  52.89  ?       ?      0.00    52.89  
1 1 1 4   9   19 o 4  200.16  21.40  1187.12   242.03   1223.22  341.38   1150.63   343.20   200.05  30.70  193.41  32.03  6.65    44.37  
1 1 1 4   9   20 o 12 275.77  29.73  2296.22   463.23   2444.85  655.75   2148.17   654.46   277.95  42.44  258.31  45.81  19.65   62.45  
1 1 1 4   9   21 o 14 263.87  28.31  2105.38   422.20   2078.76  596.16   2132.16   598.01   254.69  42.26  258.30  41.75  -3.62   59.40  
1 1 1 4   9   22 o 17 78.93   19.52  190.81    87.92    159.25   120.22   227.09    128.91   74.11   24.40  85.98   24.77  -11.86  34.77  
1 1 1 4   9   23 o 14 220.37  24.83  1489.72   308.69   1571.49  435.16   1406.88   437.98   219.30  35.80  205.32  38.57  13.98   52.63  
1 1 1 4   9   24 o 18 83.10   19.20  214.08    89.75    192.89   118.53   242.54    137.40   78.92   24.02  87.64   25.67  -8.73   35.15  
1 1 1 4   9   25 o 13 105.13  18.07  339.46    105.12   338.91   139.63   340.17    159.69   102.80  24.09  102.05  26.89  0.75    36.10  
1 1 1 4   9   26 o 9  170.47  20.87  906.07    199.97   923.07   276.93   887.54    289.06   165.30  30.30  160.18  32.55  5.12    44.47  
1 1 1 4   9   27 o 2  120.89  18.83  457.94    126.41   327.28   169.64   621.11    189.57   97.28   28.53  137.18  24.99  -39.90  37.93  
1 1 1 4   9   28 o 5  190.72  23.73  1195.42   254.16   1106.05  353.26   1291.33   365.95   168.25  37.53  184.53  35.84  -16.28  51.89  
1 1 1 4   9   29 o 8  49.90   20.52  43.18     94.50    -37.36   124.07   154.47    145.85   46.86   21.27  70.27   26.50  -23.41  33.98  
1 1 1 4   9   30 o 16 171.33  44.27  1455.88   438.53   0.00     0.00     1455.88   438.53   ?       ?      171.33  44.27  0.00    44.27  
1 1 1 4   10  0  o 19 601.30  63.62  11473.98  2162.86  10697.09 3055.96  12253.70  3061.55  543.03  101.77 591.58  93.23  -48.55  138.02 
1 1 1 4   10  1  o 4  17.88   8.90   -90.96    35.89    -90.96   35.89    0.00      0.00     17.88   8.90   ?       ?      0.00    8.90   
1 1 1 4   10  2  o 5  424.73  70.63  5962.78   1661.65  5962.78  1661.65  0.00      0.00     424.73  70.63  ?       ?      0.00    70.63  
1 1 1 4   10  3  o 6  616.79  132.29 16312.78  4543.46  16312.78 4543.46  0.00      0.00     616.79  132.29 ?       ?      0.00    132.29 
1 1 1 4   10  4  o 16 608.62  129.42 15734.36  4382.44  15734.36 4382.44  0.00      0.00     608.62  129.42 ?       ?      0.00    129.42 
1 1 1 4   10  5  o 5  503.51  90.54  9047.66   2520.76  9047.66  2520.76  0.00      0.00     503.51  90.54  ?       ?      0.00    90.54  
1 1 1 4   10  6  o 1  479.77  83.83  7985.10   2224.91  7985.10  2224.91  0.00      0.00     479.77  83.83  ?       ?      0.00    83.83  
1 1 1 4   10  7  o 18 468.13  80.50  7483.71   2085.31  7483.71  2085.31  0.00      0.00     468.13  80.50  ?       ?      0.00    80.50  
1 1 1 4   10  8  o 2  229.24  34.93  1587.54   445.20   1587.54  445.20   0.00      0.00     229.24  34.93  ?       ?      0.00    34.93  
1 1 1 4   10  9  o 2  456.23  76.90  6970.23   1942.50  6970.23  1942.50  0.00      0.00     456.23  76.90  ?       ?      0.00    76.90  
1 1 1 4   10  10 o 14 167.98  25.67  841.00    239.68   841.00   239.68   0.00      0.00     167.98  25.67  ?       ?      0.00    25.67  
1 1 1 4   10  11 f 0  621.14  126.03 15581.64  4340.12  15581.64 4340.12  0.00      0.00     621.14  126.03 ?       ?      0.00    126.03 
1 1 1 4   10  12 o 6  603.59  121.75 14622.59  4073.09  14622.59 4073.09  0.00      0.00     603.59  121.75 ?       ?      0.00    121.75 
1 1 1 4   10  13 o 9  362.83  58.54  4222.73   1177.85  4222.73  1177.85  0.00      0.00     362.83  58.54  ?       ?      0.00    58.54  
1 1 1 4   10  14 o 17 115.20  20.71  397.75    131.92   0.00     0.00     397.75    131.92   ?       ?      115.20  20.71  0.00    20.71  
1 1 1 4   10  15 o 17 104.02  12.65  317.10    73.99    336.81   101.97   295.18    107.54   106.38  17.29  98.98   19.62  7.40    26.15  
1 1 1 4   10  16 o 3  632.78  85.22  15351.62  3016.88  15095.42 4266.23  15607.89  4266.80  513.17  140.66 528.41  138.87 -15.24  197.66 
1 1 1 4   10  17 o 18 82.22   13.24  200.46    60.35    203.19   81.70    197.18    89.54    81.97   17.87  80.57   19.56  1.40    26.49  
1 1 1 4   10  18 o 1  294.97  31.35  2634.94   522.80   2633.63  738.56   2636.25   740.15   286.42  46.51  286.51  46.60  -0.09   65.84  
1 1 1 4   10  19 o 6  256.68  27.39  1978.15   397.35   2032.18  561.25   1923.85   562.63   254.35  39.74  246.58  41.20  7.77    57.24  
1 1 1 4   10  20 o 9  376.64  41.39  4499.51   880.19   4182.77  1242.69  4818.37   1246.86  339.79  66.09  371.25  60.59  -31.45  89.66  
1 1 1 4   10  21 o 8  71.39   19.66  155.17    83.12    142.14   110.18   172.39    126.64   70.38   23.36  76.70   25.03  -6.32   34.24  
1 1 1 4   10  22 o 10 207.98  23.41  1319.60   274.61   1349.41  385.79   1288.98   390.98   203.95  34.16  198.24  35.67  5.71    49.39  
1 1 1 4   10  23 o 4  109.30  17.81  363.19    107.89   372.09   145.31   352.26    161.07   108.53  23.96  104.72  26.71  3.81    35.88  
1 1 1 4   10  24 o 15 123.70  18.07  466.84    124.54   381.20   171.22   563.05    181.48   107.83  27.56  133.00  24.68  -25.17  36.99  
1 1 1 4   10  25 o 19 88.99   20.21  251.29    100.86   222.07   136.37   286.56    149.84   82.83   25.86  93.00   26.68  -10.17  37.16  
1 1 1 4   10  26 o 5  99.55   20.77  318.36    114.82   369.21   152.75   252.28    174.12   104.84  25.60  86.66   29.38  18.18   38.97  
1 1 1 4   10  27 o 7  97.43   21.09  310.07    114.54   295.30   153.42   328.66    172.16   92.09   27.16  96.19   28.88  -4.10   39.64  
1 1 1 4   10  28 o 8  121.65  20.80  484.26    140.02   356.21   193.18   625.99    203.24   97.20   30.84  132.90  27.54  -35.71  41.35  
1 1 1 4   10  29 f 0  152.37  37.59  1005.39   326.74   0.00     0.00     1005.39   326.74   ?       ?      152.37  37.59  0.00    37.59  
1 1 1 4   10  30 o 8  61.05   26.16  80.12     163.76   0.00     0.00     80.12     163.76   ?       ?      61.05   26.16  0.00    26.16  
1 1 1 4   11  0  o 1  406.77  38.17  4920.98   880.95   5893.76  1523.32  4432.17   1079.83  433.44  63.07  380.87  50.64  52.57   80.89  
1 1 1 4   11  1  o 4  187.09  19.02  1021.99   201.48   2.82     281.46   2093.27   288.56   80.65   34.42  268.47  18.84  -187.82 39.24  
1 1 1 4   11  2  o 3  788.98  93.85  21155.04  4167.39  21331.42 5893.54  20978.66  5893.63  715.97  148.27 707.35  149.81 8.62    210.78 
1 1 1 4   11  3  o 9  421.27  44.28  5349.96   1054.91  5366.12  1491.80  5333.80   1491.93  410.89  65.44  409.48  65.69  1.41    92.72  
1 1 1 4   11  4  o 1  322.26  33.34  3080.74   607.87   3002.77  859.41   3158.81   859.90   312.20  49.61  320.97  48.15  -8.77   69.14  
1 1 1 4   11  5  o 6  787.46  95.18  21397.56  4215.36  21562.77 5961.37  21232.35  5961.46  706.63  151.51 698.51  152.92 8.11    215.26 
1 1 1 4   11  6  o 1  684.27  78.58  15388.15  3030.97  15392.88 4286.34  15383.42  4286.53  631.77  122.61 631.50  122.66 0.27    173.43 
1 1 1 4   11  7  o 12 159.85  16.79  746.11    151.77   679.62   213.36   814.22    215.94   150.76  25.56  165.84  23.33  -15.07  34.61  
1 1 1 4   11  8  o 11 645.06  73.49  13572.01  2673.04  13540.05 3780.15  13603.97  3780.37  597.50  114.37 599.38  114.03 -1.88   161.51 
1 1 1 4   11  9  o 6  490.57  52.94  7454.67   1467.33  7335.51  2074.85  7573.90   2075.40  465.64  80.53  474.65  78.94  -9.01   112.77 
1 1 1 4   11  10 o 19 334.24  35.02  3344.59   661.92   3400.78  935.67   3288.30   936.51   329.79  51.07  323.63  52.18  6.16    73.02  
1 1 1 4   11  11 o 3  212.84  22.14  1333.09   266.60   1343.84  376.03   1322.22   378.03   210.96  32.06  209.07  32.56  1.89    45.69  
1 1 1 4   11  12 o 10 373.15  39.92  4258.36   841.78   4312.37  1190.22  4204.32   1190.68  363.02  59.15  357.66  60.12  5.36    84.34  
1 1 1 4   11  13 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   11  14 o 12 193.92  20.44  1110.79   224.11   1050.24  314.28   1173.44   319.66   185.32  30.61  196.61  29.21  -11.29  42.31  
1 1 1 4   11  15 o 16 326.25  34.73  3255.39   640.46   3104.99  904.48   3406.64   907.03   306.49  53.34  323.42  50.50  -16.93  73.46  
1 1 1 4   11  16 o 1  231.42  24.38  1594.06   319.03   1552.76  449.02   1636.16   453.36   223.76  36.19  230.13  35.45  -6.38   50.66  
1 1 1 4   11  17 o 11 479.66  54.92  7561.55   1484.99  7351.06  2099.61  7772.23   2100.58  434.35  87.24  451.04  84.22  -16.70  121.26 
1 1 1 4   11  18 o 2  72.04   16.15  156.73    65.13    125.16   86.41    198.28    99.11    65.62   20.60  80.75   21.14  -15.14  29.52  
1 1 1 4   11  19 o 7  261.72  28.03  2081.88   414.58   2070.27  584.88   2093.61   587.75   252.92  41.74  254.40  41.69  -1.48   58.99  
1 1 1 4   11  20 o 12 224.01  24.76  1525.92   313.10   1449.12  438.86   1605.53   446.83   210.91  37.63  223.24  36.10  -12.33  52.14  
1 1 1 4   11  21 o 11 58.26   21.28  85.38     92.67    43.98    124.48   136.84    138.78   57.63   23.61  71.78   26.07  -14.15  35.17  
1 1 1 4   11  22 o 4  219.33  24.62  1491.11   304.69   1417.62  428.84   1566.03   432.98   204.01  38.01  216.21  36.16  -12.20  52.47  
1 1 1 4   11  23 o 11 147.34  19.19  664.01    158.47   683.61   219.32   642.60    229.22   145.25  27.31  139.40  29.56  5.85    40.24  
1 1 1 4   11  24 o 8  128.00  18.59  506.13    132.63   478.94   179.55   538.79    196.78   120.21  26.71  127.05  27.76  -6.84   38.52  
1 1 1 4   11  25 o 11 69.10   21.64  151.52    95.39    153.27   126.81   149.25    144.76   70.85   25.02  71.51   26.52  -0.66   36.46  
1 1 1 4   11  26 o 6  152.84  20.77  747.74    177.50   773.68   244.86   719.01    257.66   147.85  29.88  139.64  32.72  8.22    44.31  
1 1 1 4   11  27 o 4  128.63  32.69  634.08    241.83   0.00     0.00     634.08    241.83   ?       ?      128.63  32.69  0.00    32.69  
1 1 1 4   11  28 o 1  127.17  33.36  656.37    246.50   0.00     0.00     656.37    246.50   ?       ?      127.17  33.36  0.00    33.36  
1 1 1 4   11  29 o 17 70.95   28.83  169.46    183.78   0.00     0.00     169.46    183.78   ?       ?      70.95   28.83  0.00    28.83  
1 1 1 4   12  0  o 3  35.77   17.03  -124.12   96.18    -182.25  134.62   -63.51    137.46   41.76   19.96  50.63   22.73  -8.87   30.25  
1 1 1 4   12  1  o 8  415.83  23.31  5044.07   554.13   1233.20  945.18   7039.86   684.00   199.80  68.43  491.13  24.34  -291.33 72.63  
1 1 1 4   12  2  o 6  360.61  29.16  3832.48   598.48   3494.00  1025.60  4007.26   736.97   333.15  55.58  366.55  35.47  -33.39  65.93  
1 1 1 4   12  3  o 1  363.85  38.21  3973.61   786.14   4137.48  1111.63  3809.66   1111.90  363.28  55.02  346.82  57.89  16.46   79.87  
1 1 1 4   12  4  o 18 676.51  79.31  15316.67  3021.83  15736.12 4273.44  14897.19  4273.58  628.65  122.82 604.84  127.13 23.81   176.77 
1 1 1 4   12  5  o 1  226.58  23.51  1510.11   301.30   1533.70  425.68   1486.43   426.54   225.50  33.93  221.71  34.65  3.79    48.49  
1 1 1 4   12  6  o 17 302.60  47.40  2845.48   796.33   0.00     0.00     2845.48   796.33   ?       ?      302.60  47.40  0.00    47.40  
1 1 1 4   12  7  o 15 382.61  40.61  4450.43   878.39   4463.73  1242.01  4437.13   1242.47  371.41  60.32  370.11  60.57  1.30    85.48  
1 1 1 4   12  8  o 1  329.73  34.81  3273.42   648.96   3408.57  917.64   3138.20   917.89   328.71  50.22  313.70  52.85  15.01   72.90  
1 1 1 4   12  9  o 18 549.15  62.71  9914.26   1941.49  9190.47  2745.37  10638.39  2746.00  481.15  102.53 531.45  93.41  -50.31  138.70 
1 1 1 4   12  10 o 16 194.59  20.48  1115.79   225.30   1090.36  317.01   1141.74   320.26   189.54  30.14  194.21  29.67  -4.66   42.29  
1 1 1 4   12  11 o 17 205.88  21.54  1252.66   250.87   1142.34  353.19   1364.99   356.40   192.81  33.10  212.28  30.09  -19.46  44.73  
1 1 1 4   12  12 o 1  464.92  92.94  8587.31   2393.82  8587.31  2393.82  0.00      0.00     464.92  92.94  ?       ?      0.00    92.94  
1 1 1 4   12  13 o 17 474.28  96.89  9141.38   2548.66  0.00     0.00     9141.38   2548.66  ?       ?      474.28  96.89  0.00    96.89  
1 1 1 4   12  14 o 12 277.20  29.20  2307.55   457.75   2241.27  646.97   2373.99   647.75   266.11  43.88  274.82  42.42  -8.71   61.03  
1 1 1 4   12  15 o 15 211.78  22.93  1331.07   274.28   1393.59  386.25   1267.47   389.56   213.38  32.56  202.44  34.77  10.93   47.64  
1 1 1 4   12  16 o 14 311.17  33.30  2953.06   585.65   2909.17  827.08   2997.19   829.39   298.43  50.05  303.53  49.29  -5.10   70.24  
1 1 1 4   12  17 o 10 190.52  20.37  1077.81   219.37   940.75   304.71   1225.28   316.07   173.82  31.71  200.39  28.26  -26.57  42.47  
1 1 1 4   12  18 f 0  55.37   16.07  91.51     54.06    114.63   69.53    56.18     85.95    61.93   18.29  52.56   20.22  9.37    27.27  
1 1 1 4   12  19 o 12 148.68  18.01  661.37    150.63   550.09   197.33   816.74    233.16   132.20  26.92  162.28  25.90  -30.07  37.35  
1 1 1 4   12  20 o 12 131.10  18.40  519.46    134.65   460.68   178.79   596.49    204.69   120.28  26.60  137.11  26.97  -16.83  37.88  
1 1 1 4   12  21 o 1  146.83  19.20  655.82    158.00   594.64   213.44   729.99    235.00   135.45  28.36  150.52  28.23  -15.07  40.02  
1 1 1 4   12  22 o 18 126.23  19.74  492.68    138.37   428.61   181.85   580.76    213.23   113.81  28.02  132.42  28.87  -18.62  40.23  
1 1 1 4   12  23 o 11 53.15   20.90  58.89     93.35    -12.40   129.16   136.84    135.07   51.36   22.60  69.64   25.65  -18.28  34.19  
1 1 1 4   12  24 o 16 162.20  21.12  834.60    192.03   800.16   265.31   872.49    278.30   150.28  31.75  156.89  31.99  -6.62   45.07  
1 1 1 4   12  25 o 9  217.73  55.75  2438.37   699.75   0.00     0.00     2438.37   699.75   ?       ?      217.73  55.75  0.00    55.75  
1 1 1 4   12  26 o 10 183.73  43.39  1502.71   450.35   0.00     0.00     1502.71   450.35   ?       ?      183.73  43.39  0.00    43.39  
1 1 1 4   12  27 o 16 167.16  41.98  1303.70   402.23   0.00     0.00     1303.70   402.23   ?       ?      167.16  41.98  0.00    41.98  
1 1 1 4   12  28 o 12 61.75   26.52  82.99     169.02   0.00     0.00     82.99     169.02   ?       ?      61.75   26.52  0.00    26.52  
1 1 1 4   13  0  o 13 149.14  16.26  651.03    136.97   -2.58    183.62   1471.12   205.68   64.75   27.72  224.95  16.03  -160.21 32.02  
1 1 1 4   13  1  o 4  458.69  40.76  6396.78   1062.02  6910.04  1824.94  6133.95   1305.94  451.27  72.93  441.14  52.60  10.13   89.92  
1 1 1 4   13  2  o 9  499.66  45.50  7696.52   1290.80  8115.59  2223.97  7483.64   1585.10  476.70  84.35  482.26  58.45  -5.55   102.62 
1 1 1 4   13  3  o 6  271.85  26.75  2191.02   412.04   2757.09  686.68   1872.52   515.08   299.35  41.04  247.32  37.45  52.03   55.56  
1 1 1 4   13  4  o 19 142.61  16.70  597.15    134.10   877.75   200.65   370.64    180.28   172.44  20.68  110.07  28.36  62.36   35.10  
1 1 1 4   13  5  f 0  246.11  26.10  1798.59   363.11   2035.50  513.20   1561.11   513.82   258.53  35.52  223.48  41.58  35.05   54.68  
1 1 1 4   13  6  o 8  214.27  22.88  1357.16   277.10   1520.46  391.92   1193.93   391.83   224.28  31.29  196.66  36.03  27.61   47.72  
1 1 1 4   13  7  o 1  642.93  81.37  14861.14  2936.04  15289.66 4151.99  14432.52  4152.40  569.30  129.92 543.54  133.95 25.76   186.61 
1 1 1 4   13  8  o 14 382.20  41.26  4505.47   891.06   4536.13  1259.78  4474.78   1260.51  368.76  61.69  365.75  62.26  3.01    87.65  
1 1 1 4   13  9  o 3  466.69  51.89  6952.95   1366.64  6695.61  1932.22  7210.55   1933.22  428.57  81.51  449.33  77.76  -20.75  112.66 
1 1 1 4   13  10 o 1  377.63  40.81  4393.86   870.64   4479.82  1230.61  4307.70   1231.94  367.30  60.47  358.79  62.06  8.51    86.64  
1 1 1 4   13  11 o 1  266.39  28.14  2120.35   423.90   2073.88  598.37   2167.17   600.60   257.52  41.92  263.81  40.99  -6.29   58.63  
1 1 1 4   13  12 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   13  13 o 6  294.50  31.22  2618.91   519.81   2531.80  733.86   2706.63   736.39   281.07  47.15  291.84  45.43  -10.76  65.48  
1 1 1 4   13  14 o 3  216.31  34.67  1449.90   415.95   0.00     0.00     1449.90   415.95   ?       ?      216.31  34.67  0.00    34.67  
1 1 1 4   13  15 o 11 154.58  17.38  706.23    151.53   614.67   211.59   802.63    217.10   141.22  27.09  162.97  23.92  -21.74  36.13  
1 1 1 4   13  16 o 2  189.65  20.74  1075.23   222.15   1070.95  313.01   1079.56   315.33   185.19  30.50  185.90  30.61  -0.71   43.22  
1 1 1 4   13  17 o 18 291.60  32.56  2684.05   535.70   2731.22  756.44   2636.59   758.77   279.40  48.94  273.13  50.24  6.27    70.14  
1 1 1 4   13  18 o 2  243.35  26.86  1837.61   368.96   1816.52  519.00   1859.15   524.62   231.61  40.51  234.41  40.45  -2.81   57.24  
1 1 1 4   13  19 o 18 180.90  21.31  998.63    217.04   974.50   299.16   1025.44   315.36   173.09  31.26  177.03  32.22  -3.94   44.89  
1 1 1 4   13  20 o 15 208.36  39.37  1525.70   453.64   0.00     0.00     1525.70   453.64   ?       ?      208.36  39.37  0.00    39.37  
1 1 1 4   13  21 o 2  220.93  44.83  1868.28   549.16   0.00     0.00     1868.28   549.16   ?       ?      220.93  44.83  0.00    44.83  
1 1 1 4   13  22 o 12 118.32  30.81  489.95    211.34   0.00     0.00     489.95    211.34   ?       ?      118.32  30.81  0.00    30.81  
1 1 1 4   13  23 o 16 99.01   31.60  351.94    202.63   0.00     0.00     351.94    202.63   ?       ?      99.01   31.60  0.00    31.60  
1 1 1 4   13  24 o 10 180.70  42.27  1377.71   430.63   0.00     0.00     1377.71   430.63   ?       ?      180.70  42.27  0.00    42.27  
1 1 1 4   13  25 o 5  57.02   24.85  26.85     152.91   0.00     0.00     26.85     152.91   ?       ?      57.02   24.85  0.00    24.85  
1 1 1 4   13  26 f 0  115.98  32.70  550.60    227.04   0.00     0.00     550.60    227.04   ?       ?      115.98  32.70  0.00    32.70  
1 1 1 4   13  27 o 15 58.76   25.99  44.61     172.81   0.00     0.00     44.61     172.81   ?       ?      58.76   25.99  0.00    25.99  
1 1 1 4   14  0  o 7  558.86  28.45  9196.56   909.64   0.00     0.00     9196.56   909.64   ?       ?      558.86  28.45  0.00    28.45  
1 1 1 4   14  1  o 2  480.39  85.44  8134.80   2269.72  0.00     0.00     8134.80   2269.72  ?       ?      480.39  85.44  0.00    85.44  
1 1 1 4   14  2  o 9  523.34  98.63  10235.97  2854.53  0.00     0.00     10235.97  2854.53  ?       ?      523.34  98.63  0.00    98.63  
1 1 1 4   14  3  o 19 225.03  35.67  1542.24   445.49   0.00     0.00     1542.24   445.49   ?       ?      225.03  35.67  0.00    35.67  
1 1 1 4   14  4  f 0  221.36  35.13  1492.25   431.54   0.00     0.00     1492.25   431.54   ?       ?      221.36  35.13  0.00    35.13  
1 1 1 4   14  5  o 3  250.74  39.65  1935.18   551.80   0.00     0.00     1935.18   551.80   ?       ?      250.74  39.65  0.00    39.65  
1 1 1 4   14  6  f 0  231.42  36.71  1640.43   471.38   0.00     0.00     1640.43   471.38   ?       ?      231.42  36.71  0.00    36.71  
1 1 1 4   14  7  o 12 153.69  27.40  715.07    232.85   0.00     0.00     715.07    232.85   ?       ?      153.69  27.40  0.00    27.40  
1 1 1 4   14  8  o 18 340.01  56.11  3766.41   1056.97  0.00     0.00     3766.41   1056.97  ?       ?      340.01  56.11  0.00    56.11  
1 1 1 4   14  9  o 12 213.20  34.27  1394.38   405.17   0.00     0.00     1394.38   405.17   ?       ?      213.20  34.27  0.00    34.27  
1 1 1 4   14  10 o 6  201.56  32.80  1246.85   366.44   0.00     0.00     1246.85   366.44   ?       ?      201.56  32.80  0.00    32.80  
1 1 1 4   14  11 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   14  12 o 18 185.70  30.62  1064.93   315.10   0.00     0.00     1064.93   315.10   ?       ?      185.70  30.62  0.00    30.62  
1 1 1 4   14  13 o 5  155.70  27.01  746.90    232.65   0.00     0.00     746.90    232.65   ?       ?      155.70  27.01  0.00    27.01  
1 1 1 4   14  14 o 15 100.32  24.63  313.54    140.80   0.00     0.00     313.54    140.80   ?       ?      100.32  24.63  0.00    24.63  
1 1 1 4   14  15 o 19 125.82  24.33  491.74    169.39   0.00     0.00     491.74    169.39   ?       ?      125.82  24.33  0.00    24.33  
1 1 1 4   14  16 o 7  160.20  28.01  810.46    248.23   0.00     0.00     810.46    248.23   ?       ?      160.20  28.01  0.00    28.01  
1 1 1 4   14  17 o 3  199.41  34.44  1312.89   380.03   0.00     0.00     1312.89   380.03   ?       ?      199.41  34.44  0.00    34.44  
1 1 1 4   14  18 o 13 134.71  29.83  597.77    224.61   0.00     0.00     597.77    224.61   ?       ?      134.71  29.83  0.00    29.83  
1 1 1 4   14  19 o 3  90.71   28.84  268.46    168.83   0.00     0.00     268.46    168.83   ?       ?      90.71   28.84  0.00    28.84  
1 1 1 4   14  20 o 5  58.48   25.37  11.29     157.83   0.00     0.00     11.29     157.83   ?       ?      58.48   25.37  0.00    25.37  
1 1 1 4   14  21 o 6  196.88  41.69  1519.62   456.49   0.00     0.00     1519.62   456.49   ?       ?      196.88  41.69  0.00    41.69  
1 1 1 4   14  22 o 7  143.64  20.57  658.45    164.75   625.98   218.02   701.66    251.55   133.43  29.27  138.80  32.19  -5.37   43.51  
1 1 1 4   14  23 o 13 81.28   22.81  222.80    110.73   206.11   134.14   258.51    196.19   77.88   25.78  85.40   31.00  -7.52   40.32  
1 1 1 4   14  24 f 0  161.12  22.86  872.44    205.49   806.28   273.86   957.67    310.84   142.53  33.96  153.16  35.97  -10.63  49.47  
1 1 1 4   14  25 o 4  71.77   24.07  181.14    116.84   183.77   140.90   175.34    209.05   72.22   26.27  73.45   30.39  -1.23   40.17  
1 1 1 4   14  26 o 4  51.54   21.62  50.89     107.89   -5.57    134.59   152.42    180.48   49.80   22.42  68.64   28.31  -18.84  36.11  
1 1 1 4   15  0  o 18 255.00  29.32  1962.62   421.40   1724.59  502.07   2529.99   775.14   234.72  38.60  278.05  50.42  -43.32  63.50  
1 1 1 4   15  1  o 10 401.33  48.81  5171.97   1101.33  5427.39  1503.75  4876.44   1617.50  391.50  69.45  358.67  80.53  32.83   106.34 
1 1 1 4   15  2  f 0  119.97  20.67  432.38    137.21   457.79   140.85   -40.00    607.24   123.55  20.58  111.08  48.94  12.47   53.09  
1 1 1 4   15  3  o 11 217.90  23.85  1413.46   293.45   1641.50  413.81   1182.78   416.20   231.93  31.93  193.53  38.81  38.40   50.26  
1 1 1 4   15  4  o 5  234.86  24.82  1645.26   329.54   2136.94  517.14   1309.09   427.60   263.48  35.06  204.12  37.89  59.36   51.62  
1 1 1 4   15  5  o 12 207.75  21.52  1279.21   252.93   1468.11  384.00   1134.45   336.16   219.07  31.43  192.06  31.59  27.02   44.56  
1 1 1 4   15  6  f 0  46.37   17.15  49.26     60.45    100.36   75.58    -41.51    100.73   59.48   19.33  43.69   19.55  15.79   27.49  
1 1 1 4   15  7  o 9  219.44  21.54  1429.45   267.85   1427.17  411.08   1431.14   353.09   213.91  34.66  216.70  29.12  -2.78   45.27  
1 1 1 4   15  8  o 8  183.77  20.21  1003.51   209.70   1026.81  292.90   979.01    300.37   182.83  28.86  177.77  30.53  5.06    42.02  
1 1 1 4   15  9  o 3  220.19  23.49  1454.83   292.29   1372.56  411.62   1538.50   415.11   208.13  35.74  221.71  33.67  -13.58  49.10  
1 1 1 4   15  10 o 3  251.11  27.30  1922.62   387.24   1976.52  545.28   1867.76   550.04   246.99  39.81  238.73  41.65  8.26    57.62  
1 1 1 4   15  11 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   15  12 o 5  255.28  28.12  2012.21   405.30   2073.16  571.40   1950.49   574.99   249.64  41.32  240.48  43.24  9.16    59.80  
1 1 1 4   15  13 o 11 153.21  18.21  702.82    157.00   793.02   217.80   605.24    226.52   160.40  24.42  137.61  29.56  22.79   38.34  
1 1 1 4   15  14 o 17 277.42  31.23  2447.57   488.76   2448.34  688.73   2446.78   693.74   261.91  47.56  261.34  48.01  0.57    67.58  
1 1 1 4   15  15 o 18 125.63  16.53  474.33    116.35   488.68   157.28   456.99    172.93   125.22  22.72  119.69  25.92  5.52    34.46  
1 1 1 4   15  16 o 3  125.09  16.51  472.18    115.69   484.83   157.59   457.41    170.37   124.14  22.96  119.30  25.64  4.84    34.42  
1 1 1 4   15  17 o 13 75.75   17.01  178.07    72.17    179.67   92.35    175.56    115.67   75.46   20.70  75.02   23.87  0.44    31.60  
1 1 1 4   15  18 o 16 98.35   21.32  308.91    116.89   391.57   152.79   192.27    181.51   109.29  24.91  80.35   29.71  28.95   38.77  
1 1 1 4   15  19 o 3  63.90   22.43  120.08    101.86   141.28   129.26   85.32     165.47   69.44   25.17  66.29   27.20  3.16    37.06  
1 1 1 4   15  20 o 6  142.17  21.70  649.36    171.51   821.43   234.36   450.95    251.66   155.81  27.19  109.12  35.26  46.69   44.52  
1 1 1 4   15  21 o 5  63.15   21.96  122.36    97.48    93.70    117.51   185.58    174.54   60.55   23.55  76.69   28.98  -16.13  37.34  
1 1 1 4   15  22 o 17 178.80  23.88  1074.78   238.97   1083.61  325.36   1064.44   352.12   166.15  35.21  159.41  38.84  6.73    52.42  
1 1 1 4   15  23 o 16 89.97   26.89  299.10    149.54   299.10   149.54   0.00      0.00     89.97   26.89  ?       ?      0.00    26.89  
1 1 1 4   15  24 o 15 92.86   28.22  336.66    163.67   336.66   163.67   0.00      0.00     92.86   28.22  ?       ?      0.00    28.22  
1 1 1 4   16  0  o 1  270.30  34.64  2283.23   525.11   2225.99  628.22   2415.93   956.62   261.05  43.45  253.37  65.35  7.69    78.47  
1 1 1 4   16  1  o 5  263.03  27.85  2102.64   414.19   1977.46  583.15   2230.09   588.40   246.17  42.82  263.54  40.16  -17.37  58.70  
1 1 1 4   16  2  o 19 222.61  23.98  1489.68   301.63   1843.18  460.11   1223.26   399.43   242.81  33.93  195.58  36.93  47.23   50.15  
1 1 1 4   16  3  o 7  269.08  26.49  2191.16   403.92   2490.31  641.28   1994.42   520.05   277.33  41.56  250.51  37.30  26.82   55.84  
1 1 1 4   16  4  o 7  195.96  31.59  1199.11   343.28   1199.11  343.28   0.00      0.00     195.96  31.59  ?       ?      0.00    31.59  
1 1 1 4   16  5  o 2  198.63  31.05  1230.58   342.42   1405.68  385.87   581.74    742.79   211.60  32.83  144.00  58.16  67.59   66.79  
1 1 1 4   16  6  o 4  106.93  19.92  347.56    117.76   355.56   120.00   139.77    611.68   108.14  20.07  115.48  50.03  -7.34   53.90  
1 1 1 4   16  7  o 19 345.59  47.09  4041.99   909.89   4426.52  1220.91  3561.63   1364.60  340.30  64.86  281.30  80.45  58.99   103.34 
1 1 1 4   16  8  o 19 136.91  22.61  573.07    171.50   629.97   178.61   -98.97    613.84   143.77  22.37  104.58  47.40  39.19   52.41  
1 1 1 4   16  9  o 1  349.51  75.86  5294.54   1478.34  5294.54  1478.34  0.00      0.00     349.51  75.86  ?       ?      0.00    75.86  
1 1 1 4   16  10 o 7  217.62  36.68  1556.45   441.90   1556.45  441.90   0.00      0.00     217.62  36.68  ?       ?      0.00    36.68  
1 1 1 4   16  11 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   16  12 o 5  150.66  25.81  715.57    215.18   715.57   215.18   0.00      0.00     150.66  25.81  ?       ?      0.00    25.81  
1 1 1 4   16  13 o 9  141.23  25.05  631.57    195.62   631.57   195.62   0.00      0.00     141.23  25.05  ?       ?      0.00    25.05  
1 1 1 4   16  14 o 17 75.52   21.49  179.29    97.58    179.29   97.58    0.00      0.00     75.52   21.49  ?       ?      0.00    21.49  
1 1 1 4   16  15 o 16 259.30  56.77  2926.06   821.53   2926.06  821.53   0.00      0.00     259.30  56.77  ?       ?      0.00    56.77  
1 1 1 4   16  16 o 12 137.51  25.32  615.87    192.53   615.87   192.53   0.00      0.00     137.51  25.32  ?       ?      0.00    25.32  
1 1 1 4   16  17 o 19 58.66   20.97  96.79     89.34    96.79    89.34    0.00      0.00     58.66   20.97  ?       ?      0.00    20.97  
1 1 1 4   16  18 o 13 84.62   26.38  241.16    142.00   241.16   142.00   0.00      0.00     84.62   26.38  ?       ?      0.00    26.38  
1 1 1 4   16  19 o 2  156.34  33.21  903.03    288.83   903.03   288.83   0.00      0.00     156.34  33.21  ?       ?      0.00    33.21  
1 1 1 4   16  20 o 3  126.06  30.12  584.49    214.95   584.49   214.95   0.00      0.00     126.06  30.12  ?       ?      0.00    30.12  
1 1 1 4   16  21 o 5  70.74   26.19  165.03    141.11   165.03   141.11   0.00      0.00     70.74   26.19  ?       ?      0.00    26.19  
1 1 1 4   16  22 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   17  0  o 11 309.76  28.84  2976.54   507.01   2910.65  797.29   3021.27   656.95   286.14  50.38  303.58  38.56  -17.44  63.44  
1 1 1 4   17  1  o 17 298.26  39.88  2944.12   665.70   0.00     0.00     2944.12   665.70   ?       ?      298.26  39.88  0.00    39.88  
1 1 1 4   17  2  o 8  149.28  17.97  666.84    150.90   782.69   208.71   539.93    218.43   159.77  23.45  129.70  29.94  30.07   38.03  
1 1 1 4   17  3  o 8  192.40  21.48  1119.45   233.22   1199.06  325.87   1035.85   333.92   194.70  30.13  178.63  33.80  16.07   45.28  
1 1 1 4   17  4  o 14 127.28  16.03  483.17    114.54   597.33   157.06   353.46    167.42   140.36  20.06  105.34  27.42  35.02   33.98  
1 1 1 4   17  5  o 3  133.67  16.55  533.93    124.28   561.45   170.04   502.37    182.09   134.90  22.77  126.19  26.00  8.70    34.56  
1 1 1 4   17  6  o 7  300.29  30.81  2860.23   523.58   3158.51  835.09   2667.04   672.07   292.93  51.54  277.48  43.63  15.45   67.53  
1 1 1 4   17  7  o 10 120.43  15.85  434.27    106.94   444.12   143.73   422.06    160.05   119.79  21.70  115.54  24.87  4.26    33.00  
1 1 1 4   17  8  o 16 225.83  23.66  1571.05   302.23   1630.82  452.42   1522.88   406.14   219.91  37.16  214.90  34.06  5.02    50.40  
1 1 1 4   17  9  o 4  174.11  19.39  919.59    190.55   1012.67  271.73   829.53    267.27   178.32  27.42  159.37  30.32  18.95   40.88  
1 1 1 4   17  10 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   17  11 o 14 188.72  22.11  1103.83   234.95   1224.04  326.54   974.78    338.32   192.83  30.51  167.30  36.27  25.53   47.40  
1 1 1 4   17  12 o 12 195.86  22.50  1197.11   248.44   1211.53  346.16   1181.80   356.77   188.80  33.15  184.91  34.89  3.90    48.12  
1 1 1 4   17  13 o 15 123.11  16.69  461.86    114.89   418.03   152.35   519.67    174.95   113.64  24.10  126.56  24.97  -12.92  34.70  
1 1 1 4   17  14 o 5  130.17  17.20  519.39    125.39   513.02   167.62   527.49    188.95   125.73  24.10  125.78  26.98  -0.05   36.17  
1 1 1 4   17  15 o 14 44.57   17.50  39.65     65.42    60.14    77.64    -10.55    121.51   50.51   19.27  49.81   21.92  0.70    29.19  
1 1 1 4   17  16 o 12 137.62  18.21  590.49    140.36   620.19   188.20   553.26    210.69   136.69  24.90  125.33  29.73  11.35   38.78  
1 1 1 4   17  17 o 1  145.18  20.83  677.52    168.62   753.92   228.09   585.45    250.40   147.34  27.99  123.75  34.14  23.59   44.15  
1 1 1 4   17  18 o 1  51.35   20.96  49.26     97.60    49.08    120.26   49.59     167.05   54.85   22.90  61.15   26.32  -6.31   34.89  
1 1 1 4   17  19 o 18 132.73  21.43  586.00    157.69   610.27   207.24   552.63    243.02   128.62  28.79  116.07  34.18  12.55   44.68  
1 1 1 4   17  20 o 11 100.39  23.29  352.84    131.59   374.85   165.61   315.16    216.74   99.60   27.87  88.20   32.50  11.40   42.81  
1 1 1 4   18  0  o 6  73.20   15.36  163.42    62.50    122.26   77.33    240.94    106.12   63.64   19.41  87.76   21.28  -24.12  28.80  
1 1 1 4   18  1  o 4  97.69   15.32  287.36    83.09    282.89   106.33   294.38    133.14   95.51   20.03  96.33   24.13  -0.83   31.36  
1 1 1 4   18  2  o 8  59.97   17.14  109.48    61.93    104.10   76.74    119.54    104.89   59.69   19.48  65.31   22.78  -5.61   29.97  
1 1 1 4   18  3  o 15 74.37   17.00  170.34    71.01    157.21   88.15    194.62    119.86   71.31   20.47  79.11   24.17  -7.80   31.67  
1 1 1 4   18  4  o 16 173.15  18.61  905.86    182.11   853.07   257.38   958.81    257.72   162.72  28.60  173.88  26.67  -11.16  39.10  
1 1 1 4   18  5  o 1  159.49  18.22  769.32    163.80   806.19   229.36   730.93    234.01   159.38  25.96  150.39  28.14  8.99    38.29  
1 1 1 4   18  6  o 19 234.03  25.53  1722.14   337.49   1913.09  503.13   1565.94   455.05   234.56  38.71  211.69  38.88  22.87   54.87  
1 1 1 4   18  7  f 0  121.33  22.20  462.70    148.94   462.70   148.94   0.00      0.00     121.33  22.20  ?       ?      0.00    22.20  
1 1 1 4   18  8  f 0  59.72   18.08  108.63    67.28    85.78    81.74    156.60    118.45   56.27   20.07  72.02   24.23  -15.75  31.46  
1 1 1 4   18  9  f 0  102.15  21.21  330.39    120.34   330.39   120.34   0.00      0.00     102.15  21.21  ?       ?      0.00    21.21  
1 1 1 4   18  10 o 14 66.47   24.69  119.25    125.53   0.00     0.00     119.25    125.53   ?       ?      66.47   24.69  0.00    24.69  
1 1 1 4   18  11 o 14 126.67  17.07  491.66    120.98   503.64   159.28   475.31    186.01   125.20  23.01  118.81  27.77  6.39    36.07  
1 1 1 4   18  12 o 13 164.21  19.84  841.81    183.25   862.56   250.06   817.75    269.33   160.06  28.25  152.84  31.74  7.22    42.49  
1 1 1 4   18  13 o 4  99.22   16.89  306.32    92.77    297.12   116.31   322.40    153.77   95.50   21.71  97.11   26.74  -1.62   34.44  
1 1 1 4   18  14 o 1  182.62  22.52  1079.81   231.07   1143.09  319.15   1010.09   335.00   177.91  32.44  161.95  36.86  15.96   49.11  
1 1 1 4   18  15 o 4  122.07  17.64  468.93    120.02   461.90   156.47   478.96    187.07   116.92  24.11  115.81  28.37  1.11    37.23  
1 1 1 4   18  16 o 17 213.70  30.19  1657.91   360.04   1924.06  502.09   1376.21   516.55   208.93  43.29  159.32  50.41  49.61   66.45  
1 1 1 4   18  17 o 13 112.98  20.89  423.96    130.49   417.06   168.59   434.27    206.08   106.90  27.36  105.17  31.60  1.72    41.80  
1 1 1 4   19  0  o 9  85.14   15.55  221.41    73.21    241.03   91.59    186.70    121.82   87.91   18.72  77.22   24.49  10.70   30.83  
1 1 1 4   19  1  o 12 170.07  31.04  966.83    291.90   0.00     0.00     966.83    291.90   ?       ?      170.07  31.04  0.00    31.04  
1 1 1 4   19  2  o 3  135.92  26.65  601.96    200.47   0.00     0.00     601.96    200.47   ?       ?      135.92  26.65  0.00    26.65  
1 1 1 4   19  3  o 14 84.94   24.36  232.85    124.96   0.00     0.00     232.85    124.96   ?       ?      84.94   24.36  0.00    24.36  
1 1 1 4   19  4  o 16 59.61   22.91  83.70     110.30   0.00     0.00     83.70     110.30   ?       ?      59.61   22.91  0.00    22.91  
1 1 1 4   19  5  o 1  50.66   21.59  14.61     110.51   0.00     0.00     14.61     110.51   ?       ?      50.66   21.59  0.00    21.59  
1 1 1 4   19  6  o 9  123.72  27.26  510.43    188.39   0.00     0.00     510.43    188.39   ?       ?      123.72  27.26  0.00    27.26  
1 1 1 4   19  7  o 8  136.50  27.04  620.26    204.40   0.00     0.00     620.26    204.40   ?       ?      136.50  27.04  0.00    27.04  
1 1 1 4   19  8  o 2  151.27  29.82  784.96    249.74   0.00     0.00     784.96    249.74   ?       ?      151.27  29.82  0.00    29.82  
1 1 1 4   19  9  x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 4   19  10 o 13 193.35  23.71  1216.04   257.64   1381.21  367.69   1056.73   361.10   194.94  34.10  164.43  38.87  30.51   51.71  
1 1 1 4   19  11 o 18 91.26   17.17  262.24    86.67    271.75   107.06   244.15    147.65   91.21   20.90  84.45   26.98  6.76    34.13  
1 1 1 4   19  12 o 16 43.83   17.59  34.91     67.50    70.20    78.33    -66.84    133.01   51.91   19.46  46.65   21.49  5.26    28.99  
1 1 1 4   19  13 o 7  41.65   17.31  21.22     68.18    -1.16    79.14    85.64     134.27   41.14   17.91  61.13   24.71  -19.98  30.52  
1 1 1 5   -19 0  o 10 73.54   28.82  142.25    177.15   117.56   183.38   487.03    685.26   71.50   28.89  114.17  51.05  -42.67  58.66  
1 1 1 5   -18 0  f 0  102.15  29.42  350.09    181.88   350.09   181.88   0.00      0.00     102.15  29.42  ?       ?      0.00    29.42  
1 1 1 5   -18 1  o 12 74.90   28.04  153.96    162.58   133.82   168.62   420.19    613.09   73.04   28.26  116.49  50.28  -43.45  57.68  
1 1 1 5   -18 2  o 6  76.07   27.59  167.39    155.36   149.81   160.93   408.51    595.98   74.26   27.88  115.60  49.73  -41.34  57.01  
1 1 1 5   -18 3  o 11 87.20   28.36  245.13    162.71   236.78   169.27   346.82    590.55   86.20   28.97  112.47  48.94  -26.28  56.87  
1 1 1 5   -18 4  o 18 117.81  30.09  469.29    204.22   469.29   204.22   0.00      0.00     117.81  30.09  ?       ?      0.00    30.09  
1 1 1 5   -18 5  o 18 98.65   44.68  78.80     544.39   0.00     0.00     78.80     544.39   ?       ?      98.65   44.68  0.00    44.68  
1 1 1 5   -18 6  f 0  90.91   42.10  -86.79    520.82   0.00     0.00     -86.79    520.82   ?       ?      90.91   42.10  0.00    42.10  
1 1 1 5   -18 7  o 12 139.87  50.80  824.53    526.71   0.00     0.00     824.53    526.71   ?       ?      139.87  50.80  0.00    50.80  
1 1 1 5   -17 0  o 10 134.31  27.14  579.22    202.03   565.86   218.55   657.68    529.65   131.47  29.67  133.60  50.48  -2.14   58.55  
1 1 1 5   -17 1  o 2  103.60  27.39  347.24    165.33   388.50   175.14   9.51      501.07   109.42  27.82  96.56   43.37  12.86   51.53  
1 1 1 5   -17 2  o 15 72.52   26.42  142.60    142.67   139.75   149.39   172.13    481.03   72.80   26.95  102.99  44.49  -30.19  52.02  
1 1 1 5   -17 3  o 16 79.94   27.32  190.64    150.62   148.94   159.71   525.74    452.77   75.00   27.85  123.89  46.71  -48.89  54.38  
1 1 1 5   -17 4  x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   -17 5  o 18 133.31  25.54  563.95    188.31   632.40   213.45   323.62    399.96   140.38  27.47  107.41  42.92  32.98   50.96  
1 1 1 5   -17 6  o 10 109.25  26.35  384.40    163.34   362.12   180.91   482.67    379.93   105.27  29.01  118.93  43.15  -13.65  51.99  
1 1 1 5   -17 7  o 4  69.35   25.70  125.64    135.96   163.12   146.51   -106.67   364.79   75.56   26.87  79.04   36.10  -3.48   45.00  
1 1 1 5   -17 8  o 17 89.54   38.65  100.79    362.27   0.00     0.00     100.79    362.27   ?       ?      89.54   38.65  0.00    38.65  
1 1 1 5   -17 9  o 17 74.10   34.72  -224.96   371.35   0.00     0.00     -224.96   371.35   ?       ?      74.10   34.72  0.00    34.72  
1 1 1 5   -17 10 o 16 58.35   24.31  40.18     135.00   74.48    146.59   -151.44   346.46   63.96   25.84  74.37   34.41  -10.41  43.03  
1 1 1 5   -16 0  o 3  109.42  25.22  376.25    155.17   401.37   166.96   217.09    420.27   112.76  26.28  104.36  43.13  8.40    50.51  
1 1 1 5   -16 1  o 1  55.52   23.75  6.82      134.44   6.82     134.44   0.00      0.00     55.52   23.75  ?       ?      0.00    23.75  
1 1 1 5   -16 2  o 17 213.88  37.80  1508.22   447.10   1508.22  447.10   0.00      0.00     213.88  37.80  ?       ?      0.00    37.80  
1 1 1 5   -16 3  x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   -16 4  o 16 123.22  41.06  503.71    340.28   0.00     0.00     503.71    340.28   ?       ?      123.22  41.06  0.00    41.06  
1 1 1 5   -16 5  f 0  153.48  23.60  725.29    201.31   728.89   245.03   717.80    353.12   151.28  29.27  144.52  40.79  6.76    50.21  
1 1 1 5   -16 6  f 0  132.48  28.14  559.09    207.39   559.09   207.39   0.00      0.00     132.48  28.14  ?       ?      0.00    28.14  
1 1 1 5   -16 7  o 16 286.95  35.14  2673.38   566.79   2867.53  781.08   2457.45   823.73   281.69  50.14  250.76  58.33  30.93   76.92  
1 1 1 5   -16 8  o 7  217.05  28.25  1478.90   343.65   1655.36  451.51   1235.92   529.82   223.91  36.37  182.63  49.37  41.28   61.32  
1 1 1 5   -16 9  o 16 72.49   25.44  147.77    130.94   138.19   143.89   193.95    315.81   72.36   26.51  93.73   37.90  -21.38  46.25  
1 1 1 5   -16 10 o 4  96.88   24.50  297.41    136.31   333.34   150.79   136.81    318.80   102.25  25.72  89.47   37.32  12.78   45.32  
1 1 1 5   -16 11 o 4  105.54  39.84  336.64    329.75   0.00     0.00     336.64    329.75   ?       ?      105.54  39.84  0.00    39.84  
1 1 1 5   -16 12 o 13 89.64   37.52  145.03    323.97   0.00     0.00     145.03    323.97   ?       ?      89.64   37.52  0.00    37.52  
1 1 1 5   -16 13 o 11 129.01  23.90  525.44    170.45   548.02   191.03   437.29    377.52   130.60  26.39  114.31  42.74  16.29   50.23  
1 1 1 5   -15 0  o 19 181.15  39.46  1069.53   398.71   0.00     0.00     1069.53   398.71   ?       ?      181.15  39.46  0.00    39.46  
1 1 1 5   -15 1  o 6  246.43  30.55  1870.89   422.92   2266.76  576.38   1409.20   622.47   266.34  38.84  200.15  53.25  66.18   65.91  
1 1 1 5   -15 2  o 9  225.42  37.86  1624.25   472.57   1624.25  472.57   0.00      0.00     225.42  37.86  ?       ?      0.00    37.86  
1 1 1 5   -15 3  x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   -15 4  o 13 264.45  45.08  2315.44   659.78   2315.44  659.78   0.00      0.00     264.45  45.08  ?       ?      0.00    45.08  
1 1 1 5   -15 5  o 7  121.39  26.68  459.12    180.86   459.12   180.86   0.00      0.00     121.39  26.68  ?       ?      0.00    26.68  
1 1 1 5   -15 6  o 1  138.65  22.30  584.04    171.50   592.70   202.93   562.39    320.81   138.24  26.54  131.26  39.42  6.98    47.52  
1 1 1 5   -15 7  o 15 142.41  22.51  617.26    177.91   656.24   215.53   533.93    315.17   145.34  26.82  127.85  39.21  17.49   47.51  
1 1 1 5   -15 8  o 3  124.26  22.85  474.43    157.02   502.07   182.45   395.51    308.31   126.86  25.93  113.02  39.07  13.84   46.89  
1 1 1 5   -15 9  o 1  206.67  25.82  1311.20   299.65   1450.88  393.52   1118.43   462.28   213.29  33.22  179.49  44.96  33.79   55.91  
1 1 1 5   -15 10 o 3  175.80  23.06  941.94    227.14   910.59   284.46   997.09    377.30   169.37  30.37  172.46  39.02  -3.09   49.45  
1 1 1 5   -15 11 o 5  202.12  34.87  1328.18   389.99   1328.18  389.99   0.00      0.00     202.12  34.87  ?       ?      0.00    34.87  
1 1 1 5   -15 12 o 8  79.02   23.38  192.49    113.53   206.42   125.08   127.35    270.52   81.77   24.63  84.86   34.79  -3.09   42.62  
1 1 1 5   -15 13 o 10 101.94  37.28  310.36    284.44   0.00     0.00     310.36    284.44   ?       ?      101.94  37.28  0.00    37.28  
1 1 1 5   -15 14 o 12 90.22   36.54  176.53    294.02   0.00     0.00     176.53    294.02   ?       ?      90.22   36.54  0.00    36.54  
1 1 1 5   -15 15 o 17 23.17   9.57   4.47      20.67    3.90     20.73    113.35    287.81   23.04   9.56   84.27   35.33  -61.23  36.60  
1 1 1 5   -15 16 o 7  180.69  24.45  1021.08   247.10   1123.10  311.34   847.43    406.17   185.85  30.22  151.11  44.10  34.74   53.46  
1 1 1 5   -14 0  o 4  206.15  25.11  1269.21   291.05   1365.78  380.77   1133.50   451.39   211.38  32.41  188.27  42.74  23.11   53.64  
1 1 1 5   -14 1  o 11 113.59  36.57  386.80    270.84   0.00     0.00     386.80    270.84   ?       ?      113.59  36.57  0.00    36.57  
1 1 1 5   -14 2  x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   -14 3  o 15 181.47  38.39  1041.64   387.47   0.00     0.00     1041.64   387.47   ?       ?      181.47  38.39  0.00    38.39  
1 1 1 5   -14 4  o 8  252.15  28.63  1918.60   407.08   1983.13  554.63   1843.23   599.38   250.99  39.82  238.77  45.39  12.22   60.38  
1 1 1 5   -14 5  o 6  257.98  29.08  2014.50   423.16   2033.07  577.92   1993.04   621.31   252.94  41.22  247.99  45.31  4.95    61.26  
1 1 1 5   -14 6  o 9  326.03  56.59  3629.66   1020.71  3629.66  1020.71  0.00      0.00     326.03  56.59  ?       ?      0.00    56.59  
1 1 1 5   -14 7  o 1  330.16  57.86  3764.29   1056.65  3764.29  1056.65  0.00      0.00     330.16  57.86  ?       ?      0.00    57.86  
1 1 1 5   -14 8  o 12 145.87  25.79  650.95    208.06   650.95   208.06   0.00      0.00     145.87  25.79  ?       ?      0.00    25.79  
1 1 1 5   -14 9  o 5  125.40  20.60  474.36    143.16   500.31   171.39   414.46    260.38   127.80  24.25  115.11  35.70  12.69   43.16  
1 1 1 5   -14 10 o 6  170.81  21.85  876.75    209.32   977.40   267.86   718.91    335.45   178.53  26.98  148.19  38.93  30.34   47.37  
1 1 1 5   -14 11 o 19 93.43   21.98  269.23    115.89   275.13   132.99   250.61    236.25   94.13   24.41  94.77   34.07  -0.63   41.91  
1 1 1 5   -14 12 o 11 103.07  21.23  326.46    121.43   300.63   139.81   405.79    244.98   98.11   24.81  112.70  34.57  -14.59  42.55  
1 1 1 5   -14 13 o 17 158.39  21.24  759.14    188.25   862.56   236.08   578.54    311.98   167.28  25.38  131.84  38.70  35.44   46.28  
1 1 1 5   -14 14 o 8  98.86   21.64  302.74    119.40   199.61   134.45   687.71    259.77   81.15   25.72  145.87  31.91  -64.71  40.99  
1 1 1 5   -14 15 o 18 30.74   14.87  -127.76   80.40    -124.38  85.34    -154.45   239.79   32.38   15.58  61.93   28.64  -29.55  32.61  
1 1 1 5   -14 16 o 19 183.83  39.53  1156.65   404.80   0.00     0.00     1156.65   404.80   ?       ?      183.83  39.53  0.00    39.53  
1 1 1 5   -14 17 o 14 79.53   32.22  124.69    228.82   0.00     0.00     124.69    228.82   ?       ?      79.53   32.22  0.00    32.22  
1 1 1 5   -14 18 o 11 101.37  24.05  327.31    137.82   255.00   160.36   531.72    269.60   89.54   28.06  124.39  35.82  -34.84  45.50  
1 1 1 5   -13 0  o 5  414.63  46.73  5342.38   1092.95  5913.77  1537.82  4759.18   1553.64  421.88  65.63  369.43  75.80  52.46   100.27 
1 1 1 5   -13 1  o 1  494.29  92.02  9011.28   2514.96  9011.28  2514.96  0.00      0.00     494.29  92.02  ?       ?      0.00    92.02  
1 1 1 5   -13 2  x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   -13 3  o 11 143.26  27.43  621.71    217.39   621.71   217.39   0.00      0.00     143.26  27.43  ?       ?      0.00    27.43  
1 1 1 5   -13 4  x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   -13 5  o 4  123.42  35.02  466.92    259.58   0.00     0.00     466.92    259.58   ?       ?      123.42  35.02  0.00    35.02  
1 1 1 5   -13 6  o 8  67.62   29.36  -23.67    211.61   0.00     0.00     -23.67    211.61   ?       ?      67.62   29.36  0.00    29.36  
1 1 1 5   -13 7  o 13 106.83  20.11  343.10    118.81   370.36   139.13   269.71    228.29   110.57  22.68  98.22   33.63  12.35   40.57  
1 1 1 5   -13 8  o 4  396.18  44.49  4931.81   994.28   5329.86  1400.21  4526.97   1412.11  395.15  63.91  356.61  71.47  38.54   95.88  
1 1 1 5   -13 9  o 14 123.99  24.48  468.53    168.07   468.53   168.07   0.00      0.00     123.99  24.48  ?       ?      0.00    24.48  
1 1 1 5   -13 10 o 5  219.17  35.41  1497.09   430.33   1497.09  430.33   0.00      0.00     219.17  35.41  ?       ?      0.00    35.41  
1 1 1 5   -13 11 o 12 81.42   21.00  202.13    98.82    209.75   112.74   176.84    205.31   83.00   22.91  84.90   31.56  -1.89   39.00  
1 1 1 5   -13 12 o 11 133.59  19.76  534.58    146.95   532.50   183.18   538.32    246.12   131.76  25.14  130.36  32.89  1.40    41.40  
1 1 1 5   -13 13 o 9  168.59  20.79  850.70    196.98   899.22   259.73   785.01    302.21   170.98  27.39  156.65  34.54  14.32   44.08  
1 1 1 5   -13 14 o 13 70.48   21.53  148.53    95.12    3.14     104.40   858.76    230.75   49.13   20.97  167.68  24.71  -118.55 32.41  
1 1 1 5   -13 15 o 19 164.40  21.12  815.27    194.74   862.26   256.48   751.31    299.25   166.35  27.84  151.81  35.05  14.54   44.76  
1 1 1 5   -13 16 o 14 208.07  24.45  1322.13   286.46   1379.69  387.95   1253.12   424.77   207.30  33.76  193.67  39.54  13.63   52.00  
1 1 1 5   -13 17 o 14 111.23  21.26  381.19    130.80   390.44   157.62   360.73    234.39   111.32  25.25  106.21  34.00  5.11    42.35  
1 1 1 5   -13 18 o 9  132.89  33.77  586.61    258.07   0.00     0.00     586.61    258.07   ?       ?      132.89  33.77  0.00    33.77  
1 1 1 5   -13 19 o 18 79.96   31.87  139.17    219.98   0.00     0.00     139.17    219.98   ?       ?      79.96   31.87  0.00    31.87  
1 1 1 5   -13 20 o 6  146.53  21.76  663.93    177.45   725.25   223.73   559.95    291.34   150.62  26.86  126.78  37.44  23.84   46.08  
1 1 1 5   -12 0  o 16 289.63  30.55  2510.60   500.27   2394.27  699.59   2632.34   715.65   276.04  45.75  290.43  44.33  -14.39  63.70  
1 1 1 5   -12 1  x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   -12 2  o 7  308.83  33.37  2870.62   582.19   3086.69  817.31   2648.04   829.52   313.74  46.81  287.28  52.22  26.45   70.13  
1 1 1 5   -12 3  o 18 72.85   20.87  158.22    91.73    87.82    104.96   385.92    188.77   61.40   22.62  112.29  29.06  -50.88  36.82  
1 1 1 5   -12 4  o 11 397.66  43.25  4859.15   971.52   5112.02  1369.04  4602.63   1378.89  394.74  62.49  370.62  67.29  24.11   91.83  
1 1 1 5   -12 5  o 1  305.80  32.51  2798.72   561.97   2807.90  787.45   2789.20   802.25   299.77  47.33  298.15  48.54  1.62    67.79  
1 1 1 5   -12 6  o 2  286.16  30.83  2440.30   498.51   2661.01  696.02   2207.83   714.33   294.40  42.40  264.97  48.76  29.43   64.62  
1 1 1 5   -12 7  o 3  278.14  45.64  2400.20   703.50   0.00     0.00     2400.20   703.50   ?       ?      278.14  45.64  0.00    45.64  
1 1 1 5   -12 8  o 6  131.12  34.04  528.42    258.43   0.00     0.00     528.42    258.43   ?       ?      131.12  34.04  0.00    34.04  
1 1 1 5   -12 9  f 0  233.52  25.38  1613.60   334.80   1652.02  463.10   1571.53   484.59   233.04  35.76  226.12  38.72  6.92    52.71  
1 1 1 5   -12 10 o 1  167.79  20.55  831.77    193.85   984.91   255.34   623.43    297.82   181.61  25.17  141.46  36.45  40.15   44.29  
1 1 1 5   -12 11 o 13 375.99  64.94  4828.05   1350.99  4828.05  1350.99  0.00      0.00     375.99  64.94  ?       ?      0.00    64.94  
1 1 1 5   -12 12 o 3  122.69  24.14  458.24    163.99   458.24   163.99   0.00      0.00     122.69  24.14  ?       ?      0.00    24.14  
1 1 1 5   -12 13 o 13 305.32  52.15  3098.11   881.17   0.00     0.00     3098.11   881.17   ?       ?      305.32  52.15  0.00    52.15  
1 1 1 5   -12 14 o 9  129.50  29.83  523.93    217.22   0.00     0.00     523.93    217.22   ?       ?      129.50  29.83  0.00    29.83  
1 1 1 5   -12 15 o 6  153.52  19.19  702.22    165.47   782.15   222.26   602.83    247.85   160.26  24.97  138.02  31.92  22.24   40.53  
1 1 1 5   -12 16 o 18 101.09  18.90  309.94    105.66   288.50   136.99   341.41    165.99   96.35   24.66  104.37  27.37  -8.01   36.85  
1 1 1 5   -12 17 o 16 76.41   27.21  158.66    150.27   0.00     0.00     158.66    150.27   ?       ?      76.41   27.21  0.00    27.21  
1 1 1 5   -12 18 o 11 142.28  19.04  609.02    151.65   703.72   204.02   492.12    226.69   151.09  24.35  123.30  31.82  27.79   40.06  
1 1 1 5   -12 19 o 3  120.96  18.15  441.81    122.16   460.06   156.91   413.74    194.63   121.69  23.31  113.29  29.60  8.40    37.68  
1 1 1 5   -12 20 o 19 167.35  32.46  916.03    300.61   0.00     0.00     916.03    300.61   ?       ?      167.35  32.46  0.00    32.46  
1 1 1 5   -12 21 o 14 78.24   28.47  171.20    165.60   0.00     0.00     171.20    165.60   ?       ?      78.24   28.47  0.00    28.47  
1 1 1 5   -11 0  o 19 278.61  43.03  2374.60   666.13   2374.60  666.13   0.00      0.00     278.61  43.03  ?       ?      0.00    43.03  
1 1 1 5   -11 1  x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   -11 2  o 16 290.58  45.08  2597.05   727.65   2597.05  727.65   0.00      0.00     290.58  45.08  ?       ?      0.00    45.08  
1 1 1 5   -11 3  o 4  118.24  15.90  411.08    105.18   458.70   135.54   339.00    166.77   124.32  19.64  105.68  27.30  18.64   33.63  
1 1 1 5   -11 4  o 1  475.02  52.00  7021.87   1394.85  7579.07  1971.52  6463.42   1973.72  475.41  74.70  431.59  82.67  43.82   111.42 
1 1 1 5   -11 5  o 4  201.34  21.63  1192.30   246.04   1295.69  341.73   1081.02   354.52   207.96  29.45  188.29  34.05  19.67   45.02  
1 1 1 5   -11 6  o 10 47.13   17.78  46.85     65.59    64.98    77.37    0.52      123.69   52.91   19.43  53.59   22.84  -0.68   29.99  
1 1 1 5   -11 7  o 4  206.79  22.28  1260.01   260.28   1419.16  364.47   1094.39   371.81   217.47  29.99  188.80  35.61  28.67   46.56  
1 1 1 5   -11 8  o 13 133.29  17.02  522.52    127.30   568.38   173.28   468.76    187.62   137.94  22.67  124.12  27.09  13.81   35.33  
1 1 1 5   -11 9  o 7  163.26  28.74  804.08    259.52   0.00     0.00     804.08    259.52   ?       ?      163.26  28.74  0.00    28.74  
1 1 1 5   -11 10 o 9  210.35  34.68  1342.01   404.19   0.00     0.00     1342.01   404.19   ?       ?      210.35  34.68  0.00    34.68  
1 1 1 5   -11 11 o 11 279.05  29.73  2313.61   468.96   2663.72  660.05   1956.71   666.41   295.89  39.87  249.60  48.25  46.29   62.60  
1 1 1 5   -11 12 o 4  100.71  17.52  302.21    97.60    385.99   129.34   191.42    148.74   113.52  20.61  82.37   27.14  31.15   34.08  
1 1 1 5   -11 13 o 2  19.74   7.41   8.22      11.36    8.22     11.36    0.00      0.00     19.74   7.41   ?       ?      0.00    7.41   
1 1 1 5   -11 14 o 9  347.21  59.27  4065.85   1138.93  4065.85  1138.93  0.00      0.00     347.21  59.27  ?       ?      0.00    59.27  
1 1 1 5   -11 15 o 15 155.30  26.67  735.08    229.19   735.08   229.19   0.00      0.00     155.30  26.67  ?       ?      0.00    26.67  
1 1 1 5   -11 16 o 5  247.58  26.85  1849.17   375.50   1953.65  526.88   1741.32   535.29   248.79  38.10  232.67  41.60  16.12   56.42  
1 1 1 5   -11 17 o 15 148.55  18.12  655.69    151.32   723.08   203.67   572.65    226.07   154.35  23.75  135.01  29.95  19.34   38.22  
1 1 1 5   -11 18 o 19 109.77  17.19  361.32    104.77   378.02   134.45   335.51    167.18   111.03  21.87  103.38  27.64  7.65    35.24  
1 1 1 5   -11 19 o 19 97.96   17.84  290.84    96.64    311.05   121.33   255.77    159.82   100.37  21.69  90.99   27.93  9.38    35.36  
1 1 1 5   -11 20 o 1  115.44  17.53  401.33    112.49   450.35   144.79   326.68    178.68   121.08  21.62  101.34  29.15  19.74   36.30  
1 1 1 5   -11 21 f 0  127.82  28.87  525.81    206.81   0.00     0.00     525.81    206.81   ?       ?      127.82  28.87  0.00    28.87  
1 1 1 5   -11 22 o 4  103.22  28.75  346.27    176.69   0.00     0.00     346.27    176.69   ?       ?      103.22  28.75  0.00    28.75  
1 1 1 5   -11 23 o 19 114.43  29.47  432.80    194.78   0.00     0.00     432.80    194.78   ?       ?      114.43  29.47  0.00    29.47  
1 1 1 5   -10 0  x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   -10 1  f 0  144.33  16.15  608.69    131.50   590.07   179.19   630.41    193.59   140.82  22.95  145.44  24.02  -4.62   33.23  
1 1 1 5   -10 2  o 19 59.83   17.59  105.09    64.43    105.09   64.43    0.00      0.00     59.83   17.59  ?       ?      0.00    17.59  
1 1 1 5   -10 3  o 4  405.26  64.72  5214.92   1454.98  5214.92  1454.98  0.00      0.00     405.26  64.72  ?       ?      0.00    64.72  
1 1 1 5   -10 4  o 10 282.48  29.29  2354.39   468.17   2504.79  661.60   2203.53   662.59   287.82  41.22  268.50  44.55  19.32   60.69  
1 1 1 5   -10 5  o 19 192.58  20.30  1085.26   221.07   1182.17  311.99   987.53    313.31   199.47  28.02  181.23  31.24  18.24   41.96  
1 1 1 5   -10 6  o 2  88.14   14.40  229.76    70.36    227.51   97.29    232.23    101.87   86.94   19.92  87.81   20.57  -0.86   28.64  
1 1 1 5   -10 7  o 2  169.95  18.32  845.17    175.91   898.78   247.12   790.09    250.47   173.84  25.52  162.23  27.90  11.61   37.81  
1 1 1 5   -10 8  o 6  305.05  31.92  2770.59   550.67   2981.01  778.24   2559.60   779.29   311.40  44.82  286.25  49.20  25.15   66.55  
1 1 1 5   -10 9  o 13 163.31  17.95  781.68    165.53   826.76   232.87   735.63    235.35   166.43  25.16  156.30  27.22  10.13   37.06  
1 1 1 5   -10 10 o 1  113.05  15.96  376.79    100.70   327.13   136.57   435.97    149.08   103.90  23.45  120.49  22.38  -16.59  32.42  
1 1 1 5   -10 11 o 6  89.85   25.00  242.80    133.61   0.00     0.00     242.80    133.61   ?       ?      89.85   25.00  0.00    25.00  
1 1 1 5   -10 12 o 14 248.80  39.45  1889.42   544.71   0.00     0.00     1889.42   544.71   ?       ?      248.80  39.45  0.00    39.45  
1 1 1 5   -10 13 o 11 60.93   24.92  39.99     138.45   0.00     0.00     39.99     138.45   ?       ?      60.93   24.92  0.00    24.92  
1 1 1 5   -10 14 o 3  292.57  30.85  2553.98   510.32   2678.74  719.04   2427.35   724.40   294.28  43.90  278.45  46.99  15.82   64.31  
1 1 1 5   -10 15 o 14 385.62  41.75  4592.86   909.48   4786.76  1285.27  4398.39   1287.14  379.49  61.07  360.72  64.53  18.77   88.84  
1 1 1 5   -10 16 o 8  201.94  32.20  1251.96   360.78   1251.96  360.78   0.00      0.00     201.94  32.20  ?       ?      0.00    32.20  
1 1 1 5   -10 17 o 12 79.41   21.30  191.63    99.12    191.63   99.12    0.00      0.00     79.41   21.30  ?       ?      0.00    21.30  
1 1 1 5   -10 18 o 7  132.45  26.02  539.93    190.76   0.00     0.00     539.93    190.76   ?       ?      132.45  26.02  0.00    26.02  
1 1 1 5   -10 19 o 7  175.59  19.86  919.69    196.72   963.12   272.82   872.66    283.91   176.70  27.81  166.77  30.79  9.93    41.49  
1 1 1 5   -10 20 o 11 50.53   18.89  58.29     73.71    103.33   90.65    -29.60    126.63   61.42   21.19  50.53   22.30  10.89   30.76  
1 1 1 5   -10 21 f 0  180.14  20.51  977.30    208.36   1050.34  288.85   898.06    300.85   183.12  28.40  166.93  32.56  16.19   43.21  
1 1 1 5   -10 22 o 14 179.26  20.49  971.79    207.06   1056.88  286.14   878.26    299.99   183.18  28.11  163.99  33.01  19.18   43.35  
1 1 1 5   -10 23 o 5  225.11  25.45  1576.67   323.15   1699.96  451.40   1447.05   462.83   225.63  36.06  203.76  40.99  21.88   54.60  
1 1 1 5   -10 24 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   -9  0  o 17 296.74  46.55  2743.21   766.96   0.00     0.00     2743.21   766.96   ?       ?      296.74  46.55  0.00    46.55  
1 1 1 5   -9  1  o 14 373.85  60.73  4510.90   1258.63  0.00     0.00     4510.90   1258.63  ?       ?      373.85  60.73  0.00    60.73  
1 1 1 5   -9  2  o 16 120.40  13.68  423.47    92.89    445.80   132.62   401.95    130.15   122.54  19.51  116.07  20.27  6.47    28.13  
1 1 1 5   -9  3  f 0  195.31  20.37  1117.77   225.03   1207.09  317.96   1028.14   318.51   201.24  28.30  184.71  31.15  16.53   42.09  
1 1 1 5   -9  4  o 12 342.55  53.70  3656.33   1021.23  3656.33  1021.23  0.00      0.00     342.55  53.70  ?       ?      0.00    53.70  
1 1 1 5   -9  5  o 17 319.48  49.48  3142.00   878.20   3142.00  878.20   0.00      0.00     319.48  49.48  ?       ?      0.00    49.48  
1 1 1 5   -9  6  o 8  150.11  16.28  657.73    138.05   677.65   195.36   637.86    195.10   151.14  23.26  146.38  24.05  4.76    33.46  
1 1 1 5   -9  7  o 15 338.76  35.14  3406.64   673.43   3443.77  952.28   3369.49   952.47   334.68  51.19  330.70  51.88  3.98    72.88  
1 1 1 5   -9  8  o 3  163.29  17.47  778.60    161.25   762.71   227.42   794.66    228.66   160.06  25.61  163.55  25.16  -3.49   35.90  
1 1 1 5   -9  9  o 18 480.25  51.21  7052.20   1390.08  7529.43  1965.86  6574.95   1965.90  481.81  73.39  445.14  79.87  36.67   108.46 
1 1 1 5   -9  10 o 4  204.30  21.35  1224.11   246.68   1232.55  347.27   1215.52   350.47   202.75  30.80  201.17  31.37  1.59    43.97  
1 1 1 5   -9  11 o 1  240.15  25.00  1700.98   339.60   1737.68  478.77   1663.82   481.78   239.47  35.94  233.82  37.13  5.65    51.67  
1 1 1 5   -9  12 o 1  344.34  37.09  3577.29   721.72   -1.53    1016.57  7214.25   1024.80  145.14  63.66  490.46  36.66  -345.32 73.46  
1 1 1 5   -9  13 o 11 127.81  24.37  491.96    172.29   0.00     0.00     491.96    172.29   ?       ?      127.81  24.37  0.00    24.37  
1 1 1 5   -9  14 o 8  318.71  50.46  3171.57   892.45   0.00     0.00     3171.57   892.45   ?       ?      318.71  50.46  0.00    50.46  
1 1 1 5   -9  15 o 5  245.65  25.90  1782.24   359.69   1822.86  505.96   1740.74   511.44   244.97  37.14  238.76  38.63  6.21    53.59  
1 1 1 5   -9  16 o 16 227.53  24.11  1530.41   310.11   1511.99  436.76   1549.14   440.40   222.56  35.37  225.40  35.18  -2.84   49.89  
1 1 1 5   -9  17 o 12 87.16   21.23  230.81    105.24   230.81   105.24   0.00      0.00     87.16   21.23  ?       ?      0.00    21.23  
1 1 1 5   -9  18 o 16 107.21  21.37  348.66    126.88   348.66   126.88   0.00      0.00     107.21  21.37  ?       ?      0.00    21.37  
1 1 1 5   -9  19 o 8  303.25  51.48  3079.65   864.24   3079.65  864.24   0.00      0.00     303.25  51.48  ?       ?      0.00    51.48  
1 1 1 5   -9  20 o 3  291.54  31.68  2625.44   521.67   2788.78  736.71   2461.18   738.79   290.17  45.74  269.19  49.64  20.97   67.50  
1 1 1 5   -9  21 o 11 205.93  22.53  1278.77   262.00   1346.37  367.01   1208.52   374.14   206.60  31.98  193.93  34.89  12.67   47.33  
1 1 1 5   -9  22 o 17 99.29   16.12  296.33    88.71    328.72   115.60   249.96    138.34   103.54  20.17  89.50   25.62  14.04   32.61  
1 1 1 5   -9  23 o 19 172.82  19.80  901.07    192.91   959.72   268.70   838.69    277.12   174.59  27.74  161.23  31.07  13.36   41.65  
1 1 1 5   -9  24 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   -9  25 o 8  105.08  17.68  337.85    102.86   315.76   138.17   365.32    154.06   99.19   24.43  106.37  25.55  -7.18   35.35  
1 1 1 5   -8  0  o 14 371.53  39.94  4252.29   838.58   4416.31  1186.05  4088.33   1185.82  365.34  58.53  349.00  61.43  16.34   84.85  
1 1 1 5   -8  1  o 8  132.03  20.71  520.18    151.83   0.00     0.00     520.18    151.83   ?       ?      132.03  20.71  0.00    20.71  
1 1 1 5   -8  2  x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   -8  3  o 16 198.02  30.34  1185.46   333.95   0.00     0.00     1185.46   333.95   ?       ?      198.02  30.34  0.00    30.34  
1 1 1 5   -8  4  o 8  290.99  30.30  2526.90   498.67   2731.24  705.42   2322.77   705.04   297.44  42.52  271.90  46.86  25.54   63.28  
1 1 1 5   -8  5  o 5  199.48  20.66  1168.31   233.19   1227.58  329.36   1108.74   330.20   202.37  29.19  191.60  31.09  10.77   42.64  
1 1 1 5   -8  6  o 7  187.40  28.56  1051.31   297.59   1051.31  297.59   0.00      0.00     187.40  28.56  ?       ?      0.00    28.56  
1 1 1 5   -8  7  o 16 58.21   16.15  100.74    55.84    100.74   55.84    0.00      0.00     58.21   16.15  ?       ?      0.00    16.15  
1 1 1 5   -8  8  f 0  284.54  29.38  2389.05   472.96   2376.86  668.70   2401.24   669.03   279.59  43.04  281.13  42.80  -1.54   60.70  
1 1 1 5   -8  9  o 9  361.39  37.49  3887.57   766.44   4081.50  1083.76  3693.53   1084.05  364.01  53.45  344.49  56.79  19.52   77.99  
1 1 1 5   -8  10 o 1  185.93  19.32  1009.87   203.20   1087.98  286.05   930.30    288.70   191.61  26.73  176.28  29.57  15.33   39.87  
1 1 1 5   -8  11 o 5  173.45  18.42  879.10    180.60   714.97   251.68   1053.30   259.29   153.99  29.55  188.89  24.49  -34.90  38.37  
1 1 1 5   -8  12 o 19 304.69  33.43  2766.37   575.07   -221.29  810.29   5798.41   816.29   124.28  55.54  442.81  32.33  -318.52 64.27  
1 1 1 5   -8  13 o 12 444.64  47.76  6089.28   1199.88  6265.00  1696.64  5913.46   1697.14  434.86  70.37  420.20  73.00  14.66   101.39 
1 1 1 5   -8  14 o 18 306.60  32.10  2808.29   556.63   2829.73  786.45   2786.77   787.95   301.35  46.99  298.74  47.54  2.60    66.84  
1 1 1 5   -8  15 o 15 72.78   22.29  154.50    101.85   0.00     0.00     154.50    101.85   ?       ?      72.78   22.29  0.00    22.29  
1 1 1 5   -8  16 o 3  221.51  35.05  1486.50   430.83   0.00     0.00     1486.50   430.83   ?       ?      221.51  35.05  0.00    35.05  
1 1 1 5   -8  17 o 14 146.53  16.94  629.60    139.89   613.30   193.39   647.48    202.60   143.01  24.43  146.92  24.91  -3.91   34.89  
1 1 1 5   -8  18 f 0  438.34  48.30  6060.53   1195.39  6192.29  1690.14  5928.65   1690.92  421.13  72.53  409.81  74.62  11.32   104.06 
1 1 1 5   -8  19 f 0  388.59  70.77  5442.38   1520.59  5442.38  1520.59  0.00      0.00     388.59  70.77  ?       ?      0.00    70.77  
1 1 1 5   -8  20 o 5  265.41  43.61  2273.62   641.44   2273.62  641.44   0.00      0.00     265.41  43.61  ?       ?      0.00    43.61  
1 1 1 5   -8  21 o 11 94.89   15.68  269.22    82.45    257.35   111.11   283.76    122.99   91.55   21.51  95.98   22.68  -4.43   31.26  
1 1 1 5   -8  22 o 2  66.27   17.64  133.67    68.27    175.73   87.29    67.40     109.56   75.71   19.85  58.40   22.73  17.31   30.18  
1 1 1 5   -8  23 o 14 226.66  38.70  1701.89   485.55   1701.89  485.55   0.00      0.00     226.66  38.70  ?       ?      0.00    38.70  
1 1 1 5   -8  24 o 15 66.65   23.57  121.45    112.59   0.00     0.00     121.45    112.59   ?       ?      66.65   23.57  0.00    23.57  
1 1 1 5   -8  25 o 16 83.70   17.82  215.81    83.01    224.77   111.34   204.61    124.57   84.51   22.54  80.98   24.62  3.53    33.38  
1 1 1 5   -8  26 f 0  129.01  26.71  539.41    191.30   0.00     0.00     539.41    191.30   ?       ?      129.01  26.71  0.00    26.71  
1 1 1 5   -7  0  o 17 230.57  23.95  1579.91   312.40   1603.94  441.68   1555.85   441.92   228.19  34.82  224.40  35.48  3.80    49.71  
1 1 1 5   -7  1  o 18 167.74  17.39  826.59    164.98   845.75   232.93   807.31    233.71   167.72  24.95  163.56  25.74  4.16    35.85  
1 1 1 5   -7  2  o 8  216.11  22.43  1383.10   274.22   1371.20  387.75   1395.01   387.87   211.51  33.01  213.50  32.68  -1.99   46.45  
1 1 1 5   -7  3  o 19 167.08  25.66  840.74    238.25   0.00     0.00     840.74    238.25   ?       ?      167.08  25.66  0.00    25.66  
1 1 1 5   -7  4  o 7  421.24  75.94  6346.38   1768.78  0.00     0.00     6346.38   1768.78  ?       ?      421.24  75.94  0.00    75.94  
1 1 1 5   -7  5  o 18 243.92  37.96  1835.91   514.21   0.00     0.00     1835.91   514.21   ?       ?      243.92  37.96  0.00    37.96  
1 1 1 5   -7  6  o 7  257.73  26.78  1974.03   390.49   2012.33  552.23   1935.74   552.23   255.64  38.85  250.24  39.77  5.40    55.60  
1 1 1 5   -7  7  o 6  362.21  59.15  4255.96   1187.51  0.00     0.00     4255.96   1187.51  ?       ?      362.21  59.15  0.00    59.15  
1 1 1 5   -7  8  o 5  289.77  45.07  2596.11   725.38   2596.11  725.38   0.00      0.00     289.77  45.07  ?       ?      0.00    45.07  
1 1 1 5   -7  9  o 19 279.28  42.93  2383.18   666.27   2383.18  666.27   0.00      0.00     279.28  42.93  ?       ?      0.00    42.93  
1 1 1 5   -7  10 o 11 411.95  43.27  5109.13   1008.01  4991.20  1425.25  5227.16   1425.84  396.15  64.92  406.61  63.13  -10.46  90.55  
1 1 1 5   -7  11 o 8  253.41  26.90  1888.84   385.41   0.82     541.79   3823.00   548.37   110.51  47.47  361.57  26.61  -251.06 54.42  
1 1 1 5   -7  12 o 17 201.07  20.85  1182.39   237.21   1205.19  333.93   1159.17   337.03   201.13  29.82  196.94  30.82  4.19    42.89  
1 1 1 5   -7  13 o 9  666.71  75.55  14425.55  2840.68  14710.02 4017.28  14141.06  4017.37  628.64  115.58 612.42  118.55 16.22   165.57 
1 1 1 5   -7  14 o 8  377.58  39.77  4300.00   849.18   4294.61  1200.55  4305.39   1201.30  367.30  58.93  367.80  58.88  -0.50   83.30  
1 1 1 5   -7  15 o 14 285.69  29.81  2428.28   481.70   2516.60  680.47   2339.57   681.99   285.82  42.79  274.51  44.82  11.31   61.96  
1 1 1 5   -7  16 o 5  146.44  16.74  628.50    138.20   598.80   190.64   661.39    200.63   141.29  24.39  148.67  24.35  -7.38   34.46  
1 1 1 5   -7  17 o 1  453.15  77.50  6961.79   1943.67  0.00     0.00     6961.79   1943.67  ?       ?      453.15  77.50  0.00    77.50  
1 1 1 5   -7  18 o 19 219.83  34.80  1466.87   424.51   0.00     0.00     1466.87   424.51   ?       ?      219.83  34.80  0.00    34.80  
1 1 1 5   -7  19 o 12 298.04  31.46  2668.66   530.15   2708.97  748.74   2628.13   750.76   293.26  45.99  288.23  46.99  5.03    65.75  
1 1 1 5   -7  20 o 8  580.40  73.97  12231.31  2408.54  12410.29 3406.08  12052.30  3406.29  504.46  119.47 492.54  121.29 11.92   170.25 
1 1 1 5   -7  21 o 13 193.82  31.13  1160.20   334.60   1160.20  334.60   0.00      0.00     193.82  31.13  ?       ?      0.00    31.13  
1 1 1 5   -7  22 o 13 215.24  35.07  1465.38   418.42   1465.38  418.42   0.00      0.00     215.24  35.07  ?       ?      0.00    35.07  
1 1 1 5   -7  23 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   -7  24 o 1  96.20   16.38  279.29    87.22    293.17   118.67   262.99    128.62   97.14   21.82  91.59   24.13  5.55    32.53  
1 1 1 5   -7  25 o 16 62.38   21.77  107.39    95.86    107.39   95.86    0.00      0.00     62.38   21.77  ?       ?      0.00    21.77  
1 1 1 5   -7  26 o 8  163.80  19.16  814.16    176.78   808.72   246.74   819.90    253.38   158.57  28.14  159.31  28.76  -0.74   40.24  
1 1 1 5   -7  27 o 15 209.40  38.54  1550.75   446.18   1550.75  446.18   0.00      0.00     209.40  38.54  ?       ?      0.00    38.54  
1 1 1 5   -6  0  o 15 359.89  60.98  4358.94   1214.92  4358.94  1214.92  0.00      0.00     359.89  60.98  ?       ?      0.00    60.98  
1 1 1 5   -6  1  o 3  307.37  32.43  2857.93   563.68   2838.63  797.12   2877.23   797.20   297.54  48.32  299.84  47.93  -2.30   68.06  
1 1 1 5   -6  2  o 11 242.63  25.23  1752.09   346.32   1770.86  489.72   1733.31   489.83   239.35  36.82  236.54  37.31  2.82    52.42  
1 1 1 5   -6  3  o 18 379.49  41.09  4468.99   880.91   4481.48  1245.76  4456.49   1245.81  363.94  61.84  362.71  62.06  1.23    87.61  
1 1 1 5   -6  4  o 13 188.10  19.47  1042.31   207.26   1088.22  292.94   996.31    293.27   189.87  27.69  181.03  29.21  8.84    40.25  
1 1 1 5   -6  5  o 14 428.68  78.83  6704.90   1868.43  0.00     0.00     6704.90   1868.43  ?       ?      428.68  78.83  0.00    78.83  
1 1 1 5   -6  6  o 1  307.05  49.71  3032.18   846.22   0.00     0.00     3032.18   846.22   ?       ?      307.05  49.71  0.00    49.71  
1 1 1 5   -6  7  o 3  362.06  38.75  4019.41   792.83   4083.95  1121.17  3954.86   1121.28  352.39  57.40  345.80  58.57  6.59    82.01  
1 1 1 5   -6  8  o 2  542.08  62.52  9692.94   1909.98  9960.86  2701.12  9425.01   2701.13  508.52  96.05  489.63  99.50  18.89   138.29 
1 1 1 5   -6  9  o 10 193.53  20.03  1100.05   219.30   1104.08  309.58   1095.99   310.71   191.55  29.06  190.76  29.31  0.79    41.28  
1 1 1 5   -6  10 o 19 224.53  34.17  1524.26   426.60   1524.26  426.60   0.00      0.00     224.53  34.17  ?       ?      0.00    34.17  
1 1 1 5   -6  11 o 12 21.52   10.82  -183.21   59.86    -183.21  59.86    0.00      0.00     21.52   10.82  ?       ?      0.00    10.82  
1 1 1 5   -6  12 o 6  446.81  47.17  6044.99   1191.63  6153.99  1685.15  5935.96   1685.28  438.43  69.25  429.47  70.82  8.96    99.05  
1 1 1 5   -6  13 o 9  418.51  43.81  5263.52   1036.97  5724.91  1466.55  4802.20   1466.44  427.89  61.47  387.59  68.41  40.30   91.97  
1 1 1 5   -6  14 o 14 190.13  19.77  1056.88   212.59   1005.15  300.01   1109.04   301.29   183.32  29.51  193.13  27.99  -9.80   40.67  
1 1 1 5   -6  15 o 11 315.47  32.82  2961.57   585.62   2988.73  828.07   2934.40   828.32   310.97  47.92  307.84  48.47  3.14    68.16  
1 1 1 5   -6  16 o 19 374.22  39.57  4243.93   837.26   4358.83  1184.03  4129.02   1184.10  368.88  57.81  357.60  59.79  11.28   83.17  
1 1 1 5   -6  17 o 12 465.51  50.67  6769.44   1332.25  7106.48  1884.21  6432.50   1883.96  457.21  74.34  430.20  79.20  27.01   108.63 
1 1 1 5   -6  18 o 10 100.68  14.84  298.90    83.19    308.71   115.83   288.45    119.57   101.32  20.62  97.71   21.86  3.61    30.05  
1 1 1 5   -6  19 o 17 228.78  35.85  1591.88   455.43   0.00     0.00     1591.88   455.43   ?       ?      228.78  35.85  0.00    35.85  
1 1 1 5   -6  20 o 14 115.26  22.46  401.21    143.27   0.00     0.00     401.21    143.27   ?       ?      115.26  22.46  0.00    22.46  
1 1 1 5   -6  21 o 1  61.78   16.97  114.58    62.01    84.36    82.44    153.96    94.11    57.18   20.17  71.88   21.29  -14.69  29.33  
1 1 1 5   -6  22 o 15 379.78  72.57  5457.48   1524.62  5457.48  1524.62  0.00      0.00     379.78  72.57  ?       ?      0.00    72.57  
1 1 1 5   -6  23 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   -6  24 o 12 183.61  30.56  1065.18   310.82   1065.18  310.82   0.00      0.00     183.61  30.56  ?       ?      0.00    30.56  
1 1 1 5   -6  25 o 17 87.31   16.62  231.71    80.28    258.17   111.70   203.43    115.45   91.02   21.69  80.98   23.48  10.03   31.96  
1 1 1 5   -6  26 o 10 54.90   18.24  86.15     67.13    61.63    91.41    114.86    98.90    53.96   20.83  63.92   22.13  -9.96   30.39  
1 1 1 5   -6  27 o 12 90.09   17.53  249.85    87.41    242.37   119.49   258.45    128.22   87.23   23.39  89.86   24.28  -2.63   33.71  
1 1 1 5   -6  28 o 19 228.96  26.20  1680.26   338.21   1792.94  478.05   1567.35   478.55   224.01  38.57  205.38  42.01  18.63   57.03  
1 1 1 5   -5  0  o 3  325.79  34.32  3207.68   632.29   3194.70  894.15   3220.65   894.23   316.05  51.02  317.51  50.77  -1.46   71.98  
1 1 1 5   -5  1  o 16 300.01  31.41  2702.78   532.99   2675.57  753.74   2730.00   753.80   291.10  46.68  294.41  46.11  -3.31   65.62  
1 1 1 5   -5  2  o 19 327.21  34.53  3240.26   638.89   3248.11  903.49   3232.40   903.56   318.35  51.17  317.46  51.33  0.88    72.48  
1 1 1 5   -5  3  f 0  61.92   8.56   112.44    29.60    98.83    41.03    127.22    42.75    57.38   12.78  65.41   11.82  -8.03   17.41  
1 1 1 5   -5  4  o 8  414.47  45.21  5371.62   1058.28  5157.28  1496.56  5586.01   1496.72  385.22  70.26  404.52  66.78  -19.30  96.93  
1 1 1 5   -5  5  o 3  349.14  37.24  3727.36   734.87   3608.69  1039.20  3846.05   1039.33  330.88  56.75  343.41  54.54  -12.54  78.71  
1 1 1 5   -5  6  o 17 335.34  35.68  3429.54   676.35   3593.09  956.54   3266.01   956.48   333.23  51.68  315.26  54.84  17.97   75.35  
1 1 1 5   -5  7  o 18 88.53   15.22  233.39    74.55    0.00     0.00     233.39    74.55    ?       ?      88.53   15.22  0.00    15.22  
1 1 1 5   -5  8  o 19 258.08  40.55  2078.73   580.94   0.00     0.00     2078.73   580.94   ?       ?      258.08  40.55  0.00    40.55  
1 1 1 5   -5  9  o 2  49.69   9.66   73.54     26.56    68.40    35.09    80.45     40.65    47.81   12.61  51.81   13.52  -4.00   18.49  
1 1 1 5   -5  10 o 3  336.56  36.07  3432.78   685.95   1.34     968.24   6890.51   971.94   140.60  61.88  478.23  35.66  -337.62 71.42  
1 1 1 5   -5  11 o 16 439.50  75.69  6605.20   1840.87  6605.20  1840.87  0.00      0.00     439.50  75.69  ?       ?      0.00    75.69  
1 1 1 5   -5  12 o 13 217.51  33.05  1424.12   399.68   1424.12  399.68   0.00      0.00     217.51  33.05  ?       ?      0.00    33.05  
1 1 1 5   -5  13 o 5  312.42  32.28  2891.89   570.53   3069.18  806.80   2714.55   806.91   317.26  45.61  296.67  49.09  20.58   67.01  
1 1 1 5   -5  14 o 15 584.42  63.75  10676.09  2104.20  10598.28 2975.67  10753.91  2975.91  554.58  97.00  559.54  96.11  -4.96   136.55 
1 1 1 5   -5  15 o 4  636.11  120.18 15176.22  4227.87  0.00     0.00     15176.22  4227.87  ?       ?      636.11  120.18 0.00    120.18 
1 1 1 5   -5  16 o 15 223.48  34.17  1505.20   424.45   0.00     0.00     1505.20   424.45   ?       ?      223.48  34.17  0.00    34.17  
1 1 1 5   -5  17 o 3  355.77  37.53  3821.40   755.02   3816.72  1067.76  3826.09   1067.77  345.87  55.67  346.35  55.58  -0.48   78.66  
1 1 1 5   -5  18 o 9  237.29  24.79  1664.47   332.74   1668.29  470.31   1660.64   470.81   233.88  36.20  233.28  36.34  0.60    51.29  
1 1 1 5   -5  19 o 12 491.65  54.01  7593.36   1499.33  7481.06  2120.47  7705.63   2120.27  462.91  82.84  471.46  81.27  -8.56   116.05 
1 1 1 5   -5  20 o 13 129.92  23.56  507.19    169.23   0.00     0.00     507.19    169.23   ?       ?      129.92  23.56  0.00    23.56  
1 1 1 5   -5  21 o 1  290.44  46.74  2678.67   752.87   0.00     0.00     2678.67   752.87   ?       ?      290.44  46.74  0.00    46.74  
1 1 1 5   -5  22 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   -5  23 o 11 177.08  19.30  930.85    193.02   942.26   272.51   919.36    273.43   175.10  28.06  172.71  28.58  2.39    40.05  
1 1 1 5   -5  24 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   -5  25 o 16 172.31  29.21  938.26    278.67   938.26   278.67   0.00      0.00     172.31  29.21  ?       ?      0.00    29.21  
1 1 1 5   -5  26 o 9  137.04  16.74  562.60    128.95   564.36   182.43   560.85    182.31   134.20  24.59  133.75  24.65  0.46    34.82  
1 1 1 5   -5  27 o 19 135.11  16.77  549.51    127.26   574.67   181.01   524.93    178.94   135.02  24.25  128.48  25.16  6.53    34.94  
1 1 1 5   -5  28 o 1  248.86  28.81  2008.90   403.97   2013.93  572.10   2003.89   570.52   232.03  44.57  231.46  44.55  0.57    63.02  
1 1 1 5   -5  29 o 2  83.85   20.63  224.30    98.64    239.27   143.25   210.80    136.01   85.54   26.47  80.96   25.90  4.58    37.03  
1 1 1 5   -4  0  o 2  316.40  50.01  3150.57   878.16   3150.57  878.16   0.00      0.00     316.40  50.01  ?       ?      0.00    50.01  
1 1 1 5   -4  1  o 11 87.39   9.46   222.36    46.71    248.96   65.36    194.60    66.77    92.05   12.71  80.80   14.95  11.25   19.62  
1 1 1 5   -4  2  o 8  85.90   9.38   214.89    45.50    214.39   63.60    215.42    65.11    85.16   13.46  85.31   13.76  -0.15   19.25  
1 1 1 5   -4  3  o 5  54.58   7.94   87.48     24.15    81.74    32.56    94.49     36.01    52.27   11.19  56.24   11.54  -3.97   16.07  
1 1 1 5   -4  4  o 14 110.03  11.58  352.87    72.07    383.21   101.23   321.68    102.63   113.99  15.90  103.88  17.85  10.11   23.91  
1 1 1 5   -4  5  o 17 339.84  35.93  3502.19   690.35   3394.18  976.19   3610.26   976.43   323.91  54.43  335.58  52.40  -11.67  75.55  
1 1 1 5   -4  6  o 6  139.97  14.50  572.79    114.84   636.01   162.17   509.17    162.66   146.50  19.79  130.15  22.59  16.34   30.03  
1 1 1 5   -4  7  o 10 191.99  19.82  1085.27   215.33   1134.33  304.48   1036.18   304.57   193.95  28.17  184.71  29.73  9.24    40.96  
1 1 1 5   -4  8  o 17 310.51  50.45  3112.42   868.39   0.00     0.00     3112.42   868.39   ?       ?      310.51  50.45  0.00    50.45  
1 1 1 5   -4  9  o 5  62.63   13.50  117.76    47.09    0.00     0.00     117.76    47.09    ?       ?      62.63   13.50  0.00    13.50  
1 1 1 5   -4  10 o 6  60.73   13.75  110.86    46.83    0.00     0.00     110.86    46.83    ?       ?      60.73   13.75  0.00    13.75  
1 1 1 5   -4  11 o 18 343.18  56.29  3837.31   1070.53  0.00     0.00     3837.31   1070.53  ?       ?      343.18  56.29  0.00    56.29  
1 1 1 5   -4  12 o 14 232.70  35.80  1650.76   462.93   0.00     0.00     1650.76   462.93   ?       ?      232.70  35.80  0.00    35.80  
1 1 1 5   -4  13 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   -4  14 o 2  549.47  97.10  10590.36  2950.82  10590.36 2950.82  0.00      0.00     549.47  97.10  ?       ?      0.00    97.10  
1 1 1 5   -4  15 o 8  230.10  23.71  1552.45   308.73   1557.60  436.37   1547.28   436.84   227.89  34.43  227.07  34.60  0.82    48.81  
1 1 1 5   -4  16 o 18 196.53  20.34  1129.87   226.18   1203.37  319.28   1055.83   320.45   201.17  28.44  187.63  30.82  13.55   41.94  
1 1 1 5   -4  17 o 6  193.70  20.16  1099.53   220.85   1102.91  312.02   1096.13   312.65   191.89  29.25  191.25  29.42  0.65    41.48  
1 1 1 5   -4  18 o 12 271.60  28.26  2191.41   434.13   2285.97  614.10   2096.95   613.80   272.86  40.43  260.23  42.56  12.63   58.70  
1 1 1 5   -4  19 o 3  73.94   14.26  163.22    58.33    161.65   80.42    164.96    84.73    73.26   18.97  74.04   19.62  -0.78   27.30  
1 1 1 5   -4  20 o 10 212.86  22.56  1334.47   271.44   1249.72  382.70   1420.27   385.05   202.67  34.10  217.07  31.85  -14.41  46.66  
1 1 1 5   -4  21 o 11 225.85  35.22  1555.21   441.72   1555.21  441.72   0.00      0.00     225.85  35.22  ?       ?      0.00    35.22  
1 1 1 5   -4  22 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   -4  23 o 15 116.79  21.99  414.51    142.04   0.00     0.00     414.51    142.04   ?       ?      116.79  21.99  0.00    21.99  
1 1 1 5   -4  24 o 11 94.50   21.31  274.09    112.85   0.00     0.00     274.09    112.85   ?       ?      94.50   21.31  0.00    21.31  
1 1 1 5   -4  25 o 19 104.75  15.08  327.10    88.06    377.12   125.00   277.82    124.07   111.14  20.34  94.50   23.07  16.64   30.76  
1 1 1 5   -4  26 o 6  213.29  36.67  1509.85   432.83   1509.85  432.83   0.00      0.00     213.29  36.67  ?       ?      0.00    36.67  
1 1 1 5   -4  27 f 0  60.01   21.56  95.58     94.58    95.58    94.58    0.00      0.00     60.01   21.56  ?       ?      0.00    21.56  
1 1 1 5   -4  28 o 11 192.32  22.26  1145.68   241.21   1098.52  338.62   1194.27   343.68   180.01  34.02  188.75  32.91  -8.75   47.33  
1 1 1 5   -4  29 o 18 44.54   18.99  8.08      85.43    -53.67   131.12   53.64     112.61   48.30   21.90  55.79   22.60  -7.49   31.47  
1 1 1 5   -4  30 o 16 64.81   21.99  126.51    97.56    104.17   149.97   142.89    128.45   66.75   26.41  69.78   25.12  -3.03   36.45  
1 1 1 5   -3  0  o 9  117.38  17.62  407.22    115.07   407.22   115.07   0.00      0.00     117.38  17.62  ?       ?      0.00    17.62  
1 1 1 5   -3  1  o 7  240.76  36.58  1755.30   489.68   1755.30  489.68   0.00      0.00     240.76  36.58  ?       ?      0.00    36.58  
1 1 1 5   -3  2  o 11 140.18  14.40  572.99    114.20   602.09   161.36   543.78    161.65   142.69  20.27  135.21  21.55  7.48    29.58  
1 1 1 5   -3  3  o 13 189.53  19.38  1052.25   207.88   1000.85  293.90   1103.71   294.07   182.54  29.02  192.31  27.41  -9.77   39.92  
1 1 1 5   -3  4  o 18 169.48  17.40  840.27    166.86   854.39   236.11   826.20    235.82   169.26  25.06  166.27  25.52  2.98    35.76  
1 1 1 5   -3  5  o 15 153.73  23.18  704.56    198.22   0.00     0.00     704.56    198.22   ?       ?      153.73  23.18  0.00    23.18  
1 1 1 5   -3  6  o 5  440.24  77.69  6789.40   1891.60  6789.40  1891.60  0.00      0.00     440.24  77.69  ?       ?      0.00    77.69  
1 1 1 5   -3  7  o 8  484.39  54.26  7525.04   1482.92  7603.33  2097.13  7446.74   2097.19  457.41  82.92  451.30  84.04  6.11    118.06 
1 1 1 5   -3  8  o 19 352.55  37.68  3800.87   750.74   4074.65  1061.67  3527.06   1061.73  354.50  53.86  325.84  58.93  28.66   79.84  
1 1 1 5   -3  9  o 6  138.37  21.23  571.97    163.29   0.00     0.00     571.97    163.29   ?       ?      138.37  21.23  0.00    21.23  
1 1 1 5   -3  10 o 6  249.72  39.13  1940.42   542.57   0.00     0.00     1940.42   542.57   ?       ?      249.72  39.13  0.00    39.13  
1 1 1 5   -3  11 o 15 424.98  77.58  6541.24   1823.00  0.00     0.00     6541.24   1823.00  ?       ?      424.98  77.58  0.00    77.58  
1 1 1 5   -3  12 o 10 371.63  39.80  4238.43   835.95   4509.06  1182.29  3967.87   1182.14  371.36  57.30  344.45  62.07  26.91   84.47  
1 1 1 5   -3  13 o 13 133.23  14.31  518.68    107.75   452.83   151.04   586.91    153.76   122.81  22.24  140.83  19.54  -18.02  29.61  
1 1 1 5   -3  14 o 6  560.66  106.70 11876.83  3308.80  11876.83 3308.80  0.00      0.00     560.66  106.70 ?       ?      0.00    106.70 
1 1 1 5   -3  15 o 5  489.84  82.73  8049.97   2243.59  8049.97  2243.59  0.00      0.00     489.84  82.73  ?       ?      0.00    82.73  
1 1 1 5   -3  16 o 3  226.84  23.46  1509.09   301.15   1349.67  425.65   1668.85   426.11   211.21  36.42  236.58  32.21  -25.37  48.62  
1 1 1 5   -3  17 o 14 620.68  69.50  12343.31  2434.01  12018.95 3442.18  12667.67  3442.24  572.61  108.69 592.35  105.08 -19.74  151.18 
1 1 1 5   -3  18 o 1  428.33  45.85  5625.61   1109.86  5608.39  1569.53  5642.85   1569.64  412.25  68.74  413.73  68.48  -1.48   97.03  
1 1 1 5   -3  19 o 5  87.20   13.05  224.25    63.33    261.62   87.89    183.88    91.35    93.62   16.98  78.06   20.22  15.55   26.41  
1 1 1 5   -3  20 o 15 371.47  39.72  4204.87   833.84   3946.99  1179.16  4462.79   1179.28  346.48  61.54  372.04  57.03  -25.56  83.90  
1 1 1 5   -3  21 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   -3  22 o 10 399.62  69.21  5478.90   1530.13  0.00     0.00     5478.90   1530.13  ?       ?      399.62  69.21  0.00    69.21  
1 1 1 5   -3  23 o 8  61.00   20.07  104.73    81.34    0.00     0.00     104.73    81.34    ?       ?      61.00   20.07  0.00    20.07  
1 1 1 5   -3  24 o 15 287.26  49.01  2774.31   779.16   0.00     0.00     2774.31   779.16   ?       ?      287.26  49.01  0.00    49.01  
1 1 1 5   -3  25 o 6  120.85  22.48  447.91    150.22   0.00     0.00     447.91    150.22   ?       ?      120.85  22.48  0.00    22.48  
1 1 1 5   -3  26 o 1  285.56  32.36  2597.31   521.10   2436.86  737.62   2757.18   736.28   258.26  51.56  279.47  47.60  -21.22  70.17  
1 1 1 5   -3  27 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   -3  28 o 12 90.70   26.25  265.07    144.42   265.07   144.42   0.00      0.00     90.70   26.25  ?       ?      0.00    26.25  
1 1 1 5   -3  29 o 16 65.48   21.68  128.92    94.88    53.54    129.79   215.44    139.05   58.67   24.08  82.09   26.18  -23.42  35.57  
1 1 1 5   -3  30 o 14 101.50  20.33  327.68    114.31   295.47   159.22   361.94    164.22   93.48   27.70  103.39  27.28  -9.91   38.88  
1 1 1 5   -2  0  o 1  478.59  51.16  7027.27   1383.94  6976.89  1957.17  7077.65   1957.20  459.36  76.94  463.25  76.25  -3.89   108.32 
1 1 1 5   -2  1  o 5  254.81  38.68  1965.38   548.07   1965.38  548.07   0.00      0.00     254.81  38.68  ?       ?      0.00    38.68  
1 1 1 5   -2  2  f 0  88.35   13.63  230.23    66.93    230.23   66.93    0.00      0.00     88.35   13.63  ?       ?      0.00    13.63  
1 1 1 5   -2  3  o 12 369.76  38.68  4104.07   808.95   4160.31  1143.97  4047.81   1144.07  363.67  56.64  358.11  57.60  5.56    80.79  
1 1 1 5   -2  4  o 12 123.16  12.75  441.78    88.81    444.42   125.21   439.11    125.99   122.59  18.36  121.79  18.61  0.80    26.14  
1 1 1 5   -2  5  o 8  97.18   10.31  274.91    56.65    278.57   79.51    271.13    80.73    97.15   14.72  95.73   15.20  1.42    21.15  
1 1 1 5   -2  6  o 4  142.23  14.67  590.58    118.06   647.09   166.71   533.73    167.21   147.92  20.16  133.57  22.61  14.36   30.29  
1 1 1 5   -2  7  o 4  341.97  36.06  3536.50   697.22   3563.87  985.92   3509.13   986.11   333.86  53.23  330.92  53.75  2.94    75.65  
1 1 1 5   -2  8  o 14 100.84  11.13  296.73    63.36    -18.22   87.14    649.85    92.27    42.77   18.70  149.76  10.81  -106.99 21.60  
1 1 1 5   -2  9  o 13 192.95  19.86  1096.14   216.81   -9.81    305.11   2224.32   308.16   81.96   35.42  275.62  19.60  -193.66 40.48  
1 1 1 5   -2  10 o 17 219.11  33.85  1472.73   412.02   0.00     0.00     1472.73   412.02   ?       ?      219.11  33.85  0.00    33.85  
1 1 1 5   -2  11 o 1  186.93  28.62  1058.80   297.34   0.00     0.00     1058.80   297.34   ?       ?      186.93  28.62  0.00    28.62  
1 1 1 5   -2  12 o 9  373.81  64.18  4762.61   1327.72  0.00     0.00     4762.61   1327.72  ?       ?      373.81  64.18  0.00    64.18  
1 1 1 5   -2  13 o 1  356.19  37.98  3873.54   764.73   4233.81  1081.91  3513.83   1081.08  362.45  53.61  325.22  60.12  37.23   80.55  
1 1 1 5   -2  14 o 16 87.77   11.32  225.65    55.73    196.17   80.07    253.36    77.62    80.72   17.76  92.44   15.15  -11.72  23.35  
1 1 1 5   -2  15 f 0  521.02  93.25  9641.95   2686.75  9641.95  2686.75  0.00      0.00     521.02  93.25  ?       ?      0.00    93.25  
1 1 1 5   -2  16 o 12 317.78  49.27  3112.00   869.72   3112.00  869.72   0.00      0.00     317.78  49.27  ?       ?      0.00    49.27  
1 1 1 5   -2  17 o 9  157.08  16.71  720.39    148.40   804.79   210.94   637.67    208.82   165.00  22.88  145.92  25.88  19.09   34.54  
1 1 1 5   -2  18 o 19 220.60  22.84  1429.36   285.09   1643.83  404.09   1216.80   402.29   234.74  30.72  199.82  36.41  34.92   47.64  
1 1 1 5   -2  19 o 6  125.04  14.30  457.41    100.81   478.68   144.59   437.28    140.64   126.75  20.58  120.92  21.02  5.82    29.42  
1 1 1 5   -2  20 o 19 113.20  14.49  376.44    91.98    458.98   134.98   304.88    125.68   124.17  19.59  100.26  22.40  23.91   29.76  
1 1 1 5   -2  21 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   -2  22 o 12 45.89   17.78  39.03     66.76    20.19    104.36   52.07     86.85    51.64   21.43  52.46   20.29  -0.82   29.51  
1 1 1 5   -2  23 o 14 297.51  31.62  2681.35   531.75   2752.76  753.21   2610.38   750.81   293.20  46.28  284.53  47.65  8.67    66.43  
1 1 1 5   -2  24 o 5  220.95  35.81  1539.47   438.69   0.00     0.00     1539.47   438.69   ?       ?      220.95  35.81  0.00    35.81  
1 1 1 5   -2  25 o 11 111.35  21.71  379.57    133.76   0.00     0.00     379.57    133.76   ?       ?      111.35  21.71  0.00    21.71  
1 1 1 5   -2  26 o 12 279.40  30.85  2453.92   486.53   2627.88  691.02   2282.90   685.15   276.59  45.07  253.97  48.77  22.62   66.40  
1 1 1 5   -2  27 o 16 310.55  36.13  3195.87   632.17   3368.17  895.45   3024.67   892.59   295.40  54.82  274.57  58.42  20.82   80.12  
1 1 1 5   -2  28 o 2  214.14  39.27  1604.43   464.99   1604.43  464.99   0.00      0.00     214.14  39.27  ?       ?      0.00    39.27  
1 1 1 5   -2  29 o 17 172.88  32.56  1015.71   311.31   1015.71  311.31   0.00      0.00     172.88  32.56  ?       ?      0.00    32.56  
1 1 1 5   -2  30 o 14 51.82   20.82  48.97     94.62    -51.06   135.16   145.09    132.49   49.06   22.24  70.42   25.49  -21.36  33.83  
1 1 1 5   -2  31 o 3  120.03  28.88  500.82    196.58   0.00     0.00     500.82    196.58   ?       ?      120.03  28.88  0.00    28.88  
1 1 1 5   -1  0  o 10 516.83  55.48  8237.62   1620.46  8047.30  2291.64  8427.96   2291.72  489.78  84.56  503.42  82.13  -13.65  117.88 
1 1 1 5   -1  1  o 15 256.66  38.88  1990.20   554.92   1990.20  554.92   0.00      0.00     256.66  38.88  ?       ?      0.00    38.88  
1 1 1 5   -1  2  o 18 236.70  35.71  1685.57   470.16   1685.57  470.16   0.00      0.00     236.70  35.71  ?       ?      0.00    35.71  
1 1 1 5   -1  3  o 2  142.94  14.58  595.21    117.93   553.24   166.61   637.35    166.95   136.43  22.02  146.99  20.33  -10.56  29.97  
1 1 1 5   -1  4  o 8  415.62  43.86  5229.68   1030.69  5337.17  1457.60  5122.18   1457.63  408.43  64.29  398.94  65.95  9.49    92.10  
1 1 1 5   -1  5  o 6  270.27  27.85  2158.59   425.93   2266.68  602.34   2050.50   602.37   273.23  39.55  258.75  41.99  14.48   57.68  
1 1 1 5   -1  6  o 7  270.63  27.94  2168.87   427.82   2278.29  605.00   2059.43   605.05   273.37  39.71  258.72  42.19  14.66   57.94  
1 1 1 5   -1  7  o 8  279.41  28.97  2322.21   458.01   2379.23  647.65   2265.17   647.80   277.78  41.92  270.36  43.19  7.42    60.19  
1 1 1 5   -1  8  o 13 253.07  26.26  1900.54   375.96   1.61     530.53   3816.27   532.87   107.58  46.60  359.60  25.99  -252.01 53.36  
1 1 1 5   -1  9  o 9  13.21   6.60   -56.22    20.64    -56.22   20.64    0.00      0.00     13.21   6.60   ?       ?      0.00    6.60   
1 1 1 5   -1  10 o 14 112.34  11.95  368.39    75.89    382.92   106.53   353.41    108.14   113.66  16.84  108.88  17.92  4.78    24.59  
1 1 1 5   -1  11 o 18 523.76  128.40 13751.89  3830.40  0.00     0.00     13751.89  3830.40  ?       ?      523.76  128.40 0.00    128.40 
1 1 1 5   -1  12 o 14 391.17  69.16  5368.10   1496.28  0.00     0.00     5368.10   1496.28  ?       ?      391.17  69.16  0.00    69.16  
1 1 1 5   -1  13 o 1  172.16  26.39  893.02    252.50   0.00     0.00     893.02    252.50   ?       ?      172.16  26.39  0.00    26.39  
1 1 1 5   -1  14 o 5  179.08  18.55  941.45    187.99   955.77   265.74   927.11    265.99   178.38  26.78  175.49  27.29  2.89    38.23  
1 1 1 5   -1  15 o 19 506.01  55.84  8096.26   1595.02  8212.24  2255.67  7980.28   2255.71  483.19  84.39  474.59  85.96  8.61    120.46 
1 1 1 5   -1  16 o 7  394.90  63.60  4994.45   1392.83  4994.45  1392.83  0.00      0.00     394.90  63.60  ?       ?      0.00    63.60  
1 1 1 5   -1  17 o 3  366.51  57.78  4213.18   1175.56  4213.18  1175.56  0.00      0.00     366.51  57.78  ?       ?      0.00    57.78  
1 1 1 5   -1  18 o 13 235.97  24.35  1636.86   325.18   1678.68  459.84   1595.03   459.92   236.16  34.97  229.76  36.05  6.40    50.23  
1 1 1 5   -1  19 f 0  246.17  25.58  1790.84   356.27   1754.90  503.51   1826.87   504.16   239.70  37.85  244.97  37.00  -5.27   52.93  
1 1 1 5   -1  20 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   -1  21 o 8  272.02  42.90  2305.66   647.80   0.00     0.00     2305.66   647.80   ?       ?      272.02  42.90  0.00    42.90  
1 1 1 5   -1  22 o 6  200.31  21.25  1181.96   240.62   1284.80  339.74   1078.46   340.84   206.63  29.48  187.97  32.78  18.66   44.08  
1 1 1 5   -1  23 o 13 261.27  27.67  2041.73   408.71   1976.72  578.03   2106.72   577.98   250.96  41.58  260.03  40.00  -9.07   57.69  
1 1 1 5   -1  24 o 13 440.92  51.43  6470.52   1277.48  6459.02  1806.62  6482.03   1806.65  403.05  80.90  404.04  80.72  -1.00   114.28 
1 1 1 5   -1  25 o 10 191.22  31.26  1145.21   331.33   0.00     0.00     1145.21   331.33   ?       ?      191.22  31.26  0.00    31.26  
1 1 1 5   -1  26 o 17 211.31  35.34  1445.87   413.54   0.00     0.00     1445.87   413.54   ?       ?      211.31  35.34  0.00    35.34  
1 1 1 5   -1  27 o 9  124.76  18.19  471.39    126.45   461.81   182.23   480.30    175.62   120.06  27.09  123.06  25.69  -3.00   37.33  
1 1 1 5   -1  28 o 10 310.54  37.34  3291.03   652.26   3442.84  925.03   3140.91   919.87   288.29  57.91  270.26  60.77  18.03   83.94  
1 1 1 5   -1  29 o 1  143.48  29.83  688.29    237.68   688.29   237.68   0.00      0.00     143.48  29.83  ?       ?      0.00    29.83  
1 1 1 5   -1  30 o 8  66.77   26.02  109.50    143.68   109.50   143.68   0.00      0.00     66.77   26.02  ?       ?      0.00    26.02  
1 1 1 5   -1  31 o 12 76.58   21.81  191.38    100.50   254.83   161.69   151.44    128.29   86.47   28.29  70.38   25.13  16.09   37.84  
1 1 1 5   0   0  o 4  200.52  20.41  1175.72   231.63   1130.49  327.49   1220.99   327.66   194.45  30.33  202.57  29.00  -8.11   41.96  
1 1 1 5   0   1  o 9  154.20  22.96  704.44    197.10   704.44   197.10   0.00      0.00     154.20  22.96  ?       ?      0.00    22.96  
1 1 1 5   0   2  f 0  177.45  26.49  936.12    261.60   936.12   261.60   0.00      0.00     177.45  26.49  ?       ?      0.00    26.49  
1 1 1 5   0   3  o 18 140.46  14.34  574.64    114.01   565.68   161.11   583.63    161.35   138.22  20.96  140.51  20.62  -2.29   29.40  
1 1 1 5   0   4  o 19 254.05  26.06  1899.52   374.67   1903.67  529.84   1895.38   529.90   250.96  37.96  250.37  38.06  0.59    53.76  
1 1 1 5   0   5  o 15 72.33   7.90   152.19    32.27    149.64   45.36    154.80    45.92    71.20   11.49  72.45   11.42  -1.26   16.20  
1 1 1 5   0   6  o 17 289.03  29.82  2478.10   487.71   2391.24  689.62   2565.00   689.82   278.46  44.65  289.36  42.82  -10.90  61.86  
1 1 1 5   0   7  o 14 136.35  13.60  541.76    105.02   -22.22   146.95   1130.49   150.14   56.17   24.43  197.50  13.32  -141.32 27.82  
1 1 1 5   0   8  o 7  106.94  11.23  333.23    67.94    0.43     94.05    696.29    98.24    46.80   19.93  155.04  11.11  -108.24 22.82  
1 1 1 5   0   9  o 5  58.75   7.32   100.78    24.15    101.25   32.06    100.18    36.71    58.49   9.90   57.94   11.44  0.55    15.13  
1 1 1 5   0   10 o 1  80.39   9.01   188.40    40.87    174.04   56.46    204.21    59.23    76.51   13.34  83.12   12.82  -6.61   18.50  
1 1 1 5   0   11 o 2  361.75  38.97  4040.41   796.47   4170.40  1126.45  3910.46   1126.31  353.99  57.40  340.67  59.77  13.32   82.87  
1 1 1 5   0   12 o 7  100.17  15.81  298.02    87.92    0.00     0.00     298.02    87.92    ?       ?      100.17  15.81  0.00    15.81  
1 1 1 5   0   13 o 2  539.11  147.23 16817.32  4684.03  0.00     0.00     16817.32  4684.03  ?       ?      539.11  147.23 0.00    147.23 
1 1 1 5   0   14 o 10 401.05  43.39  4995.75   982.99   5504.32  1390.37  4487.48   1389.95  406.66  61.47  359.50  69.87  47.16   93.06  
1 1 1 5   0   15 f 0  215.86  33.09  1413.30   397.03   1413.30  397.03   0.00      0.00     215.86  33.09  ?       ?      0.00    33.09  
1 1 1 5   0   16 o 9  397.28  64.73  5111.97   1425.54  5111.97  1425.54  0.00      0.00     397.28  64.73  ?       ?      0.00    64.73  
1 1 1 5   0   17 f 0  320.64  49.86  3178.96   887.98   3178.96  887.98   0.00      0.00     320.64  49.86  ?       ?      0.00    49.86  
1 1 1 5   0   18 o 3  285.04  43.89  2484.50   695.13   2484.50  695.13   0.00      0.00     285.04  43.89  ?       ?      0.00    43.89  
1 1 1 5   0   19 o 9  510.75  56.28  8222.85   1622.86  8025.41  2295.08  8420.29   2295.05  477.04  87.01  491.53  84.37  -14.49  121.20 
1 1 1 5   0   20 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   0   21 o 9  319.15  51.84  3277.24   917.21   3277.24  917.21   0.00      0.00     319.15  51.84  ?       ?      0.00    51.84  
1 1 1 5   0   22 o 19 38.79   17.43  -38.26    80.90    -38.26   80.90    0.00      0.00     38.79   17.43  ?       ?      0.00    17.43  
1 1 1 5   0   23 o 18 188.15  20.01  1043.25   212.79   1152.21  301.56   935.20    300.30   195.68  27.61  174.87  31.05  20.81   41.55  
1 1 1 5   0   24 f 0  142.86  16.39  601.82    132.02   620.70   186.51   582.86    186.89   143.21  23.50  138.41  24.41  4.80    33.89  
1 1 1 5   0   25 o 16 347.56  67.27  4627.04   1293.66  0.00     0.00     4627.04   1293.66  ?       ?      347.56  67.27  0.00    67.27  
1 1 1 5   0   26 o 14 141.29  24.61  617.32    192.40   0.00     0.00     617.32    192.40   ?       ?      141.29  24.61  0.00    24.61  
1 1 1 5   0   27 o 2  108.98  26.08  378.97    160.98   0.00     0.00     378.97    160.98   ?       ?      108.98  26.08  0.00    26.08  
1 1 1 5   0   28 o 19 226.41  26.36  1620.94   336.17   1543.58  477.86   1696.75   473.01   207.63  41.54  220.77  38.73  -13.14  56.80  
1 1 1 5   0   29 o 11 92.58   21.06  271.98    109.42   256.60   164.86   284.09    146.29   88.81   28.52  93.11   26.25  -4.29   38.76  
1 1 1 5   0   30 o 17 99.03   29.64  336.59    181.62   336.59   181.62   0.00      0.00     99.03   29.64  ?       ?      0.00    29.64  
1 1 1 5   0   31 o 10 114.49  31.45  475.51    213.00   475.51   213.00   0.00      0.00     114.49  31.45  ?       ?      0.00    31.45  
1 1 1 5   1   0  o 10 270.09  41.03  2210.68   616.22   2210.68  616.22   0.00      0.00     270.09  41.03  ?       ?      0.00    41.03  
1 1 1 5   1   1  o 17 399.38  63.49  5050.31   1406.88  5050.31  1406.88  0.00      0.00     399.38  63.49  ?       ?      0.00    63.49  
1 1 1 5   1   2  o 6  204.66  30.67  1251.36   349.26   1251.36  349.26   0.00      0.00     204.66  30.67  ?       ?      0.00    30.67  
1 1 1 5   1   3  o 10 532.30  57.62  8794.94   1732.80  8857.22  2450.52  8732.65   2450.58  511.71  86.50  507.35  87.29  4.35    122.89 
1 1 1 5   1   4  o 2  298.69  30.81  2641.67   520.70   2640.74  736.33   2642.61   736.44   293.69  45.12  293.80  45.10  -0.11   63.79  
1 1 1 5   1   5  o 1  464.33  49.68  6619.22   1303.63  6591.48  1843.57  6646.96   1843.64  446.28  74.59  448.49  74.20  -2.21   105.21 
1 1 1 5   1   6  o 5  592.11  66.93  11348.31  2235.32  11428.23 3161.20  11268.38  3161.24  554.65  103.07 549.53  104.02 5.12    146.44 
1 1 1 5   1   7  f 0  279.52  28.37  2317.97   448.87   0.61     633.78   4650.25   635.81   117.38  50.89  396.95  28.08  -279.57 58.12  
1 1 1 5   1   8  o 15 153.71  15.47  690.37    134.69   -43.94   189.22   1444.54   191.76   62.27   27.38  222.99  15.07  -160.72 31.26  
1 1 1 5   1   9  o 5  135.04  13.91  532.68    106.31   542.33   150.12   522.98    150.58   135.07  19.96  132.48  20.46  2.59    28.58  
1 1 1 5   1   10 o 6  266.22  27.84  2119.02   419.24   2244.15  592.87   1993.86   592.93   268.84  39.60  251.70  42.55  17.14   58.13  
1 1 1 5   1   11 o 17 85.36   9.70   212.68    46.68    230.08   67.91    197.09    64.27    88.12   13.88  81.34   14.28  6.78    19.92  
1 1 1 5   1   12 o 9  186.71  28.61  1058.29   296.93   0.00     0.00     1058.29   296.93   ?       ?      186.71  28.61  0.00    28.61  
1 1 1 5   1   13 o 16 157.09  24.00  741.67    209.59   0.00     0.00     741.67    209.59   ?       ?      157.09  24.00  0.00    24.00  
1 1 1 5   1   14 o 1  282.00  44.82  2511.56   701.25   0.00     0.00     2511.56   701.25   ?       ?      282.00  44.82  0.00    44.82  
1 1 1 5   1   15 o 1  228.61  23.68  1544.30   306.27   1701.53  433.78   1388.01   432.49   237.16  32.73  212.37  36.81  24.80   49.26  
1 1 1 5   1   16 o 5  398.47  42.27  4828.76   952.27   4870.39  1346.73  4787.13   1346.70  387.97  62.60  384.13  63.27  3.84    89.00  
1 1 1 5   1   17 o 6  263.24  40.38  2108.07   590.79   2108.07  590.79   0.00      0.00     263.24  40.38  ?       ?      0.00    40.38  
1 1 1 5   1   18 o 15 620.63  122.45 15103.56  4207.57  15103.56 4207.57  0.00      0.00     620.63  122.45 ?       ?      0.00    122.45 
1 1 1 5   1   19 f 0  225.65  34.64  1540.98   434.37   1540.98  434.37   0.00      0.00     225.65  34.64  ?       ?      0.00    34.64  
1 1 1 5   1   20 o 4  335.48  54.60  3633.21   1015.43  0.00     0.00     3633.21   1015.43  ?       ?      335.48  54.60  0.00    54.60  
1 1 1 5   1   21 o 11 86.99   13.95  224.24    67.32    163.95   92.78    291.26    97.82    73.95   20.92  98.63   17.94  -24.68  27.56  
1 1 1 5   1   22 o 9  421.19  45.89  5535.93   1091.74  5633.45  1544.04  5438.44   1543.87  406.17  68.66  397.55  70.22  8.63    98.21  
1 1 1 5   1   23 o 18 169.09  27.33  864.31    256.27   864.31   256.27   0.00      0.00     169.09  27.33  ?       ?      0.00    27.33  
1 1 1 5   1   24 o 16 242.31  25.92  1763.47   354.94   1669.16  502.05   1857.73   501.87   229.21  39.58  243.44  37.08  -14.22  54.24  
1 1 1 5   1   25 o 12 166.81  18.49  827.53    174.12   811.89   246.42   843.12    246.07   161.96  27.49  165.37  26.84  -3.42   38.42  
1 1 1 5   1   26 o 1  61.50   23.92  76.96     121.32   76.96    121.32   0.00      0.00     61.50   23.92  ?       ?      0.00    23.92  
1 1 1 5   1   27 f 0  120.65  23.84  456.48    159.25   0.00     0.00     456.48    159.25   ?       ?      120.65  23.84  0.00    23.84  
1 1 1 5   1   28 o 2  181.01  31.83  1087.05   318.65   0.00     0.00     1087.05   318.65   ?       ?      181.01  31.83  0.00    31.83  
1 1 1 5   1   29 o 7  98.68   28.76  325.65    172.87   325.65   172.87   0.00      0.00     98.68   28.76  ?       ?      0.00    28.76  
1 1 1 5   1   30 o 8  53.77   21.35  58.33     98.31    27.34    151.84   80.70     129.00   58.82   25.20  61.31   24.42  -2.49   35.09  
1 1 1 5   1   31 o 2  110.72  30.39  441.22    198.99   441.22   198.99   0.00      0.00     110.72  30.39  ?       ?      0.00    30.39  
1 1 1 5   2   0  o 1  176.34  26.33  925.20    258.43   925.20   258.43   0.00      0.00     176.34  26.33  ?       ?      0.00    26.33  
1 1 1 5   2   1  o 19 434.61  70.78  6121.32   1705.10  6121.32  1705.10  0.00      0.00     434.61  70.78  ?       ?      0.00    70.78  
1 1 1 5   2   2  o 18 293.11  30.17  2540.79   500.36   2503.40  707.56   2578.19   707.67   286.14  44.52  290.75  43.75  -4.62   62.42  
1 1 1 5   2   3  o 1  606.51  67.60  11760.44  2313.60  11513.28 3271.88  12007.61  3271.97  562.31  105.23 577.68  102.41 -15.38  146.84 
1 1 1 5   2   4  o 15 123.59  12.67  444.71    88.65    453.20   125.31   436.20    125.42   123.88  18.16  121.41  18.58  2.47    25.98  
1 1 1 5   2   5  o 15 247.14  25.34  1799.75   354.43   1714.40  501.13   1885.18   501.35   237.38  38.06  249.86  35.99  -12.48  52.38  
1 1 1 5   2   6  o 1  161.37  15.85  759.78    144.94   -23.99   203.82   1561.71   206.17   66.50   28.84  231.95  15.57  -165.46 32.78  
1 1 1 5   2   7  o 18 116.12  11.67  392.58    76.75    -0.20    107.01   808.73    110.15   49.81   21.24  167.11  11.55  -117.30 24.18  
1 1 1 5   2   8  o 4  450.44  49.36  6373.79   1255.48  6360.16  1775.46  6387.43   1775.58  427.48  75.09  428.61  74.89  -1.13   106.05 
1 1 1 5   2   9  o 8  312.31  32.86  2943.62   580.38   2944.11  820.73   2943.14   820.82   303.93  48.68  303.87  48.70  0.06    68.86  
1 1 1 5   2   10 o 1  286.73  30.10  2472.69   488.00   2520.03  690.13   2425.34   690.16   282.56  43.98  276.52  45.02  6.04    62.94  
1 1 1 5   2   11 o 6  381.66  41.60  4545.30   896.78   4732.12  1268.36  4358.56   1268.11  373.19  61.33  354.95  64.61  18.24   89.09  
1 1 1 5   2   12 o 9  339.32  57.19  3853.68   1074.44  0.00     0.00     3853.68   1074.44  ?       ?      339.32  57.19  0.00    57.19  
1 1 1 5   2   13 o 3  157.40  23.99  744.66    209.92   0.00     0.00     744.66    209.92   ?       ?      157.40  23.99  0.00    23.99  
1 1 1 5   2   14 o 7  43.35   11.92  55.92     30.57    0.00     0.00     55.92     30.57    ?       ?      43.35   11.92  0.00    11.92  
1 1 1 5   2   15 o 2  292.45  30.69  2560.57   507.56   2927.59  718.33   2194.65   717.26   307.86  41.72  262.15  49.48  45.71   64.72  
1 1 1 5   2   16 o 18 237.04  24.51  1656.75   328.66   1658.29  464.60   1655.22   464.98   233.77  35.76  233.52  35.83  0.25    50.62  
1 1 1 5   2   17 o 2  101.46  17.63  306.13    98.98    306.13   98.98    0.00      0.00     101.46  17.63  ?       ?      0.00    17.63  
1 1 1 5   2   18 o 5  168.76  25.95  849.16    243.40   849.16   243.40   0.00      0.00     168.76  25.95  ?       ?      0.00    25.95  
1 1 1 5   2   19 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   2   20 o 15 224.36  23.44  1488.63   297.49   1459.56  420.82   1517.67   420.62   218.44  34.72  223.13  33.90  -4.70   48.53  
1 1 1 5   2   21 o 6  264.98  27.91  2100.54   418.24   2055.59  591.75   2145.40   591.19   256.00  41.70  262.20  40.59  -6.20   58.19  
1 1 1 5   2   22 o 16 231.12  24.42  1584.50   319.08   1555.85  451.44   1613.10   451.06   224.82  36.21  229.32  35.40  -4.51   50.64  
1 1 1 5   2   23 o 15 172.10  18.88  872.39    183.47   865.04   260.73   879.59    258.23   168.94  27.85  170.55  27.29  -1.62   39.00  
1 1 1 5   2   24 o 10 183.87  19.97  1002.30   207.43   972.01   294.40   1032.17   292.31   177.65  29.93  183.67  28.66  -6.02   41.44  
1 1 1 5   2   25 o 5  175.31  19.30  916.26    191.01   979.31   270.91   853.94    269.35   178.15  27.36  165.22  29.48  12.92   40.22  
1 1 1 5   2   26 o 9  77.19   19.68  183.51    87.47    190.57   124.31   176.58    123.10   79.24   24.68  76.83   24.64  2.41    34.88  
1 1 1 5   2   27 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   2   28 o 19 70.52   21.96  153.21    98.41    0.00     0.00     153.21    98.41    ?       ?      70.52   21.96  0.00    21.96  
1 1 1 5   2   29 f 0  112.56  28.81  427.41    186.89   427.41   186.89   0.00      0.00     112.56  28.81  ?       ?      0.00    28.81  
1 1 1 5   2   30 o 6  115.42  18.69  416.29    119.58   474.66   191.30   378.85    153.19   117.60  28.61  106.59  25.40  11.02   38.26  
1 1 1 5   2   31 o 6  56.68   24.94  4.64      157.21   4.64     157.21   0.00      0.00     56.68   24.94  ?       ?      0.00    24.94  
1 1 1 5   2   32 o 5  72.66   28.49  156.94    173.20   156.94   173.20   0.00      0.00     72.66   28.49  ?       ?      0.00    28.49  
1 1 1 5   3   0  o 9  239.82  24.63  1692.48   334.22   1738.34  472.64   1646.60   472.67   240.07  35.35  233.16  36.51  6.91    50.82  
1 1 1 5   3   1  o 1  163.09  16.65  776.53    153.68   777.26   217.31   775.79    217.36   161.70  24.15  161.54  24.18  0.16    34.17  
1 1 1 5   3   2  o 1  458.33  48.95  6446.72   1268.02  6303.76  1793.20  6589.69   1793.30  435.89  74.33  447.42  72.28  -11.53  103.68 
1 1 1 5   3   3  f 0  394.94  41.66  4719.60   930.27   4758.39  1315.57  4680.81   1315.62  385.54  61.51  381.93  62.14  3.60    87.43  
1 1 1 5   3   4  o 2  424.41  45.24  5504.24   1085.36  5592.62  1534.90  5415.86   1534.95  413.86  66.89  406.17  68.25  7.68    95.56  
1 1 1 5   3   5  o 2  183.38  18.74  984.75    194.48   970.26   274.89   999.27    275.18   179.99  27.47  182.83  27.03  -2.84   38.54  
1 1 1 5   3   6  o 6  219.16  21.31  1410.95   264.68   -0.19    373.24   2838.49   375.40   91.41   39.34  311.60  21.11  -220.19 44.65  
1 1 1 5   3   7  o 3  336.69  33.56  3408.65   640.09   -26.26   904.20   6859.13   906.25   135.75  59.77  478.86  33.17  -343.12 68.36  
1 1 1 5   3   8  o 13 133.31  13.72  518.98    103.50   522.18   146.15   515.76    146.59   132.52  19.82  131.64  20.03  0.88    28.18  
1 1 1 5   3   9  o 15 457.86  51.35  6724.53   1326.41  6901.08  1875.81  6547.97   1875.84  436.66  77.68  422.08  80.35  14.58   111.76 
1 1 1 5   3   10 o 7  352.51  37.98  3825.69   756.39   4039.76  1069.79  3611.69   1069.59  350.15  55.03  327.68  59.03  22.48   80.71  
1 1 1 5   3   11 o 7  184.02  19.13  998.47    199.17   1092.75  282.12   904.79    281.23   190.40  26.53  171.96  29.55  18.44   39.71  
1 1 1 5   3   12 o 2  95.26   15.10  269.49    79.83    0.00     0.00     269.49    79.83    ?       ?      95.26   15.10  0.00    15.10  
1 1 1 5   3   13 o 3  476.44  99.24  9426.37   2626.09  0.00     0.00     9426.37   2626.09  ?       ?      476.44  99.24  0.00    99.24  
1 1 1 5   3   14 o 4  205.99  31.61  1292.08   361.92   0.00     0.00     1292.08   361.92   ?       ?      205.99  31.61  0.00    31.61  
1 1 1 5   3   15 o 6  57.78   10.23  99.02     32.70    129.43   52.49    79.73     41.81    65.67   14.33  51.65   13.83  14.01   19.91  
1 1 1 5   3   16 o 11 500.35  54.77  7856.09   1547.39  7734.91  2188.25  7977.29   2188.43  471.24  83.97  480.29  82.33  -9.05   117.60 
1 1 1 5   3   17 o 2  229.99  35.10  1596.87   448.73   1596.87  448.73   0.00      0.00     229.99  35.10  ?       ?      0.00    35.10  
1 1 1 5   3   18 o 14 153.37  23.88  700.42    203.39   700.42   203.39   0.00      0.00     153.37  23.88  ?       ?      0.00    23.88  
1 1 1 5   3   19 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   3   20 o 12 176.27  18.67  913.44    186.02   944.62   263.28   882.37    262.88   177.19  26.71  170.83  27.76  6.36    38.52  
1 1 1 5   3   21 o 15 112.49  14.29  372.09    90.18    449.84   127.61   294.51    127.46   122.95  18.67  98.29   23.00  24.67   29.62  
1 1 1 5   3   22 o 16 93.13   15.25  257.59    78.72    257.64   115.39   257.55    107.67   92.05   22.11  92.16   20.84  -0.11   30.39  
1 1 1 5   3   23 o 4  203.92  21.84  1230.90   251.65   1240.55  356.19   1221.29   355.57   201.44  31.86  199.75  32.10  1.69    45.22  
1 1 1 5   3   24 o 16 154.98  17.52  709.97    153.12   710.19   218.08   709.75    215.04   152.53  25.83  152.61  25.44  -0.08   36.25  
1 1 1 5   3   25 o 7  54.10   19.87  70.59     80.97    12.30    113.93   130.09    115.10   52.20   22.07  68.76   23.87  -16.56  32.51  
1 1 1 5   3   26 o 1  174.46  20.71  919.59    203.34   785.52   287.37   1054.03   287.77   155.24  33.25  183.27  28.26  -28.03  43.64  
1 1 1 5   3   27 o 8  130.08  18.49  513.73    134.16   534.11   187.90   492.54    191.61   129.42  26.19  123.50  27.71  5.92    38.13  
1 1 1 5   3   28 o 13 65.72   25.18  104.98    132.85   0.00     0.00     104.98    132.85   ?       ?      65.72   25.18  0.00    25.18  
1 1 1 5   3   29 o 16 131.45  28.89  582.88    212.04   0.00     0.00     582.88    212.04   ?       ?      131.45  28.89  0.00    28.89  
1 1 1 5   3   30 o 4  64.56   22.91  122.74    106.48   69.44    152.72   173.16    148.54   62.81   25.98  74.98   27.01  -12.17  37.48  
1 1 1 5   3   31 o 7  62.65   22.04  119.16    98.38    1.15     160.53   190.15    124.51   56.66   25.06  75.61   24.83  -18.95  35.27  
1 1 1 5   3   32 o 3  125.93  33.08  616.98    242.14   616.98   242.14   0.00      0.00     125.93  33.08  ?       ?      0.00    33.08  
1 1 1 5   4   0  o 2  163.20  16.68  778.68    154.06   769.71   217.76   787.67    217.99   160.62  24.38  162.59  24.08  -1.97   34.27  
1 1 1 5   4   1  f 0  267.22  27.60  2116.00   417.23   2113.57  590.00   2118.44   590.10   262.52  40.45  262.85  40.40  -0.33   57.17  
1 1 1 5   4   2  o 16 173.73  17.81  883.29    175.15   938.93   247.73   827.68    247.68   177.60  24.99  166.07  26.90  11.53   36.72  
1 1 1 5   4   3  o 9  98.97   10.30  285.07    57.67    290.49   81.46    279.62    81.65    99.22   14.75  97.24   15.12  1.98    21.12  
1 1 1 5   4   4  o 9  337.10  35.52  3425.49   677.13   3562.25  957.57   3288.71   957.63   335.58  51.34  320.73  53.92  14.85   74.45  
1 1 1 5   4   5  o 18 506.44  51.31  8066.20   1471.11  -47.26   2079.48  16194.96  2081.44  191.11  86.86  719.58  50.71  -528.47 100.58 
1 1 1 5   4   6  o 8  8.89    3.29   1.75      2.22     1.75     2.22     0.00      0.00     8.89    3.29   ?       ?      0.00    3.29   
1 1 1 5   4   7  o 15 489.48  55.10  7730.39   1521.29  7630.59  2151.34  7830.19   2151.50  453.46  85.78  461.18  84.37  -7.72   120.32 
1 1 1 5   4   8  o 18 206.89  21.33  1264.01   249.67   1254.23  352.97   1273.80   353.21   202.92  31.31  204.62  31.04  -1.70   44.09  
1 1 1 5   4   9  o 19 293.22  31.01  2594.99   514.15   2777.36  727.38   2412.90   726.85   296.48  44.08  273.73  48.00  22.75   65.17  
1 1 1 5   4   10 o 5  200.53  20.89  1189.28   236.92   1297.21  335.56   1082.01   334.54   206.82  29.06  187.42  32.26  19.40   43.42  
1 1 1 5   4   11 o 18 107.16  16.61  341.37    98.89    0.00     0.00     341.37    98.89    ?       ?      107.16  16.61  0.00    16.61  
1 1 1 5   4   12 o 5  304.98  49.97  3027.83   844.60   0.00     0.00     3027.83   844.60   ?       ?      304.98  49.97  0.00    49.97  
1 1 1 5   4   13 o 15 394.67  69.90  5474.17   1525.80  0.00     0.00     5474.17   1525.80  ?       ?      394.67  69.90  0.00    69.90  
1 1 1 5   4   14 o 1  507.16  58.04  8392.41   1659.44  9018.34  2346.94  7766.61   2346.67  493.44  85.97  446.53  94.50  46.92   127.76 
1 1 1 5   4   15 o 18 334.17  35.30  3365.23   666.90   3682.09  943.45   3048.81   942.81   342.33  49.44  307.66  55.42  34.67   74.27  
1 1 1 5   4   16 o 13 290.44  30.13  2504.81   495.00   2453.06  699.63   2556.68   700.45   281.97  44.71  288.42  43.67  -6.45   62.50  
1 1 1 5   4   17 o 15 550.98  101.21 11066.18  3083.28  11066.18 3083.28  0.00      0.00     550.98  101.21 ?       ?      0.00    101.21 
1 1 1 5   4   18 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   4   19 o 10 102.61  18.46  314.69    104.73   314.69   104.73   0.00      0.00     102.61  18.46  ?       ?      0.00    18.46  
1 1 1 5   4   20 o 11 143.43  15.74  603.46    127.44   574.13   179.89   633.01    180.55   138.06  23.54  145.44  22.34  -7.38   32.45  
1 1 1 5   4   21 o 3  345.35  37.12  3662.03   724.45   3655.50  1024.37  3668.56   1024.68  332.38  55.65  333.06  55.55  -0.68   78.63  
1 1 1 5   4   22 o 1  255.38  26.98  1947.24   389.54   1875.90  550.91   2018.58   550.87   244.88  40.61  255.05  38.85  -10.17  56.20  
1 1 1 5   4   23 o 13 325.96  35.02  3252.10   645.07   3356.81  912.83   3147.64   911.72   320.47  51.35  308.69  53.38  11.79   74.07  
1 1 1 5   4   24 o 3  191.37  20.83  1091.45   225.11   1102.26  319.62   1080.80   317.11   188.50  30.58  186.58  30.67  1.92    43.31  
1 1 1 5   4   25 o 18 97.40   16.93  286.23    91.23    252.89   119.55   332.71    141.17   90.20   23.02  103.23  24.24  -13.03  33.43  
1 1 1 5   4   26 o 17 142.76  18.36  613.45    147.00   475.38   199.41   777.82    217.57   121.49  29.00  158.30  24.75  -36.82  38.12  
1 1 1 5   4   27 o 8  133.63  17.79  540.99    133.06   608.66   180.85   461.13    196.46   139.38  23.43  118.47  29.10  20.92   37.36  
1 1 1 5   4   28 o 17 131.41  28.55  574.36    209.21   0.00     0.00     574.36    209.21   ?       ?      131.41  28.55  0.00    28.55  
1 1 1 5   4   29 o 2  142.10  30.32  693.80    239.79   0.00     0.00     693.80    239.79   ?       ?      142.10  30.32  0.00    30.32  
1 1 1 5   4   30 o 5  95.86   28.99  321.81    173.06   321.81   173.06   0.00      0.00     95.86   28.99  ?       ?      0.00    28.99  
1 1 1 5   4   31 o 8  64.03   23.28  123.74    110.69   34.98    164.30   197.49    149.78   59.72   25.90  76.75   27.18  -17.03  37.55  
1 1 1 5   4   32 o 3  69.86   28.12  139.84    172.96   139.84   172.96   0.00      0.00     69.86   28.12  ?       ?      0.00    28.12  
1 1 1 5   5   0  o 3  356.11  37.77  3856.73   760.31   3892.70  1075.23  3820.75   1075.26  346.86  55.90  343.15  56.55  3.72    79.52  
1 1 1 5   5   1  o 14 208.13  21.42  1275.73   252.32   1313.05  356.85   1238.41   356.81   208.51  30.73  202.03  31.82  6.48    44.24  
1 1 1 5   5   2  o 12 393.67  42.29  4767.05   940.76   4974.83  1330.42  4559.27   1330.46  388.53  61.71  368.99  65.19  19.54   89.77  
1 1 1 5   5   3  o 3  264.54  27.46  2082.43   410.89   2105.11  581.00   2059.74   581.18   261.01  40.05  257.89  40.60  3.12    57.03  
1 1 1 5   5   4  o 5  97.25   10.15  275.42    55.84    284.88   78.49    265.74    79.44    98.25   14.34  94.68   15.13  3.57    20.84  
1 1 1 5   5   5  o 8  254.18  24.35  1912.50   350.93   -2.74    495.14   3845.68   497.45   103.57  44.94  361.28  24.12  -257.71 51.01  
1 1 1 5   5   6  o 1  332.41  31.84  3327.24   600.09   -20.62   847.53   6692.92   849.78   130.73  57.70  472.60  31.50  -341.87 65.74  
1 1 1 5   5   7  o 19 186.72  19.49  1027.08   205.86   1168.14  291.51   886.74    290.76   197.29  26.40  170.05  30.92  27.24   40.66  
1 1 1 5   5   8  o 19 299.78  31.69  2719.67   537.21   2767.49  759.80   2671.86   759.65   294.17  46.54  288.33  47.55  5.84    66.54  
1 1 1 5   5   9  o 13 384.33  68.39  5216.01   1453.59  0.00     0.00     5216.01   1453.59  ?       ?      384.33  68.39  0.00    68.39  
1 1 1 5   5   10 o 17 269.93  43.09  2311.88   645.25   0.00     0.00     2311.88   645.25   ?       ?      269.93  43.09  0.00    43.09  
1 1 1 5   5   11 o 2  333.25  56.02  3707.33   1033.73  0.00     0.00     3707.33   1033.73  ?       ?      333.25  56.02  0.00    56.02  
1 1 1 5   5   12 f 0  530.71  136.67 15038.85  4188.84  0.00     0.00     15038.85  4188.84  ?       ?      530.71  136.67 0.00    136.67 
1 1 1 5   5   13 o 6  357.82  38.52  3926.60   778.85   4244.97  1101.79  3608.60   1101.15  361.03  54.89  328.19  60.68  32.83   81.82  
1 1 1 5   5   14 o 11 169.13  17.75  838.69    169.78   940.95   241.42   738.62    238.81   177.73  24.30  156.23  27.64  21.49   36.80  
1 1 1 5   5   15 o 11 375.59  39.55  4270.82   839.99   4104.88  1187.71  4436.87   1188.13  356.63  60.15  372.84  57.35  -16.20  83.11  
1 1 1 5   5   16 o 14 328.93  51.73  3382.75   944.52   3382.75  944.52   0.00      0.00     328.93  51.73  ?       ?      0.00    51.73  
1 1 1 5   5   17 o 14 466.41  79.70  7381.10   2057.42  7381.10  2057.42  0.00      0.00     466.41  79.70  ?       ?      0.00    79.70  
1 1 1 5   5   18 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   5   19 o 9  212.93  22.27  1339.28   268.19   1313.90  378.57   1364.84   379.97   207.54  32.87  211.82  32.27  -4.28   46.06  
1 1 1 5   5   20 o 15 201.30  21.29  1198.82   242.29   1201.39  341.80   1196.23   343.49   198.33  31.04  197.80  31.29  0.53    44.07  
1 1 1 5   5   21 f 0  104.27  14.91  321.27    86.74    311.56   121.13   331.47    124.25   101.34  21.49  104.60  21.41  -3.27   30.34  
1 1 1 5   5   22 o 3  296.74  31.64  2661.66   530.65   2743.35  750.54   2580.00   750.36   293.50  46.06  283.42  47.82  10.08   66.39  
1 1 1 5   5   23 o 1  236.70  25.19  1677.57   337.01   1599.57  475.94   1756.00   477.26   225.30  38.16  237.30  36.18  -11.99  52.58  
1 1 1 5   5   24 o 19 167.70  18.75  836.90    177.42   782.12   249.16   893.24    252.70   158.55  28.42  170.40  26.71  -11.85  39.00  
1 1 1 5   5   25 o 4  71.48   20.38  156.21    87.68    158.54   121.41   153.67    126.77   73.70   24.53  73.34   25.06  0.36    35.07  
1 1 1 5   5   26 o 3  49.70   19.81  41.85     84.94    -21.81   112.78   125.29    129.12   47.93   21.11  68.88   25.13  -20.95  32.82  
1 1 1 5   5   27 o 9  41.42   17.77  1.06      75.66    31.70    95.16    -51.60    124.76   50.04   20.59  47.48   21.46  2.56    29.74  
1 1 1 5   5   28 o 7  143.43  30.05  696.95    239.54   0.00     0.00     696.95    239.54   ?       ?      143.43  30.05  0.00    30.05  
1 1 1 5   5   29 o 6  85.35   28.45  242.72    163.33   0.00     0.00     242.72    163.33   ?       ?      85.35   28.45  0.00    28.45  
1 1 1 5   5   30 o 3  43.54   18.98  -2.41     89.17    26.02    113.20   -48.89    144.76   51.60   21.92  50.34   22.89  1.26    31.70  
1 1 1 5   5   31 o 15 62.48   22.04  121.52    98.35    120.16   126.12   123.64    157.11   64.31   24.56  67.27   26.89  -2.97   36.42  
1 1 1 5   6   0  o 15 480.49  54.16  7446.47   1467.91  7675.35  2075.95  7217.59   2075.94  457.99  81.97  439.95  85.28  18.05   118.28 
1 1 1 5   6   1  o 17 350.67  37.44  3757.23   742.00   3922.54  1049.48  3592.00   1049.21  347.39  54.41  330.02  57.47  17.37   79.14  
1 1 1 5   6   2  o 15 173.86  17.94  887.51    176.44   938.75   249.73   836.43    249.31   176.99  25.30  166.39  27.03  10.60   37.02  
1 1 1 5   6   3  o 8  403.94  44.08  5091.43   1005.48  5298.48  1421.98  4884.39   1421.95  394.88  64.99  375.77  68.44  19.11   94.38  
1 1 1 5   6   4  o 1  120.02  12.12  420.12    82.39    -20.79   115.08   883.70    118.00   49.32   21.53  174.57  11.85  -125.24 24.57  
1 1 1 5   6   5  o 12 307.60  30.96  2851.09   539.21   1.27     761.40   5718.31   763.72   125.13  54.98  436.76  30.65  -311.63 62.95  
1 1 1 5   6   6  o 10 101.04  15.60  302.84    87.55    0.00     0.00     302.84    87.55    ?       ?      101.04  15.60  0.00    15.60  
1 1 1 5   6   7  o 4  260.81  41.26  2140.15   597.29   0.00     0.00     2140.15   597.29   ?       ?      260.81  41.26  0.00    41.26  
1 1 1 5   6   8  o 8  299.55  48.71  2900.28   808.95   0.00     0.00     2900.28   808.95   ?       ?      299.55  48.71  0.00    48.71  
1 1 1 5   6   9  o 8  69.60   12.10  143.94    46.58    0.00     0.00     143.94    46.58    ?       ?      69.60   12.10  0.00    12.10  
1 1 1 5   6   10 o 4  133.56  20.37  532.73    151.27   0.00     0.00     532.73    151.27   ?       ?      133.56  20.37  0.00    20.37  
1 1 1 5   6   11 o 14 243.28  25.46  1762.82   350.37   1854.56  495.75   1671.27   495.24   245.24  36.31  231.56  38.62  13.68   53.01  
1 1 1 5   6   12 o 7  220.34  23.09  1436.89   287.68   1583.48  407.28   1290.94   406.40   228.46  31.92  204.43  35.94  24.04   48.07  
1 1 1 5   6   13 o 1  185.79  19.22  1013.62   202.05   984.33   285.17   1043.15   286.31   180.70  28.43  186.37  27.59  -5.67   39.62  
1 1 1 5   6   14 o 15 654.55  77.83  14570.51  2867.40  14424.39 4054.99  14716.65  4055.24  585.79  124.43 594.39  122.91 -8.59   174.90 
1 1 1 5   6   15 o 11 167.11  25.66  833.26    238.32   833.26   238.32   0.00      0.00     167.11  25.66  ?       ?      0.00    25.66  
1 1 1 5   6   16 o 13 180.01  27.68  969.12    276.89   969.12   276.89   0.00      0.00     180.01  27.68  ?       ?      0.00    27.68  
1 1 1 5   6   17 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   6   18 o 6  128.94  21.24  496.93    151.77   496.93   151.77   0.00      0.00     128.94  21.24  ?       ?      0.00    21.24  
1 1 1 5   6   19 o 9  208.94  21.86  1291.86   258.33   1232.70  364.91   1351.29   365.76   200.38  32.86  210.63  31.19  -10.25  45.31  
1 1 1 5   6   20 o 8  96.67   13.90  276.00    74.94    227.23   105.77   325.15    106.19   86.40   21.43  104.15  18.44  -17.75  28.27  
1 1 1 5   6   21 o 13 147.44  16.84  639.51    139.96   572.78   196.60   708.09    199.30   137.20  25.91  153.66  23.33  -16.45  34.86  
1 1 1 5   6   22 f 0  173.39  19.19  887.77    187.79   769.68   262.42   1011.70   268.85   158.14  30.00  183.13  26.33  -24.99  39.92  
1 1 1 5   6   23 o 18 70.07   17.42  149.12    69.78    135.73   96.04    164.10    101.55   68.28   21.75  74.01   22.17  -5.73   31.06  
1 1 1 5   6   24 o 6  186.76  21.20  1049.67   223.29   1031.79  316.39   1067.42   315.17   180.26  31.73  183.81  30.97  -3.56   44.34  
1 1 1 5   6   25 o 17 174.71  20.11  921.83    198.03   938.41   281.88   905.68    278.26   171.58  29.69  168.40  29.88  3.18    42.12  
1 1 1 5   6   26 o 4  62.98   20.34  117.68    83.77    191.10   124.74   57.36     113.07   78.58   24.76  56.96   22.80  21.62   33.66  
1 1 1 5   6   27 o 1  57.58   20.12  93.00     81.87    109.39   120.27   78.86     111.75   64.72   24.14  59.23   22.98  5.48    33.33  
1 1 1 5   6   28 o 18 103.09  28.72  363.53    176.28   0.00     0.00     363.53    176.28   ?       ?      103.09  28.72  0.00    28.72  
1 1 1 5   6   29 o 8  98.45   28.98  340.09    174.80   0.00     0.00     340.09    174.80   ?       ?      98.45   28.98  0.00    28.98  
1 1 1 5   6   30 o 3  65.68   23.40  133.30    111.15   159.26   149.32   101.05    166.44   71.73   26.87  66.38   27.26  5.36    38.27  
1 1 1 5   6   31 o 2  66.23   23.85  141.24    115.83   60.60    157.75   235.60    170.63   60.25   25.75  80.64   28.96  -20.39  38.75  
1 1 1 5   7   0  o 17 141.87  21.46  600.80    169.29   0.00     0.00     600.80    169.29   ?       ?      141.87  21.46  0.00    21.46  
1 1 1 5   7   1  o 5  274.06  43.32  2362.47   658.96   0.00     0.00     2362.47   658.96   ?       ?      274.06  43.32  0.00    43.32  
1 1 1 5   7   2  o 1  106.86  16.33  338.67    97.00    0.00     0.00     338.67    97.00    ?       ?      106.86  16.33  0.00    16.33  
1 1 1 5   7   3  o 14 191.07  29.17  1106.96   309.78   0.00     0.00     1106.96   309.78   ?       ?      191.07  29.17  0.00    29.17  
1 1 1 5   7   4  o 14 94.41   14.69  264.14    77.02    0.00     0.00     264.14    77.02    ?       ?      94.41   14.69  0.00    14.69  
1 1 1 5   7   5  o 8  66.97   11.62  133.17    43.05    0.00     0.00     133.17    43.05    ?       ?      66.97   11.62  0.00    11.62  
1 1 1 5   7   6  o 4  385.09  67.80  5181.85   1444.12  0.00     0.00     5181.85   1444.12  ?       ?      385.09  67.80  0.00    67.80  
1 1 1 5   7   7  o 11 110.57  17.12  363.47    105.16   0.00     0.00     363.47    105.16   ?       ?      110.57  17.12  0.00    17.12  
1 1 1 5   7   8  o 8  288.40  30.50  2506.51   497.27   2713.78  703.40   2299.43   703.08   293.72  42.99  267.44  47.54  26.29   64.09  
1 1 1 5   7   9  o 10 379.05  41.24  4454.66   882.99   4741.80  1248.84  4167.62   1248.62  376.92  59.70  348.78  64.74  28.14   88.07  
1 1 1 5   7   10 o 11 225.21  23.44  1501.98   298.66   1576.54  422.61   1427.60   422.12   227.37  33.37  215.40  35.36  11.97   48.62  
1 1 1 5   7   11 o 13 395.93  67.57  5311.75   1480.66  5311.75  1480.66  0.00      0.00     395.93  67.57  ?       ?      0.00    67.57  
1 1 1 5   7   12 o 17 390.00  64.97  5032.44   1403.35  0.00     0.00     5032.44   1403.35  ?       ?      390.00  64.97  0.00    64.97  
1 1 1 5   7   13 o 13 662.95  173.62 24001.84  6684.63  24001.84 6684.63  0.00      0.00     662.95  173.62 ?       ?      0.00    173.62 
1 1 1 5   7   14 o 3  324.21  50.91  3281.34   916.29   3281.34  916.29   0.00      0.00     324.21  50.91  ?       ?      0.00    50.91  
1 1 1 5   7   15 o 3  317.89  49.78  3145.71   878.62   3145.71  878.62   0.00      0.00     317.89  49.78  ?       ?      0.00    49.78  
1 1 1 5   7   16 o 4  573.56  114.14 13015.67  3626.06  13015.67 3626.06  0.00      0.00     573.56  114.14 ?       ?      0.00    114.14 
1 1 1 5   7   17 o 1  450.34  80.79  7215.83   2011.90  0.00     0.00     7215.83   2011.90  ?       ?      450.34  80.79  0.00    80.79  
1 1 1 5   7   18 o 13 73.73   12.79  161.55    52.16    137.32   71.19    189.62    76.63    67.54   18.03  79.28   17.32  -11.74  25.00  
1 1 1 5   7   19 f 0  341.71  37.20  3600.35   717.90   3860.37  1015.54  3340.62   1014.97  342.21  53.44  314.06  58.45  28.15   79.19  
1 1 1 5   7   20 o 1  214.09  22.81  1359.93   276.05   1377.09  391.12   1342.90   389.67   211.73  33.27  208.89  33.64  2.84    47.31  
1 1 1 5   7   21 o 3  208.39  22.38  1288.30   263.53   1262.71  373.90   1313.55   371.48   202.45  33.33  206.97  32.32  -4.52   46.43  
1 1 1 5   7   22 o 9  112.57  15.64  375.39    98.36    386.07   141.85   365.49    136.51   112.49  22.75  109.45  22.48  3.04    31.98  
1 1 1 5   7   23 o 3  127.11  17.28  482.10    122.83   462.71   164.97   506.23    183.99   122.36  24.34  127.57  26.01  -5.21   35.62  
1 1 1 5   7   24 o 6  221.76  24.92  1509.69   311.72   1536.80  443.87   1483.32   437.86   215.73  37.18  211.72  37.39  4.01    52.73  
1 1 1 5   7   25 o 14 124.29  18.18  468.38    125.86   446.67   176.44   490.87    179.58   118.06  26.67  124.16  26.03  -6.10   37.26  
1 1 1 5   7   26 o 3  160.71  19.86  792.08    179.34   765.00   254.39   818.83    252.86   151.88  30.24  158.14  28.92  -6.26   41.84  
1 1 1 5   7   27 o 2  55.20   22.07  58.58     105.77   0.00     0.00     58.58     105.77   ?       ?      55.20   22.07  0.00    22.07  
1 1 1 5   7   28 o 10 169.09  33.22  1021.02   310.92   0.00     0.00     1021.02   310.92   ?       ?      169.09  33.22  0.00    33.22  
1 1 1 5   7   29 o 4  120.81  27.91  511.23    189.70   0.00     0.00     511.23    189.70   ?       ?      120.81  27.91  0.00    27.91  
1 1 1 5   7   30 o 5  65.42   22.95  136.53    106.59   143.92   164.06   131.12    140.21   69.98   27.64  66.77   25.79  3.21    37.80  
1 1 1 5   7   31 o 3  85.19   24.49  260.15    126.17   256.38   175.41   264.19    181.61   82.32   29.39  83.19   29.88  -0.87   41.91  
1 1 1 5   8   0  o 14 89.75   10.14  234.97    51.33    260.42   75.31    212.88    70.15    93.85   14.44  84.56   15.00  9.29    20.82  
1 1 1 5   8   1  o 17 450.00  49.49  6381.49   1257.48  6482.16  1778.44  6280.85   1778.25  430.97  74.58  422.59  76.10  8.37    106.55 
1 1 1 5   8   2  o 9  156.27  23.66  730.55    205.65   0.00     0.00     730.55    205.65   ?       ?      156.27  23.66  0.00    23.66  
1 1 1 5   8   3  o 1  356.44  38.08  3882.65   767.09   4093.85  1084.93  3671.53   1084.71  355.12  55.00  333.28  58.85  21.84   80.54  
1 1 1 5   8   4  o 19 335.43  33.23  3394.26   631.51   3.85     891.37   6810.93   894.82   134.98  59.39  476.33  32.93  -341.36 67.91  
1 1 1 5   8   5  o 8  220.06  22.71  1431.50   282.81   1365.52  399.43   1497.81   400.46   211.13  34.12  221.98  32.38  -10.85  47.04  
1 1 1 5   8   6  o 7  424.83  46.51  5654.86   1115.75  5748.14  1577.76  5561.55   1578.07  408.45  69.79  400.23  71.30  8.22    99.77  
1 1 1 5   8   7  o 10 129.79  13.69  492.19    100.48   484.83   140.87   499.83    143.38   127.59  19.88  129.58  19.91  -1.99   28.14  
1 1 1 5   8   8  o 16 373.22  39.77  4261.81   839.00   4160.55  1186.12  4363.20   1186.95  355.29  60.31  365.28  58.58  -9.98   84.08  
1 1 1 5   8   9  o 14 391.90  65.82  5124.23   1428.36  5124.23  1428.36  0.00      0.00     391.90  65.82  ?       ?      0.00    65.82  
1 1 1 5   8   10 o 1  160.19  24.42  766.11    217.48   766.11   217.48   0.00      0.00     160.19  24.42  ?       ?      0.00    24.42  
1 1 1 5   8   11 o 3  520.28  95.35  9845.07   2742.88  9845.07  2742.88  0.00      0.00     520.28  95.35  ?       ?      0.00    95.35  
1 1 1 5   8   12 o 3  389.87  63.22  4900.23   1366.41  4900.23  1366.41  0.00      0.00     389.87  63.22  ?       ?      0.00    63.22  
1 1 1 5   8   13 o 18 483.59  83.25  7994.43   2227.79  7994.43  2227.79  0.00      0.00     483.59  83.25  ?       ?      0.00    83.25  
1 1 1 5   8   14 o 3  239.01  36.56  1731.51   485.72   1731.51  485.72   0.00      0.00     239.01  36.56  ?       ?      0.00    36.56  
1 1 1 5   8   15 o 2  463.37  50.37  6676.05   1318.41  6756.37  1864.45  6595.72   1864.58  446.31  75.46  439.85  76.63  6.46    107.54 
1 1 1 5   8   16 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   8   17 o 8  240.90  25.20  1727.49   343.38   1704.03  485.37   1750.99   485.85   234.45  37.31  237.97  36.75  -3.52   52.37  
1 1 1 5   8   18 o 4  292.12  30.95  2583.09   511.15   2538.93  722.52   2627.33   723.24   280.99  46.41  286.51  45.49  -5.52   64.99  
1 1 1 5   8   19 o 3  222.66  23.43  1472.87   295.06   1431.74  416.26   1514.40   418.31   215.25  34.88  221.91  33.91  -6.66   48.65  
1 1 1 5   8   20 o 9  227.43  24.07  1538.97   309.47   1478.48  437.02   1599.80   438.30   218.21  36.15  227.85  34.59  -9.64   50.04  
1 1 1 5   8   21 o 5  219.37  23.35  1435.26   289.56   1394.17  408.20   1476.88   410.80   211.51  34.83  218.25  33.89  -6.75   48.60  
1 1 1 5   8   22 o 9  322.07  35.64  3270.62   647.86   3248.69  915.73   3292.60   916.69   304.13  54.45  306.61  54.05  -2.48   76.73  
1 1 1 5   8   23 f 0  171.32  20.26  884.49    195.41   919.90   275.01   848.38    277.72   170.71  29.11  162.93  30.82  7.78    42.39  
1 1 1 5   8   24 o 18 272.26  31.28  2372.05   480.07   2406.44  679.87   2337.85   677.97   258.05  47.65  253.49  48.35  4.56    67.89  
1 1 1 5   8   25 o 18 82.26   22.34  213.97    108.23   240.18   166.77   194.90    142.25   87.28   28.74  79.70   26.55  7.58    39.12  
1 1 1 5   8   26 o 14 110.87  21.05  388.35    129.07   346.30   196.20   420.43    171.36   100.82  30.94  112.58  26.89  -11.76  40.99  
1 1 1 5   8   27 o 14 146.32  30.96  745.97    251.97   0.00     0.00     745.97    251.97   ?       ?      146.32  30.96  0.00    30.96  
1 1 1 5   8   28 o 2  141.96  31.59  727.15    250.85   0.00     0.00     727.15    250.85   ?       ?      141.96  31.59  0.00    31.59  
1 1 1 5   8   29 o 9  67.99   26.76  129.32    153.26   0.00     0.00     129.32    153.26   ?       ?      67.99   26.76  0.00    26.76  
1 1 1 5   8   30 o 1  90.88   24.12  292.44    127.90   314.41   218.18   280.94    157.87   88.72   32.62  86.70   27.92  2.02    42.94  
1 1 1 5   9   0  o 17 425.00  70.15  5926.92   1651.90  5926.92  1651.90  0.00      0.00     425.00  70.15  ?       ?      0.00    70.15  
1 1 1 5   9   1  o 10 482.45  84.13  8058.72   2245.36  8058.72  2245.36  0.00      0.00     482.45  84.13  ?       ?      0.00    84.13  
1 1 1 5   9   2  o 18 341.26  54.26  3683.89   1027.46  3683.89  1027.46  0.00      0.00     341.26  54.26  ?       ?      0.00    54.26  
1 1 1 5   9   3  o 9  17.34   8.66   -94.74    35.23    -94.74   35.23    0.00      0.00     17.34   8.66   ?       ?      0.00    8.66   
1 1 1 5   9   4  o 15 229.75  35.04  1600.67   447.50   1600.67  447.50   0.00      0.00     229.75  35.04  ?       ?      0.00    35.04  
1 1 1 5   9   5  o 9  193.22  29.34  1121.16   315.21   1121.16  315.21   0.00      0.00     193.22  29.34  ?       ?      0.00    29.34  
1 1 1 5   9   6  o 16 591.41  122.01 14377.98  4004.81  14377.98 4004.81  0.00      0.00     591.41  122.01 ?       ?      0.00    122.01 
1 1 1 5   9   7  o 15 406.04  66.86  5396.43   1504.33  5396.43  1504.33  0.00      0.00     406.04  66.86  ?       ?      0.00    66.86  
1 1 1 5   9   8  o 3  396.39  64.52  5085.99   1417.82  5085.99  1417.82  0.00      0.00     396.39  64.52  ?       ?      0.00    64.52  
1 1 1 5   9   9  o 12 701.50  223.40 36372.56  10129.08 36372.56 10129.08 0.00      0.00     701.50  223.40 ?       ?      0.00    223.40 
1 1 1 5   9   10 o 3  551.32  100.71 11019.82  3069.97  11019.82 3069.97  0.00      0.00     551.32  100.71 ?       ?      0.00    100.71 
1 1 1 5   9   11 o 17 189.29  19.60  1048.85   209.93   1006.49  294.95   1092.34   298.86   183.29  29.00  191.35  28.04  -8.06   40.33  
1 1 1 5   9   12 o 9  503.03  54.64  7880.96   1552.56  7853.09  2195.46  7908.85   2195.83  479.50  82.75  481.55  82.39  -2.05   116.77 
1 1 1 5   9   13 o 9  334.84  34.69  3355.84   657.12   3100.88  928.83   3611.32   929.79   313.18  53.59  340.95  48.90  -27.77  72.55  
1 1 1 5   9   14 o 19 246.22  25.56  1794.16   356.07   1784.82  503.15   1803.52   503.97   241.54  37.50  242.89  37.34  -1.35   52.92  
1 1 1 5   9   15 o 5  334.09  54.74  3629.13   1013.45  3629.13  1013.45  0.00      0.00     334.09  54.74  ?       ?      0.00    54.74  
1 1 1 5   9   16 o 12 278.48  44.81  2466.12   692.00   0.00     0.00     2466.12   692.00   ?       ?      278.48  44.81  0.00    44.81  
1 1 1 5   9   17 o 18 120.42  14.46  426.11    97.95    443.49   136.43   407.63    140.70   121.62  20.25  116.09  21.91  5.52    29.84  
1 1 1 5   9   18 o 14 197.42  21.12  1152.96   235.65   1146.97  333.61   1158.92   332.92   193.69  31.05  194.82  30.79  -1.12   43.73  
1 1 1 5   9   19 o 18 128.31  16.64  486.15    119.70   531.87   171.31   442.53    167.33   132.68  23.34  120.37  25.03  12.31   34.23  
1 1 1 5   9   20 o 17 277.55  29.88  2337.66   468.65   2416.77  662.84   2258.59   662.72   274.42  43.53  263.96  45.37  10.46   62.87  
1 1 1 5   9   21 o 11 178.72  19.92  952.59    200.90   998.85   283.56   905.97    284.69   179.75  28.42  170.24  30.24  9.51    41.50  
1 1 1 5   9   22 o 4  203.49  22.52  1255.16   258.64   1198.30  361.26   1314.96   370.44   192.63  33.91  202.55  32.99  -9.91   47.31  
1 1 1 5   9   23 o 3  169.06  19.83  864.63    188.83   834.65   261.47   897.30    273.00   161.45  29.29  167.43  29.48  -5.97   41.56  
1 1 1 5   9   24 f 0  141.54  18.53  608.90    146.94   566.81   201.40   656.79    214.86   132.36  27.41  142.85  27.19  -10.49  38.61  
1 1 1 5   9   25 o 7  120.55  18.97  449.46    126.94   413.96   170.04   494.16    190.79   111.94  26.81  121.96  27.86  -10.02  38.67  
1 1 1 5   9   26 o 5  117.45  28.84  473.60    193.04   0.00     0.00     473.60    193.04   ?       ?      117.45  28.84  0.00    28.84  
1 1 1 5   9   27 o 13 97.33   28.64  332.42    170.73   0.00     0.00     332.42    170.73   ?       ?      97.33   28.64  0.00    28.64  
1 1 1 5   9   28 o 17 52.30   23.77  -42.30    155.68   0.00     0.00     -42.30    155.68   ?       ?      52.30   23.77  0.00    23.77  
1 1 1 5   9   29 o 2  150.18  22.41  757.92    187.29   707.64   265.83   807.48    263.92   131.44  34.72  143.67  32.73  -12.23  47.72  
1 1 1 5   9   30 o 1  154.18  25.00  845.86    213.67   887.13   313.89   810.23    291.67   139.03  38.17  134.77  36.71  4.26    52.96  
1 1 1 5   10  0  o 5  170.47  17.76  848.11    171.23   807.38   241.30   889.43    243.03   164.63  26.43  173.24  25.17  -8.61   36.50  
1 1 1 5   10  1  o 6  216.13  22.26  1367.87   272.19   1303.81  384.29   1432.36   385.58   208.44  33.23  219.12  31.56  -10.68  45.83  
1 1 1 5   10  2  o 10 304.77  31.46  2747.18   542.59   2722.43  767.03   2771.98   767.65   298.44  46.27  301.37  45.81  -2.93   65.11  
1 1 1 5   10  3  o 16 189.95  19.46  1054.57   209.24   4.08     292.30   2158.63   299.66   82.16   35.07  272.50  19.28  -190.35 40.02  
1 1 1 5   10  4  f 0  472.87  50.34  6830.19   1345.48  6740.10  1902.60  6920.31   1903.00  453.44  75.76  460.45  74.54  -7.01   106.28 
1 1 1 5   10  5  o 1  120.96  13.36  426.69    91.21    461.34   127.39   390.26    130.64   125.03  18.29  114.36  20.66  10.67   27.59  
1 1 1 5   10  6  o 11 468.78  49.64  6710.99   1315.50  6173.22  1860.10  7249.10   1860.69  431.45  77.97  473.76  70.57  -42.30  105.16 
1 1 1 5   10  7  o 10 134.31  14.45  526.11    109.68   476.42   153.30   578.21    156.98   126.40  21.92  139.91  20.12  -13.51  29.76  
1 1 1 5   10  8  o 15 385.44  40.33  4465.56   879.11   4365.86  1243.06  4565.32   1243.43  371.17  60.42  380.61  58.80  -9.44   84.31  
1 1 1 5   10  9  o 7  207.98  21.44  1267.96   252.34   1208.97  356.43   1327.24   357.29   200.49  32.05  210.71  30.42  -10.22  44.18  
1 1 1 5   10  10 o 8  274.23  28.20  2223.45   437.58   2085.89  618.06   2361.70   619.62   260.70  42.78  278.87  39.83  -18.17  58.45  
1 1 1 5   10  11 o 12 469.23  50.62  6827.70   1341.94  6624.65  1897.35  7030.94   1898.25  441.32  77.73  457.38  74.88  -16.06  107.93 
1 1 1 5   10  12 o 4  274.24  28.35  2235.72   439.95   2073.80  620.89   2399.00   623.48   258.23  43.42  279.68  39.97  -21.45  59.02  
1 1 1 5   10  13 o 12 441.54  48.03  6123.26   1197.93  5710.47  1693.54  6536.62   1694.71  401.83  76.20  436.79  69.95  -34.96  103.44 
1 1 1 5   10  14 o 6  310.56  32.91  2921.44   577.78   2919.10  816.61   2923.79   817.60   301.46  48.86  301.69  48.88  -0.23   69.11  
1 1 1 5   10  15 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   10  16 o 9  138.07  15.72  560.10    122.38   540.55   169.72   581.28    176.62   133.93  22.90  138.99  22.94  -5.06   32.41  
1 1 1 5   10  17 o 6  108.48  14.94  347.26    90.59    325.90   125.91   370.20    130.43   103.62  21.86  110.71  21.30  -7.09   30.52  
1 1 1 5   10  18 o 16 372.08  40.45  4313.42   850.17   4202.30  1201.74  4424.76   1202.90  349.79  62.12  360.86  60.19  -11.08  86.50  
1 1 1 5   10  19 o 19 255.26  26.91  1964.55   388.39   1818.93  547.84   2111.69   550.69   237.93  41.62  258.78  38.22  -20.86  56.51  
1 1 1 5   10  20 o 4  188.10  20.21  1056.49   214.87   953.92   301.66   1162.11   306.12   174.07  31.34  193.99  28.32  -19.91  42.24  
1 1 1 5   10  21 o 19 313.85  35.42  3176.05   627.04   3085.04  885.72   3267.49   887.81   287.94  55.60  298.75  53.74  -10.81  77.33  
1 1 1 5   10  22 o 14 118.70  18.32  427.48    120.81   457.95   166.42   393.52    175.66   120.49  24.88  110.58  27.73  9.90    37.26  
1 1 1 5   10  23 o 1  128.63  18.80  505.15    134.70   438.40   184.87   580.70    196.68   115.79  28.10  134.53  26.41  -18.74  38.56  
1 1 1 5   10  24 o 13 88.21   28.05  253.35    159.75   0.00     0.00     253.35    159.75   ?       ?      88.21   28.05  0.00    28.05  
1 1 1 5   10  25 o 10 221.00  47.59  2020.63   585.95   0.00     0.00     2020.63   585.95   ?       ?      221.00  47.59  0.00    47.59  
1 1 1 5   10  26 o 5  59.80   25.15  51.44     146.53   0.00     0.00     51.44     146.53   ?       ?      59.80   25.15  0.00    25.15  
1 1 1 5   10  27 o 14 77.09   28.69  193.05    169.77   0.00     0.00     193.05    169.77   ?       ?      77.09   28.69  0.00    28.69  
1 1 1 5   10  28 o 16 117.70  21.44  461.85    139.53   429.89   183.02   506.19    215.59   107.22  29.03  113.86  31.78  -6.65   43.04  
1 1 1 5   10  29 o 7  151.47  22.63  788.23    190.75   740.04   256.61   847.76    285.18   133.50  33.53  140.68  35.36  -7.18   48.73  
1 1 1 5   11  0  o 19 272.91  28.18  2196.55   435.09   2170.03  614.84   2223.16   615.78   267.23  41.42  270.73  40.90  -3.50   58.21  
1 1 1 5   11  1  o 8  172.21  18.03  866.36    175.65   822.97   247.04   910.72    249.79   166.04  26.83  175.13  25.60  -9.09   37.09  
1 1 1 5   11  2  o 8  264.77  26.46  2061.97   396.77   86.19    558.64   4073.34   563.64   116.11  48.98  373.00  26.50  -256.88 55.69  
1 1 1 5   11  3  o 12 372.75  58.96  4370.83   1219.81  0.00     0.00     4370.83   1219.81  ?       ?      372.75  58.96  0.00    58.96  
1 1 1 5   11  4  f 0  329.49  34.28  3229.91   638.94   3331.61  903.34   3128.09   903.86   328.76  49.39  317.52  51.34  11.24   71.24  
1 1 1 5   11  5  o 14 349.55  36.38  3650.04   719.34   3520.05  1016.96  3780.21   1017.64  335.27  54.72  348.80  52.44  -13.53  75.80  
1 1 1 5   11  6  o 5  604.23  67.52  11739.59  2301.98  10824.15 3255.21  12655.36  3255.78  536.55  109.40 593.87  98.98  -57.32  147.53 
1 1 1 5   11  7  o 14 223.26  22.97  1464.95   290.21   1328.57  409.62   1602.40   411.22   209.16  35.38  231.26  31.82  -22.10  47.58  
1 1 1 5   11  8  o 5  287.47  44.87  2556.21   716.28   0.00     0.00     2556.21   716.28   ?       ?      287.47  44.87  0.00    44.87  
1 1 1 5   11  9  o 2  440.73  47.45  6022.68   1181.71  5734.72  1670.80  6310.91   1671.58  409.87  73.72  434.14  69.41  -24.27  101.25 
1 1 1 5   11  10 o 12 328.20  34.59  3250.40   641.96   3221.04  907.57   3279.80   908.17   317.76  51.52  321.02  50.98  -3.26   72.48  
1 1 1 5   11  11 o 4  51.34   14.81  77.92     46.07    60.95    60.85    100.71    70.52    49.04   17.33  59.18   18.61  -10.14  25.43  
1 1 1 5   11  12 o 11 321.46  34.00  3137.49   617.94   2999.58  873.01   3275.97   874.79   303.80  51.92  319.52  49.27  -15.72  71.58  
1 1 1 5   11  13 o 12 269.07  28.35  2171.09   431.28   2129.53  608.04   2213.17   611.82   260.01  42.18  265.53  41.49  -5.52   59.17  
1 1 1 5   11  14 o 5  308.82  50.43  3084.78   863.21   3084.78  863.21   0.00      0.00     308.82  50.43  ?       ?      0.00    50.43  
1 1 1 5   11  15 o 6  42.71   18.85  -26.15    90.45    0.00     0.00     -26.15    90.45    ?       ?      42.71   18.85  0.00    18.85  
1 1 1 5   11  16 o 15 110.61  15.39  361.39    95.09    364.56   129.03   357.62    140.68   109.84  21.23  108.35  23.31  1.49    31.53  
1 1 1 5   11  17 o 17 259.75  27.45  2028.98   403.14   1956.82  568.34   2102.06   571.93   248.23  41.34  258.28  39.85  -10.06  57.42  
1 1 1 5   11  18 o 7  508.82  64.81  9422.06   1850.31  9183.01  2616.16  9661.31   2617.30  427.17  106.94 445.19  104.25 -18.02  149.35 
1 1 1 5   11  19 f 0  251.69  27.32  1943.73   388.44   1933.63  547.42   1953.98   551.28   241.98  40.86  243.21  40.94  -1.24   57.84  
1 1 1 5   11  20 o 13 124.22  15.65  459.84    109.11   454.72   149.59   465.66    159.51   121.35  22.29  122.37  23.56  -1.03   32.44  
1 1 1 5   11  21 o 17 161.26  18.91  785.04    171.70   743.05   233.72   834.27    253.08   152.76  27.67  161.73  28.29  -8.97   39.57  
1 1 1 5   11  22 f 0  196.38  36.56  1323.78   396.94   0.00     0.00     1323.78   396.94   ?       ?      196.38  36.56  0.00    36.56  
1 1 1 5   11  23 o 18 98.49   28.02  323.50    165.94   0.00     0.00     323.50    165.94   ?       ?      98.49   28.02  0.00    28.02  
1 1 1 5   11  24 o 3  186.21  37.90  1285.86   391.33   0.00     0.00     1285.86   391.33   ?       ?      186.21  37.90  0.00    37.90  
1 1 1 5   11  25 o 11 98.13   29.75  341.13    182.08   0.00     0.00     341.13    182.08   ?       ?      98.13   29.75  0.00    29.75  
1 1 1 5   11  26 o 3  101.77  30.77  383.61    194.94   0.00     0.00     383.61    194.94   ?       ?      101.77  30.77  0.00    30.77  
1 1 1 5   11  27 o 16 63.46   23.11  124.80    109.12   148.34   146.95   95.87     162.91   69.13   26.48  64.46   26.77  4.67    37.65  
1 1 1 5   11  28 o 12 87.52   23.91  274.90    123.50   185.19   160.24   406.13    193.80   72.75   27.70  100.21  30.75  -27.45  41.39  
1 1 1 5   12  0  o 16 168.28  16.47  827.13    157.06   746.92   241.68   885.76    206.64   157.32  27.78  173.26  21.22  -15.94  34.95  
1 1 1 5   12  1  o 9  442.66  47.51  6062.93   1188.32  5432.15  1680.19  6694.25   1680.90  397.31  76.44  450.23  67.08  -52.93  101.70 
1 1 1 5   12  2  o 8  230.62  22.84  1565.40   298.37   3.07     417.66   3193.65   426.38   96.66   41.61  330.24  22.63  -233.58 47.36  
1 1 1 5   12  3  o 7  75.95   13.19  171.22    55.44    186.03   74.52    152.87    82.97    78.66   17.00  71.44   19.63  7.23    25.97  
1 1 1 5   12  4  o 17 256.58  26.78  1952.28   388.67   1980.13  548.77   1924.25   550.56   254.11  38.85  250.10  39.67  4.01    55.53  
1 1 1 5   12  5  o 12 50.67   15.69  73.97     50.33    39.37    66.03    121.94    77.75    45.79   17.69  64.49   19.41  -18.70  26.27  
1 1 1 5   12  6  o 16 150.08  16.54  660.24    140.15   696.80   196.19   622.15    200.28   152.79  23.09  143.69  25.20  9.10    34.17  
1 1 1 5   12  7  o 12 165.38  17.86  802.99    166.88   757.05   234.43   850.19    237.61   158.37  26.74  168.42  25.36  -10.05  36.85  
1 1 1 5   12  8  o 10 194.42  20.56  1113.86   225.96   1046.90  317.53   1182.55   321.62   185.45  30.91  197.92  29.18  -12.47  42.51  
1 1 1 5   12  9  o 15 354.02  37.61  3830.15   752.59   3593.94  1063.39  4067.20   1065.26  329.53  58.35  354.10  54.12  -24.57  79.58  
1 1 1 5   12  10 o 19 267.53  27.95  2138.39   422.99   1973.91  596.75   2304.48   599.67   250.42  43.06  272.82  39.43  -22.40  58.39  
1 1 1 5   12  11 o 11 194.88  20.92  1120.82   230.42   1130.98  325.15   1110.56   326.59   192.97  30.35  191.02  30.83  1.95    43.27  
1 1 1 5   12  12 o 12 318.27  33.46  3063.31   602.18   2848.74  850.75   3278.76   852.49   296.78  51.82  321.48  47.63  -24.70  70.38  
1 1 1 5   12  13 o 13 437.09  48.54  6053.87   1197.34  6124.89  1693.01  5982.79   1693.57  416.18  73.55  410.04  74.70  6.14    104.83 
1 1 1 5   12  14 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   12  15 o 10 219.09  23.35  1429.18   289.19   1393.54  405.22   1466.16   412.83   212.00  34.48  217.70  34.16  -5.70   48.53  
1 1 1 5   12  16 o 2  129.10  16.11  492.94    116.77   400.81   155.26   612.93    177.18   114.12  24.44  142.44  22.41  -28.32  33.15  
1 1 1 5   12  17 o 17 195.07  32.17  1198.61   347.69   0.00     0.00     1198.61   347.69   ?       ?      195.07  32.17  0.00    32.17  
1 1 1 5   12  18 o 4  60.95   21.06  102.08    89.54    0.00     0.00     102.08    89.54    ?       ?      60.95   21.06  0.00    21.06  
1 1 1 5   12  19 o 5  75.24   22.52  173.68    104.81   0.00     0.00     173.68    104.81   ?       ?      75.24   22.52  0.00    22.52  
1 1 1 5   12  20 o 5  111.01  23.67  389.18    146.24   0.00     0.00     389.18    146.24   ?       ?      111.01  23.67  0.00    23.67  
1 1 1 5   12  21 o 13 121.99  30.86  500.75    216.20   0.00     0.00     500.75    216.20   ?       ?      121.99  30.86  0.00    30.86  
1 1 1 5   12  22 o 19 70.44   27.30  124.84    157.54   0.00     0.00     124.84    157.54   ?       ?      70.44   27.30  0.00    27.30  
1 1 1 5   12  23 o 15 283.31  37.09  2934.61   588.68   2911.42  830.65   2958.02   834.41   241.07  60.21  243.50  60.07  -2.44   85.05  
1 1 1 5   12  24 o 12 97.41   21.72  310.69    118.37   267.55   157.77   366.25    179.04   88.07   27.86  101.67  29.16  -13.60  40.33  
1 1 1 5   12  25 o 10 56.21   21.80  79.07     100.46   146.94   130.71   -18.88    157.03   68.93   25.26  54.31   24.35  14.62   35.08  
1 1 1 5   12  26 o 4  65.76   23.12  139.73    108.23   122.63   138.28   166.77    173.90   65.21   25.49  72.68   28.54  -7.47   38.26  
1 1 1 5   12  27 o 19 72.54   24.02  186.11    116.47   168.84   149.06   213.21    186.65   70.34   26.73  76.43   29.69  -6.09   39.95  
1 1 1 5   13  0  o 5  415.01  69.06  5681.77   1587.56  0.00     0.00     5681.77   1587.56  ?       ?      415.01  69.06  0.00    69.06  
1 1 1 5   13  1  o 14 442.75  75.56  6633.38   1851.72  0.00     0.00     6633.38   1851.72  ?       ?      442.75  75.56  0.00    75.56  
1 1 1 5   13  2  o 7  589.42  123.74 14545.84  4053.44  0.00     0.00     14545.84  4053.44  ?       ?      589.42  123.74 0.00    123.74 
1 1 1 5   13  3  o 18 166.83  27.49  837.00    254.13   0.00     0.00     837.00    254.13   ?       ?      166.83  27.49  0.00    27.49  
1 1 1 5   13  4  o 6  140.85  25.31  597.42    197.14   0.00     0.00     597.42    197.14   ?       ?      140.85  25.31  0.00    25.31  
1 1 1 5   13  5  o 4  253.69  39.89  1980.29   561.84   0.00     0.00     1980.29   561.84   ?       ?      253.69  39.89  0.00    39.89  
1 1 1 5   13  6  o 1  143.65  25.34  621.49    201.36   0.00     0.00     621.49    201.36   ?       ?      143.65  25.34  0.00    25.34  
1 1 1 5   13  7  o 19 260.50  41.30  2100.42   597.08   0.00     0.00     2100.42   597.08   ?       ?      260.50  41.30  0.00    41.30  
1 1 1 5   13  8  o 13 235.99  37.60  1711.55   492.30   0.00     0.00     1711.55   492.30   ?       ?      235.99  37.60  0.00    37.60  
1 1 1 5   13  9  o 16 196.83  32.19  1179.69   351.13   0.00     0.00     1179.69   351.13   ?       ?      196.83  32.19  0.00    32.19  
1 1 1 5   13  10 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   13  11 o 5  361.01  61.48  4383.31   1228.45  0.00     0.00     4383.31   1228.45  ?       ?      361.01  61.48  0.00    61.48  
1 1 1 5   13  12 o 13 421.42  79.48  6634.02   1852.26  0.00     0.00     6634.02   1852.26  ?       ?      421.42  79.48  0.00    79.48  
1 1 1 5   13  13 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   13  14 o 19 235.25  38.67  1770.18   504.13   0.00     0.00     1770.18   504.13   ?       ?      235.25  38.67  0.00    38.67  
1 1 1 5   13  15 o 10 267.36  46.14  2412.83   682.64   0.00     0.00     2412.83   682.64   ?       ?      267.36  46.14  0.00    46.14  
1 1 1 5   13  16 o 17 124.45  25.10  483.23    173.15   0.00     0.00     483.23    173.15   ?       ?      124.45  25.10  0.00    25.10  
1 1 1 5   13  17 o 4  185.36  32.06  1106.10   328.82   0.00     0.00     1106.10   328.82   ?       ?      185.36  32.06  0.00    32.06  
1 1 1 5   13  18 o 8  92.26   22.15  267.18    115.85   0.00     0.00     267.18    115.85   ?       ?      92.26   22.15  0.00    22.15  
1 1 1 5   13  19 o 17 174.68  19.24  927.08    189.75   818.64   264.75   1041.62   272.10   157.85  30.32  180.69  27.06  -22.84  40.64  
1 1 1 5   13  20 o 10 236.30  27.12  1798.08   361.19   1595.44  499.69   2019.80   522.69   205.79  43.65  236.89  39.85  -31.10  59.11  
1 1 1 5   13  21 o 8  48.44   20.14  27.21     92.41    24.02    110.46   34.65     168.67   51.57   21.77  62.12   26.58  -10.55  34.36  
1 1 1 5   13  22 o 13 119.71  20.87  457.36    138.22   423.32   179.17   507.41    217.25   110.81  28.12  119.29  31.33  -8.48   42.10  
1 1 1 5   13  23 o 17 121.00  22.37  479.50    149.69   447.20   197.60   522.99    229.30   111.33  30.17  118.54  32.66  -7.21   44.46  
1 1 1 5   13  24 o 12 192.61  25.21  1257.47   272.08   1250.57  380.25   1264.71   389.48   174.61  38.93  174.32  39.80  0.29    55.67  
1 1 1 5   13  25 o 11 55.80   24.38  26.71     147.78   26.71    147.78   0.00      0.00     55.80   24.38  ?       ?      0.00    24.38  
1 1 1 5   13  26 o 15 81.24   28.93  254.77    169.94   254.77   169.94   0.00      0.00     81.24   28.93  ?       ?      0.00    28.93  
1 1 1 5   14  0  o 4  286.08  35.03  2486.22   563.37   2397.04  795.73   2575.86   797.72   271.80  52.90  283.12  50.96  -11.32  73.45  
1 1 1 5   14  1  o 4  97.24   15.41  280.26    83.17    5.51     102.17   820.12    143.21   49.32   20.88  167.69  15.04  -118.38 25.73  
1 1 1 5   14  2  o 12 227.30  22.33  1523.19   287.62   1544.71  444.61   1507.70   377.17   224.52  35.69  223.77  30.13  0.76    46.70  
1 1 1 5   14  3  o 15 179.48  18.42  945.39    187.10   824.88   276.15   1047.65   254.38   164.43  30.37  187.64  24.18  -23.20  38.82  
1 1 1 5   14  4  o 15 378.81  40.75  4410.76   872.30   4409.56  1232.95  4411.96   1234.29  364.71  61.05  364.76  61.10  -0.06   86.37  
1 1 1 5   14  5  o 7  170.50  19.04  855.97    183.18   817.26   256.31   896.39    261.89   164.14  28.22  172.33  27.39  -8.19   39.32  
1 1 1 5   14  6  o 3  98.26   15.91  286.90    86.70    281.52   117.64   293.29    128.27   96.27   21.80  98.12   23.15  -1.85   31.80  
1 1 1 5   14  7  o 19 94.21   16.46  265.01    85.79    319.24   114.08   194.39    130.17   102.89  20.04  81.25   25.25  21.64   32.23  
1 1 1 5   14  8  o 10 320.24  34.22  3132.82   619.28   3013.23  874.74   3252.99   876.85   302.55  52.25  316.25  49.96  -13.70  72.29  
1 1 1 5   14  9  o 18 179.00  19.79  948.72    199.95   916.92   279.80   981.91    285.85   172.93  29.23  179.26  28.75  -6.33   41.00  
1 1 1 5   14  10 o 7  70.91   17.77  152.56    72.17    174.19   92.82    119.49    114.78   75.76   20.74  67.40   23.80  8.36    31.57  
1 1 1 5   14  11 o 6  183.04  20.03  997.01    207.00   895.98   289.03   1103.40   296.61   169.41  30.86  189.63  28.10  -20.21  41.73  
1 1 1 5   14  12 o 9  276.64  30.11  2360.36   470.49   2329.26  662.97   2391.92   667.79   263.89  45.40  267.77  45.04  -3.88   63.95  
1 1 1 5   14  13 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   14  14 f 0  85.89   23.14  229.24    116.63   0.00     0.00     229.24    116.63   ?       ?      85.89   23.14  0.00    23.14  
1 1 1 5   14  15 o 9  155.62  18.01  725.67    157.91   682.12   219.43   772.45    227.42   147.15  26.97  157.21  26.11  -10.06  37.54  
1 1 1 5   14  16 o 13 104.13  16.18  327.10    93.61    323.02   126.41   332.06    139.29   101.54  22.30  102.43  24.09  -0.89   32.83  
1 1 1 5   14  17 o 11 45.64   17.94  38.75     68.85    -7.31    87.75    112.54    111.06   43.50   18.90  64.62   23.35  -21.13  30.03  
1 1 1 5   14  18 o 16 81.83   18.63  209.33    85.56    179.46   110.13   254.79    135.86   75.59   23.18  88.71   25.39  -13.12  34.38  
1 1 1 5   14  19 o 15 114.15  17.26  400.33    109.58   495.76   147.04   281.13    164.34   125.37  21.18  91.83   28.34  33.55   35.39  
1 1 1 5   14  20 o 15 160.22  31.40  892.48    278.45   892.48   278.45   0.00      0.00     160.22  31.40  ?       ?      0.00    31.40  
1 1 1 5   14  21 o 6  50.83   22.15  2.71      121.44   2.71     121.44   0.00      0.00     50.83   22.15  ?       ?      0.00    22.15  
1 1 1 5   14  22 o 6  103.19  26.42  370.73    157.19   370.73   157.19   0.00      0.00     103.19  26.42  ?       ?      0.00    26.42  
1 1 1 5   14  23 o 19 67.17   25.84  133.52    140.30   133.52   140.30   0.00      0.00     67.17   25.84  ?       ?      0.00    25.84  
1 1 1 5   14  24 o 10 48.13   21.83  -28.71    130.50   -28.71   130.50   0.00      0.00     48.13   21.83  ?       ?      0.00    21.83  
1 1 1 5   14  25 o 17 64.03   25.46  124.46    140.00   124.46   140.00   0.00      0.00     64.03   25.46  ?       ?      0.00    25.46  
1 1 1 5   15  0  x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   15  1  o 9  453.29  110.14 10005.33  2837.60  0.00     0.00     10005.33  2837.60  ?       ?      453.29  110.14 0.00    110.14 
1 1 1 5   15  2  o 8  259.83  36.74  2114.59   532.71   2441.57  668.33   1544.92   882.14   274.95  43.81  204.71  66.00  70.24   79.22  
1 1 1 5   15  3  o 12 276.58  42.33  2456.32   650.67   3133.85  843.36   1459.91   1022.75  307.41  49.47  197.73  70.92  109.68  86.47  
1 1 1 5   15  4  o 14 257.06  35.24  2062.71   506.36   2290.03  631.08   1651.81   848.45   266.34  42.72  211.34  64.25  55.00   77.15  
1 1 1 5   15  5  o 6  283.20  47.60  2658.29   746.42   2658.29  746.42   0.00      0.00     283.20  47.60  ?       ?      0.00    47.60  
1 1 1 5   15  6  o 9  332.72  59.94  3942.86   1102.69  3942.86  1102.69  0.00      0.00     332.72  59.94  ?       ?      0.00    59.94  
1 1 1 5   15  7  o 13 136.78  23.78  571.24    179.92   571.24   179.92   0.00      0.00     136.78  23.78  ?       ?      0.00    23.78  
1 1 1 5   15  8  o 1  209.06  34.05  1381.81   394.59   1381.81  394.59   0.00      0.00     209.06  34.05  ?       ?      0.00    34.05  
1 1 1 5   15  9  o 1  197.91  32.52  1236.06   356.67   1236.06  356.67   0.00      0.00     197.91  32.52  ?       ?      0.00    32.52  
1 1 1 5   15  10 o 1  193.31  31.97  1182.27   342.35   1182.27  342.35   0.00      0.00     193.31  31.97  ?       ?      0.00    31.97  
1 1 1 5   15  11 o 10 132.63  23.93  543.58    175.48   543.58   175.48   0.00      0.00     132.63  23.93  ?       ?      0.00    23.93  
1 1 1 5   15  12 o 19 172.29  28.83  937.32    275.08   937.32   275.08   0.00      0.00     172.29  28.83  ?       ?      0.00    28.83  
1 1 1 5   15  13 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   15  14 o 16 232.91  41.75  1900.26   537.77   1900.26  537.77   0.00      0.00     232.91  41.75  ?       ?      0.00    41.75  
1 1 1 5   15  15 o 4  139.02  24.96  614.18    191.86   614.18   191.86   0.00      0.00     139.02  24.96  ?       ?      0.00    24.96  
1 1 1 5   15  16 o 8  89.35   22.31  255.25    114.11   255.25   114.11   0.00      0.00     89.35   22.31  ?       ?      0.00    22.31  
1 1 1 5   15  17 o 14 56.54   20.57  85.26     86.42    85.26    86.42    0.00      0.00     56.54   20.57  ?       ?      0.00    20.57  
1 1 1 5   15  18 f 0  169.95  31.37  996.81    294.77   996.81   294.77   0.00      0.00     169.95  31.37  ?       ?      0.00    31.37  
1 1 1 5   15  19 o 11 101.80  24.81  347.05    143.61   347.05   143.61   0.00      0.00     101.80  24.81  ?       ?      0.00    24.81  
1 1 1 5   15  20 o 6  107.47  27.33  403.01    168.97   403.01   168.97   0.00      0.00     107.47  27.33  ?       ?      0.00    27.33  
1 1 1 5   15  21 o 18 165.36  22.43  900.18    207.45   881.49   278.96   923.30    310.29   153.13  32.73  152.82  35.97  0.31    48.63  
1 1 1 5   15  22 f 0  86.02   23.22  256.91    117.28   280.88   141.66   204.65    209.11   88.22   26.12  77.93   31.07  10.28   40.59  
1 1 1 5   15  23 o 5  105.95  23.11  392.59    136.62   374.79   168.66   426.56    232.96   98.83   28.29  99.35   33.98  -0.53   44.21  
1 1 1 5   16  0  o 3  45.38   14.29  59.32     41.56    -3.33    45.07    414.81    107.36   31.76   13.67  118.01  16.28  -86.25  21.26  
1 1 1 5   16  1  o 9  96.87   14.97  279.89    80.56    330.37   106.03   210.96    123.90   104.57  18.33  83.04   24.39  21.53   30.51  
1 1 1 5   16  2  o 1  201.97  21.31  1222.50   243.34   1350.20  360.71   1115.85   329.65   207.66  31.22  188.25  31.62  19.41   44.44  
1 1 1 5   16  3  f 0  323.53  33.26  3281.84   608.98   3725.99  997.66   3018.07   768.83   322.23  55.96  298.99  46.29  23.24   72.63  
1 1 1 5   16  4  o 2  204.32  21.56  1253.72   249.07   1277.97  370.37   1233.71   336.54   200.49  33.35  198.45  30.52  2.04    45.21  
1 1 1 5   16  5  o 16 208.57  21.22  1305.67   250.54   1372.63  372.43   1250.32   338.62   208.34  32.17  199.58  30.52  8.76    44.35  
1 1 1 5   16  6  o 11 134.42  16.75  538.38    126.46   541.41   171.31   534.76    187.48   132.63  23.35  130.88  25.87  1.75    34.85  
1 1 1 5   16  7  o 7  105.44  16.09  333.31    94.30    366.14   123.96   288.20    145.28   109.32  20.50  95.74   25.84  13.58   32.99  
1 1 1 5   16  8  o 12 249.60  27.97  1938.30   393.85   2053.98  553.94   1820.04   560.09   247.33  40.41  229.41  44.13  17.91   59.84  
1 1 1 5   16  9  o 5  87.95   17.36  236.13    84.54    198.51   109.55   291.54    132.94   79.96   22.77  96.17   24.12  -16.22  33.17  
1 1 1 5   16  10 o 13 284.53  32.45  2612.05   520.54   2600.32  733.37   2623.96   738.97   265.38  49.97  266.39  50.16  -1.00   70.81  
1 1 1 5   16  11 o 6  104.01  16.49  327.58    95.19    325.59   123.68   330.48    149.08   101.93  21.80  101.52  25.59  0.41    33.62  
1 1 1 5   16  12 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   16  13 o 16 213.65  23.80  1428.69   286.93   1267.94  401.11   1597.14   410.60   189.51  38.19  217.27  34.04  -27.76  51.16  
1 1 1 5   16  14 o 3  175.53  19.95  948.61    197.43   804.64   271.51   1110.16   287.61   153.87  31.79  184.38  28.06  -30.52  42.40  
1 1 1 5   16  15 o 11 126.18  17.62  488.68    124.15   534.36   166.54   431.55    186.27   129.11  23.33  112.91  28.68  16.19   36.97  
1 1 1 5   16  16 o 7  179.41  21.07  1010.85   212.86   982.29   296.68   1041.15   305.59   168.11  31.91  173.18  31.91  -5.07   45.13  
1 1 1 5   16  17 o 18 115.05  16.68  408.66    106.95   355.44   142.55   477.22    161.79   103.28  24.43  120.19  24.28  -16.92  34.45  
1 1 1 5   16  18 o 3  201.21  24.64  1337.03   278.69   1394.19  390.83   1277.89   397.50   191.13  36.96  179.13  39.70  12.00   54.24  
1 1 1 5   16  19 o 17 98.77   23.35  330.30    130.27   304.11   166.90   371.12    208.39   91.88   28.60  99.00   32.09  -7.12   42.99  
1 1 1 5   16  20 o 1  150.53  22.54  758.42    188.78   730.45   256.71   791.37    278.59   136.63  33.09  140.31  34.77  -3.69   47.99  
1 1 1 5   16  21 o 19 73.14   24.64  186.87    122.49   184.26   151.72   191.75    207.60   73.07   27.14  75.72   30.69  -2.64   40.97  
1 1 1 5   17  0  o 10 95.58   23.81  286.99    130.14   0.00     0.00     286.99    130.14   ?       ?      95.58   23.81  0.00    23.81  
1 1 1 5   17  1  o 1  86.25   15.31  224.53    73.03    270.99   92.86    149.21    118.24   94.28   17.81  71.76   24.21  22.52   30.06  
1 1 1 5   17  2  o 17 208.72  22.87  1329.03   269.49   1472.34  397.19   1206.76   366.86   213.01  33.59  191.84  34.58  21.17   48.21  
1 1 1 5   17  3  o 7  219.65  38.31  1619.55   465.52   0.00     0.00     1619.55   465.52   ?       ?      219.65  38.31  0.00    38.31  
1 1 1 5   17  4  o 2  67.93   17.55  141.84    68.91    181.36   88.11    79.59     110.58   76.49   19.88  59.90   22.96  16.59   30.38  
1 1 1 5   17  5  o 16 65.14   17.43  130.20    66.45    147.51   82.17    97.48     112.94   69.27   19.72  62.82   23.40  6.45    30.60  
1 1 1 5   17  6  o 8  157.39  18.23  746.59    161.69   785.13   226.29   706.40    231.10   157.87  25.86  148.40  28.16  9.47    38.23  
1 1 1 5   17  7  o 2  224.15  23.88  1554.00   302.49   1663.37  449.51   1463.49   408.93   222.03  36.54  209.03  35.34  13.00   50.83  
1 1 1 5   17  8  o 4  188.38  21.81  1091.22   231.50   1162.17  321.01   1014.34   334.16   188.73  30.68  173.14  34.83  15.59   46.41  
1 1 1 5   17  9  o 6  338.01  43.02  4107.86   815.91   4141.89  1151.40  4073.53   1156.36  294.93  69.20  290.27  70.18  4.65    98.56  
1 1 1 5   17  10 o 4  75.65   17.61  177.90    75.04    181.19   94.49    172.30    123.46   75.86   20.99  74.97   24.73  0.89    32.43  
1 1 1 5   17  11 o 18 64.34   21.54  122.95    93.62    122.95   93.62    0.00      0.00     64.34   21.54  ?       ?      0.00    21.54  
1 1 1 5   17  12 o 2  68.75   25.05  133.06    128.27   0.00     0.00     133.06    128.27   ?       ?      68.75   25.05  0.00    25.05  
1 1 1 5   17  13 o 3  51.86   19.11  69.03     74.93    53.09    89.92    105.26    135.53   51.66   20.45  65.39   25.33  -13.73  32.55  
1 1 1 5   17  14 o 16 194.75  23.21  1214.03   254.36   1198.76  351.60   1230.81   368.44   182.55  34.82  183.45  36.27  -0.90   50.28  
1 1 1 5   17  15 o 3  193.17  22.93  1202.45   249.33   1146.37  344.34   1264.26   361.51   176.34  35.25  185.41  35.25  -9.07   49.85  
1 1 1 5   17  16 o 14 80.20   19.33  208.18    87.96    204.01   109.19   215.91    148.45   78.33   22.87  80.08   27.13  -1.75   35.48  
1 1 1 5   17  17 o 9  137.05  18.21  594.30    139.75   544.75   189.29   653.69    207.21   124.30  27.28  136.40  27.41  -12.10  38.67  
1 1 1 5   17  18 o 7  80.43   24.08  224.77    119.81   209.27   146.68   255.85    207.68   77.46   26.94  83.73   31.62  -6.27   41.54  
1 1 1 5   17  19 o 4  133.66  23.20  611.08    171.54   599.93   225.02   626.55    265.04   123.73  31.58  121.13  35.70  2.60    47.66  
1 1 1 5   18  0  f 0  69.79   23.51  143.42    111.49   0.00     0.00     143.42    111.49   ?       ?      69.79   23.51  0.00    23.51  
1 1 1 5   18  1  o 2  121.91  26.02  476.91    176.58   0.00     0.00     476.91    176.58   ?       ?      121.91  26.02  0.00    26.02  
1 1 1 5   18  2  o 16 99.55   24.68  317.59    140.34   0.00     0.00     317.59    140.34   ?       ?      99.55   24.68  0.00    24.68  
1 1 1 5   18  3  o 13 56.82   22.50  62.26     108.92   0.00     0.00     62.26     108.92   ?       ?      56.82   22.50  0.00    22.50  
1 1 1 5   18  4  o 13 118.98  25.44  455.12    168.47   0.00     0.00     455.12    168.47   ?       ?      118.98  25.44  0.00    25.44  
1 1 1 5   18  5  o 17 147.90  17.26  661.40    143.75   588.33   197.76   743.28    209.34   134.95  26.47  153.14  24.65  -18.19  36.17  
1 1 1 5   18  6  f 0  122.22  16.95  453.87    115.75   522.59   155.89   369.42    172.80   129.14  21.80  105.65  28.03  23.49   35.51  
1 1 1 5   18  7  o 19 127.51  16.77  493.71    119.79   524.05   161.37   456.48    178.80   128.70  22.67  117.77  27.02  10.93   35.27  
1 1 1 5   18  8  o 4  137.34  17.45  575.41    134.48   661.64   182.67   473.37    198.72   144.63  22.75  118.38  29.38  26.25   37.16  
1 1 1 5   18  9  o 6  141.56  17.98  614.72    142.82   670.35   193.19   547.67    212.08   144.42  24.15  126.90  29.65  17.52   38.24  
1 1 1 5   18  10 o 4  68.22   18.44  146.70    73.93    176.36   90.71    88.03     127.56   74.33   20.56  62.14   24.43  12.19   31.93  
1 1 1 5   18  11 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 5   18  12 o 18 73.09   19.17  171.28    81.44    178.56   99.76    156.75    140.98   74.16   21.91  72.00   26.26  2.16    34.20  
1 1 1 5   18  13 o 5  127.49  17.72  507.91    126.19   438.81   165.30   604.44    195.38   113.29  25.97  133.12  26.50  -19.84  37.10  
1 1 1 5   18  14 o 9  56.86   19.30  98.00     75.13    63.31    88.68    186.26    141.45   52.23   20.41  75.22   26.43  -22.99  33.40  
1 1 1 5   18  15 o 11 40.65   17.68  -0.57     77.05    -6.62    91.27    14.45     143.75   43.22   19.01  54.85   24.00  -11.64  30.62  
1 1 1 5   19  1  o 4  67.61   23.79  132.20    114.59   0.00     0.00     132.20    114.59   ?       ?      67.61   23.79  0.00    23.79  
1 1 1 5   19  2  o 3  131.25  17.28  525.66    127.06   566.10   169.96   474.42    191.32   133.42  23.02  119.03  28.40  14.39   36.56  
1 1 1 5   19  3  o 11 59.62   23.47  76.73     117.90   0.00     0.00     76.73     117.90   ?       ?      59.62   23.47  0.00    23.47  
1 1 1 5   19  4  o 15 61.16   23.67  88.38     118.27   0.00     0.00     88.38     118.27   ?       ?      61.16   23.67  0.00    23.67  
1 1 1 5   19  5  o 9  187.54  36.19  1263.83   375.55   0.00     0.00     1263.83   375.55   ?       ?      187.54  36.19  0.00    36.19  
1 1 1 5   19  6  o 10 60.76   18.57  114.16    70.75    132.80   83.50    66.73     133.18   65.25   20.21  60.20   24.51  5.05    31.77  
1 1 1 5   19  7  o 11 129.14  28.11  567.17    202.46   0.00     0.00     567.17    202.46   ?       ?      129.14  28.11  0.00    28.11  
1 1 1 5   19  8  o 4  67.80   25.66  126.70    137.02   0.00     0.00     126.70    137.02   ?       ?      67.80   25.66  0.00    25.66  
1 1 1 5   19  9  o 18 58.04   24.23  50.33     134.60   0.00     0.00     50.33     134.60   ?       ?      58.04   24.23  0.00    24.23  
1 1 1 6   -18 0  o 11 86.71   27.56  249.64    154.27   277.40   160.55   -84.34    556.86   90.82   28.01  90.55   42.46  0.28    50.87  
1 1 1 6   -18 1  f 0  70.19   26.16  137.79    141.23   125.50   146.39   302.86    536.64   69.07   26.43  104.92  46.13  -35.85  53.16  
1 1 1 6   -18 2  o 13 59.48   24.82  48.77     141.01   70.98    148.32   -160.04   454.87   62.92   25.77  81.65   38.32  -18.73  46.18  
1 1 1 6   -18 3  o 14 49.24   22.34  -54.07    136.72   -1.96    144.72   -486.51   416.93   55.14   24.10  68.25   33.22  -13.11  41.04  
1 1 1 6   -18 4  o 11 96.82   41.44  228.31    409.85   0.00     0.00     228.31    409.85   ?       ?      96.82   41.44  0.00    41.44  
1 1 1 6   -17 0  o 10 226.71  54.49  2137.78   700.29   0.00     0.00     2137.78   700.29   ?       ?      226.71  54.49  0.00    54.49  
1 1 1 6   -17 1  o 2  133.64  24.77  569.67    183.07   560.92   209.09   598.41    378.92   130.49  28.69  127.09  43.33  3.41    51.97  
1 1 1 6   -17 2  o 10 53.96   23.11  11.12     127.71   -25.49   138.28   223.59    333.11   52.46   23.22  94.89   38.72  -42.43  45.15  
1 1 1 6   -17 3  o 15 155.31  24.82  764.51    213.87   798.81   253.36   679.48    398.91   156.04  29.36  134.13  44.45  21.90   53.28  
1 1 1 6   -17 4  x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   -17 5  o 19 51.69   22.72  -16.05    130.05   -16.05   130.05   0.00      0.00     51.69   22.72  ?       ?      0.00    22.72  
1 1 1 6   -17 6  o 7  96.85   39.16  252.79    337.25   0.00     0.00     252.79    337.25   ?       ?      96.85   39.16  0.00    39.16  
1 1 1 6   -17 7  o 19 76.93   34.91  -60.39    334.52   0.00     0.00     -60.39    334.52   ?       ?      76.93   34.91  0.00    34.91  
1 1 1 6   -17 8  o 4  89.96   38.57  138.89    356.17   0.00     0.00     138.89    356.17   ?       ?      89.96   38.57  0.00    38.57  
1 1 1 6   -17 9  o 13 133.34  24.87  570.53    183.41   492.20   209.27   830.01    380.89   120.82  30.25  147.97  42.56  -27.16  52.22  
1 1 1 6   -16 0  o 12 86.05   26.44  232.10    143.23   232.10   143.23   0.00      0.00     86.05   26.44  ?       ?      0.00    26.44  
1 1 1 6   -16 1  o 11 51.95   22.28  4.43      119.05   4.43     119.05   0.00      0.00     51.95   22.28  ?       ?      0.00    22.28  
1 1 1 6   -16 2  o 16 70.37   24.09  142.61    117.08   146.14   128.92   126.00    279.70   71.94   25.24  84.99   35.16  -13.05  43.28  
1 1 1 6   -16 3  o 19 190.15  25.18  1124.43   268.10   1203.74  345.31   1004.05   425.40   192.25  32.44  167.19  43.80  25.06   54.51  
1 1 1 6   -16 4  o 11 143.73  22.98  639.86    183.21   516.70   215.91   956.59    346.25   125.75  30.27  168.02  36.91  -42.27  47.74  
1 1 1 6   -16 5  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   -16 6  o 19 91.11   23.04  261.74    120.55   282.50   131.68   154.21    299.67   94.40   24.19  88.84   36.54  5.56    43.82  
1 1 1 6   -16 7  o 6  137.52  22.28  585.62    169.89   658.90   196.64   369.84    337.42   145.01  24.49  108.70  40.45  36.31   47.29  
1 1 1 6   -16 8  o 18 165.40  30.20  888.26    276.16   888.26   276.16   0.00      0.00     165.40  30.20  ?       ?      0.00    30.20  
1 1 1 6   -16 9  o 7  249.20  30.13  1998.71   422.22   1943.39  567.00   2067.57   632.59   232.28  44.13  234.75  48.55  -2.47   65.61  
1 1 1 6   -16 10 o 7  83.52   35.06  114.29    284.13   0.00     0.00     114.29    284.13   ?       ?      83.52   35.06  0.00    35.06  
1 1 1 6   -16 11 o 16 113.08  39.04  441.93    307.86   0.00     0.00     441.93    307.86   ?       ?      113.08  39.04  0.00    39.04  
1 1 1 6   -16 12 o 14 68.02   23.79  132.85    114.52   107.49   125.03   264.93    285.36   65.29   24.56  95.39   36.80  -30.10  44.25  
1 1 1 6   -15 0  o 10 210.24  25.85  1353.32   305.42   1464.21  406.59   1209.72   462.70   214.07  34.24  188.37  43.64  25.69   55.47  
1 1 1 6   -15 1  o 5  210.93  25.64  1360.47   304.13   1414.25  402.13   1288.60   464.88   210.18  34.53  195.30  42.66  14.88   54.88  
1 1 1 6   -15 2  o 15 49.25   20.57  18.30     96.97    -17.32   105.12   221.72    251.18   46.95   20.53  92.46   34.80  -45.51  40.41  
1 1 1 6   -15 3  o 5  201.60  33.94  1300.79   378.84   1300.79  378.84   0.00      0.00     201.60  33.94  ?       ?      0.00    33.94  
1 1 1 6   -15 4  x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   -15 5  o 3  189.43  40.07  1203.61   422.08   0.00     0.00     1203.61   422.08   ?       ?      189.43  40.07  0.00    40.07  
1 1 1 6   -15 6  o 2  202.39  24.64  1254.68   280.44   1332.46  371.49   1151.64   427.59   203.97  32.84  183.81  41.51  20.16   52.93  
1 1 1 6   -15 7  o 16 65.68   22.25  122.40    99.89    106.90   109.61   198.45    242.72   64.14   23.19  88.84   34.03  -24.70  41.18  
1 1 1 6   -15 8  o 12 176.14  22.73  947.15    224.46   901.54   288.47   1017.16   357.36   167.61  31.13  174.88  36.77  -7.27   48.17  
1 1 1 6   -15 9  o 4  325.03  38.85  3508.74   710.62   3614.40  993.24   3397.93   1017.13  305.42  58.78  290.17  62.88  15.25   86.08  
1 1 1 6   -15 10 o 6  158.03  22.22  765.18    196.00   642.31   246.08   978.42    324.18   140.40  31.33  172.57  33.93  -32.17  46.18  
1 1 1 6   -15 11 o 8  180.47  23.36  1002.56   236.34   1084.93  306.57   881.91    371.05   184.03  30.06  159.01  40.53  25.02   50.46  
1 1 1 6   -15 12 o 6  91.98   34.66  235.90    249.31   0.00     0.00     235.90    249.31   ?       ?      91.98   34.66  0.00    34.66  
1 1 1 6   -15 13 o 9  175.46  39.90  1082.35   392.82   0.00     0.00     1082.35   392.82   ?       ?      175.46  39.90  0.00    39.90  
1 1 1 6   -15 14 o 11 76.18   24.24  178.99    119.27   148.20   135.56   284.44    250.88   72.38   25.84  96.10   35.03  -23.72  43.53  
1 1 1 6   -15 15 o 2  60.37   23.00  85.73     110.46   45.82    123.12   250.36    250.06   57.07   23.44  92.40   34.74  -35.33  41.91  
1 1 1 6   -14 0  o 13 151.70  36.79  739.71    317.02   0.00     0.00     739.71    317.02   ?       ?      151.70  36.79  0.00    36.79  
1 1 1 6   -14 1  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   -14 2  x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   -14 3  o 9  334.53  60.26  3976.17   1114.66  3976.17  1114.66  0.00      0.00     334.53  60.26  ?       ?      0.00    60.26  
1 1 1 6   -14 4  x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   -14 5  o 18 301.28  52.31  3099.70   871.92   3099.70  871.92   0.00      0.00     301.28  52.31  ?       ?      0.00    52.31  
1 1 1 6   -14 6  o 10 217.65  35.81  1501.97   431.85   1501.97  431.85   0.00      0.00     217.65  35.81  ?       ?      0.00    35.81  
1 1 1 6   -14 7  o 6  196.43  22.98  1161.32   254.20   1056.37  340.33   1293.76   382.30   182.54  33.72  202.23  34.15  -19.69  47.99  
1 1 1 6   -14 8  f 0  188.47  22.47  1070.10   238.34   1007.52  316.74   1151.81   361.89   178.62  32.07  190.03  34.44  -11.40  47.06  
1 1 1 6   -14 9  o 15 92.60   22.45  265.49    118.08   245.21   138.89   318.37    224.27   89.03   25.73  101.72  33.31  -12.70  42.09  
1 1 1 6   -14 10 o 13 98.49   21.31  299.23    116.98   302.27   138.01   291.49    220.47   98.31   24.53  98.02   33.06  0.29    41.17  
1 1 1 6   -14 11 o 11 86.82   32.07  201.83    211.33   0.00     0.00     201.83    211.33   ?       ?      86.82   32.07  0.00    32.07  
1 1 1 6   -14 12 o 15 57.14   21.67  73.33     97.78    55.89    114.19   121.26    189.31   57.41   22.94  75.71   29.76  -18.30  37.57  
1 1 1 6   -14 13 o 17 105.46  20.81  343.06    121.49   398.18   146.87   223.64    216.19   112.93  23.42  89.18   32.52  23.76   40.08  
1 1 1 6   -14 14 o 3  234.73  45.17  1948.08   586.54   0.00     0.00     1948.08   586.54   ?       ?      234.73  45.17  0.00    45.17  
1 1 1 6   -14 15 o 13 147.24  36.11  737.36    302.86   0.00     0.00     737.36    302.86   ?       ?      147.24  36.11  0.00    36.11  
1 1 1 6   -14 16 o 2  62.28   28.27  -82.73    219.52   0.00     0.00     -82.73    219.52   ?       ?      62.28   28.27  0.00    28.27  
1 1 1 6   -14 17 o 10 60.47   22.39  92.71     103.11   131.85   116.16   -52.66    223.86   68.16   23.96  64.66   29.02  3.50    37.63  
1 1 1 6   -13 0  o 2  445.81  49.36  6280.07   1242.07  6237.46  1750.93  6323.23   1762.22  420.63  75.28  423.63  75.22  -2.99   106.41 
1 1 1 6   -13 1  o 2  166.85  20.73  823.84    194.27   893.06   249.77   717.83    309.11   172.41  26.05  151.59  36.05  20.82   44.48  
1 1 1 6   -13 2  o 14 272.51  28.59  2221.16   440.63   1828.24  612.11   2643.74   634.79   239.36  46.22  292.97  38.69  -53.61  60.28  
1 1 1 6   -13 3  x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   -13 4  x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   -13 5  o 16 125.34  19.07  468.36    132.87   472.99   165.31   459.90    223.35   124.78  23.95  121.57  31.69  3.21    39.72  
1 1 1 6   -13 6  o 18 249.36  27.15  1868.94   382.37   1868.63  533.12   1869.26   548.73   243.53  39.48  242.87  40.80  0.66    56.78  
1 1 1 6   -13 7  o 10 251.09  41.02  2007.26   570.92   2007.26  570.92   0.00      0.00     251.09  41.02  ?       ?      0.00    41.02  
1 1 1 6   -13 8  o 9  253.59  41.79  2061.56   587.19   2061.56  587.19   0.00      0.00     253.59  41.79  ?       ?      0.00    41.79  
1 1 1 6   -13 9  o 10 284.71  48.14  2683.21   758.85   2683.21  758.85   0.00      0.00     284.71  48.14  ?       ?      0.00    48.14  
1 1 1 6   -13 10 o 1  370.28  42.23  4408.93   881.57   4718.96  1242.76  4094.91   1250.74  362.57  61.93  330.13  68.25  32.44   92.16  
1 1 1 6   -13 11 o 11 180.23  21.31  973.07    216.26   619.83   294.32   1387.57   318.83   138.30  36.53  213.41  26.60  -75.11  45.19  
1 1 1 6   -13 12 o 15 160.51  20.23  772.81    182.28   972.20   248.70   541.37    267.94   178.46  24.96  129.21  35.18  49.25   43.13  
1 1 1 6   -13 13 o 17 321.01  37.01  3316.33   669.57   3775.16  944.53   2852.81   949.33   326.70  52.11  272.14  62.14  54.56   81.10  
1 1 1 6   -13 14 o 15 91.58   19.85  257.91    101.36   230.16   129.64   301.55    162.59   86.14   24.85  97.80   27.70  -11.67  37.22  
1 1 1 6   -13 15 o 5  51.85   18.69  68.07     71.16    51.50    80.73    125.86    150.74   50.56   19.56  71.74   26.97  -21.18  33.31  
1 1 1 6   -13 16 o 14 132.81  18.32  532.07    135.93   381.48   171.91   783.25    222.02   109.18  27.46  158.61  25.23  -49.43  37.29  
1 1 1 6   -13 17 o 9  172.59  33.36  981.58    318.56   0.00     0.00     981.58    318.56   ?       ?      172.59  33.36  0.00    33.36  
1 1 1 6   -13 18 o 17 102.06  29.95  340.87    186.87   0.00     0.00     340.87    186.87   ?       ?      102.06  29.95  0.00    29.95  
1 1 1 6   -13 19 o 16 164.97  20.78  835.47    192.48   922.69   259.05   727.97    287.59   169.59  27.55  145.76  34.84  23.83   44.42  
1 1 1 6   -12 0  o 19 446.26  48.46  6232.02   1221.47  5761.36  1723.32  6707.20   1731.56  405.15  76.91  444.33  70.21  -39.18  104.14 
1 1 1 6   -12 1  o 11 549.17  62.65  9858.71   1939.73  9597.81  2741.23  10120.37  2745.16  499.74  99.05  517.63  95.91  -17.90  137.88 
1 1 1 6   -12 2  o 2  209.54  33.16  1332.91   385.64   1332.91  385.64   0.00      0.00     209.54  33.16  ?       ?      0.00    33.16  
1 1 1 6   -12 3  x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   -12 4  o 10 258.83  42.78  2074.78   613.41   0.00     0.00     2074.78   613.41   ?       ?      258.83  42.78  0.00    42.78  
1 1 1 6   -12 5  o 15 373.90  62.04  4563.11   1284.90  0.00     0.00     4563.11   1284.90  ?       ?      373.90  62.04  0.00    62.04  
1 1 1 6   -12 6  o 4  100.46  27.39  306.27    162.25   0.00     0.00     306.27    162.25   ?       ?      100.46  27.39  0.00    27.39  
1 1 1 6   -12 7  o 11 58.43   23.99  34.97     128.91   0.00     0.00     34.97     128.91   ?       ?      58.43   23.99  0.00    23.99  
1 1 1 6   -12 8  o 19 295.32  31.62  2626.39   527.82   2846.63  744.98   2404.40   747.92   301.12  44.43  273.60  49.44  27.52   66.47  
1 1 1 6   -12 9  o 3  425.56  47.64  5762.95   1143.94  6107.24  1616.99  5417.98   1618.58  416.21  70.17  385.64  75.82  30.57   103.30 
1 1 1 6   -12 10 o 10 192.14  31.36  1134.78   333.96   1134.78  333.96   0.00      0.00     192.14  31.36  ?       ?      0.00    31.36  
1 1 1 6   -12 11 o 18 237.39  38.61  1778.50   508.08   1778.50  508.08   0.00      0.00     237.39  38.61  ?       ?      0.00    38.61  
1 1 1 6   -12 12 o 11 113.55  17.72  385.13    111.71   414.46   147.69   345.92    170.78   116.57  22.89  105.58  27.80  10.99   36.01  
1 1 1 6   -12 13 o 16 259.56  28.33  2050.95   415.30   2281.51  583.11   1813.61   591.62   267.40  39.15  233.73  45.73  33.67   60.20  
1 1 1 6   -12 14 o 3  226.85  24.93  1557.42   319.29   1589.47  446.25   1523.81   457.03   223.28  36.04  217.36  38.01  5.92    52.38  
1 1 1 6   -12 15 o 14 114.58  19.59  398.01    124.24   8.87     153.29   1142.87   212.08   59.39   25.38  195.90  19.10  -136.52 31.76  
1 1 1 6   -12 16 o 5  180.72  20.77  983.13    211.59   1010.85  289.86   951.50    309.57   179.47  29.13  172.29  32.49  7.18    43.64  
1 1 1 6   -12 17 o 5  72.84   19.43  163.11    82.74    159.32   102.78   170.09    139.47   72.63   22.41  76.82   26.29  -4.18   34.55  
1 1 1 6   -12 18 o 1  132.15  29.08  561.51    214.60   0.00     0.00     561.51    214.60   ?       ?      132.15  29.08  0.00    29.08  
1 1 1 6   -12 19 o 4  96.21   28.45  296.83    168.08   0.00     0.00     296.83    168.08   ?       ?      96.21   28.45  0.00    28.45  
1 1 1 6   -12 20 o 17 225.76  42.90  1825.63   535.63   0.00     0.00     1825.63   535.63   ?       ?      225.76  42.90  0.00    42.90  
1 1 1 6   -11 0  o 8  101.07  24.78  310.99    142.66   0.00     0.00     310.99    142.66   ?       ?      101.07  24.78  0.00    24.78  
1 1 1 6   -11 1  o 19 257.82  27.17  1975.82   396.09   2085.19  558.92   1865.49   561.40   260.65  38.51  245.09  41.37  15.56   56.52  
1 1 1 6   -11 2  x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   -11 3  o 16 437.09  47.79  5962.27   1179.54  6254.46  1667.55  5669.68   1668.70  429.36  70.07  404.36  74.64  25.00   102.37 
1 1 1 6   -11 4  o 6  172.35  19.13  873.32    186.14   911.35   258.58   832.43    268.16   174.25  26.70  165.68  29.26  8.58    39.61  
1 1 1 6   -11 5  o 10 293.87  31.11  2582.07   516.93   2810.92  729.48   2351.25   732.63   301.36  43.42  272.73  48.57  28.63   65.15  
1 1 1 6   -11 6  o 5  393.73  42.19  4735.53   938.75   4977.04  1326.96  4493.55   1328.23  391.66  61.01  368.96  65.09  22.69   89.21  
1 1 1 6   -11 7  o 8  274.73  43.55  2331.38   664.02   0.00     0.00     2331.38   664.02   ?       ?      274.73  43.55  0.00    43.55  
1 1 1 6   -11 8  o 3  226.22  36.54  1558.68   458.41   0.00     0.00     1558.68   458.41   ?       ?      226.22  36.54  0.00    36.54  
1 1 1 6   -11 9  o 17 195.77  32.45  1161.17   351.89   0.00     0.00     1161.17   351.89   ?       ?      195.77  32.45  0.00    32.45  
1 1 1 6   -11 10 o 2  301.93  31.92  2729.99   544.83   2793.05  767.75   2666.01   773.28   298.96  46.22  291.09  47.94  7.87    66.60  
1 1 1 6   -11 11 f 0  154.70  18.02  704.45    157.08   772.06   214.91   626.90    230.16   160.60  24.05  143.12  29.01  17.48   37.68  
1 1 1 6   -11 12 f 0  231.42  36.85  1662.41   473.18   1662.41  473.18   0.00      0.00     231.42  36.85  ?       ?      0.00    36.85  
1 1 1 6   -11 13 f 0  242.38  39.00  1849.85   524.27   1849.85  524.27   0.00      0.00     242.38  39.00  ?       ?      0.00    39.00  
1 1 1 6   -11 14 o 3  399.66  45.02  5134.10   1014.85  4800.79  1433.12  5469.36   1437.32  358.45  72.14  389.78  66.63  -31.33  98.20  
1 1 1 6   -11 15 o 9  91.61   25.27  258.17    137.20   0.00     0.00     258.17    137.20   ?       ?      91.61   25.27  0.00    25.27  
1 1 1 6   -11 16 o 10 68.16   24.56  119.88    122.78   0.00     0.00     119.88    122.78   ?       ?      68.16   24.56  0.00    24.56  
1 1 1 6   -11 17 o 4  217.23  23.91  1430.41   293.26   1573.71  411.07   1281.89   418.48   222.86  33.14  197.74  38.25  25.12   50.61  
1 1 1 6   -11 18 o 5  159.04  18.69  757.32    167.38   848.58   232.24   658.67    241.45   165.87  25.18  143.61  30.24  22.26   39.35  
1 1 1 6   -11 19 o 5  105.83  17.27  338.36    101.31   314.25   132.46   372.35    157.26   100.17  23.45  108.53  25.65  -8.36   34.76  
1 1 1 6   -11 20 o 15 142.11  18.19  608.53    144.98   599.38   195.75   619.66    215.77   137.97  25.66  139.27  27.96  -1.30   37.95  
1 1 1 6   -11 21 o 6  84.88   26.14  226.56    139.84   0.00     0.00     226.56    139.84   ?       ?      84.88   26.14  0.00    26.14  
1 1 1 6   -11 22 o 10 171.14  32.39  976.83    306.57   0.00     0.00     976.83    306.57   ?       ?      171.14  32.39  0.00    32.39  
1 1 1 6   -10 0  o 6  528.14  93.90  9839.71   2742.67  9839.71  2742.67  0.00      0.00     528.14  93.90  ?       ?      0.00    93.90  
1 1 1 6   -10 1  o 4  339.59  53.46  3605.97   1007.80  3605.97  1007.80  0.00      0.00     339.59  53.46  ?       ?      0.00    53.46  
1 1 1 6   -10 2  x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   -10 3  o 11 46.07   16.06  54.62     52.13    31.78    69.25    84.49     79.20    45.25   17.93  56.98   19.80  -11.73  26.71  
1 1 1 6   -10 4  o 14 271.60  28.26  2185.20   434.25   2221.14  613.69   2149.16   614.54   269.45  40.96  264.62  41.84  4.83    58.56  
1 1 1 6   -10 5  o 6  165.47  17.86  802.09    167.00   778.69   233.49   826.59    238.97   161.20  26.12  166.25  25.88  -5.05   36.77  
1 1 1 6   -10 6  o 2  172.26  18.46  870.01    179.74   874.05   252.28   865.84    256.13   170.79  26.60  169.81  27.19  0.98    38.04  
1 1 1 6   -10 7  o 4  393.43  42.05  4733.94   934.96   4930.02  1321.76  4537.58   1322.70  389.04  61.20  370.60  64.52  18.44   88.93  
1 1 1 6   -10 8  o 17 308.37  32.42  2847.14   565.40   2846.24  798.49   2848.04   800.69   301.40  47.74  301.43  47.87  -0.03   67.61  
1 1 1 6   -10 9  o 1  309.57  32.50  2864.71   568.97   2869.03  803.88   2860.37   805.40   303.15  47.77  302.59  47.96  0.56    67.70  
1 1 1 6   -10 10 o 16 444.17  75.76  6664.90   1862.47  0.00     0.00     6664.90   1862.47  ?       ?      444.17  75.76  0.00    75.76  
1 1 1 6   -10 11 o 16 465.85  80.89  7465.13   2084.70  0.00     0.00     7465.13   2084.70  ?       ?      465.85  80.89  0.00    80.89  
1 1 1 6   -10 12 o 13 296.08  47.13  2736.12   774.23   0.00     0.00     2736.12   774.23   ?       ?      296.08  47.13  0.00    47.13  
1 1 1 6   -10 13 o 17 370.60  39.72  4204.73   831.82   4355.55  1175.61  4053.52   1177.13  365.14  58.02  350.03  60.79  15.11   84.03  
1 1 1 6   -10 14 o 2  15.92   6.57   1.98      9.74     1.98     9.74     0.00      0.00     15.92   6.57   ?       ?      0.00    6.57   
1 1 1 6   -10 15 o 14 249.29  40.14  1964.12   554.90   1964.12  554.90   0.00      0.00     249.29  40.14  ?       ?      0.00    40.14  
1 1 1 6   -10 16 o 5  110.98  15.92  365.42    98.55    311.68   130.44   436.87    150.41   100.82  23.04  119.84  22.69  -19.03  32.34  
1 1 1 6   -10 17 o 8  276.14  46.91  2533.57   717.02   0.00     0.00     2533.57   717.02   ?       ?      276.14  46.91  0.00    46.91  
1 1 1 6   -10 18 o 1  271.67  29.69  2276.14   455.53   2313.73  642.27   2238.09   646.18   263.74  43.97  258.32  45.22  5.42    63.07  
1 1 1 6   -10 19 o 15 124.17  16.49  459.89    114.64   509.03   154.68   400.01    170.76   129.12  21.63  112.62  26.80  16.50   34.44  
1 1 1 6   -10 20 o 1  138.76  17.30  575.83    134.82   593.57   184.01   555.26    198.10   138.48  24.02  132.68  26.93  5.80    36.08  
1 1 1 6   -10 21 o 3  253.35  28.28  2011.38   404.29   2104.13  569.58   1917.20   573.96   248.06  41.46  233.91  44.37  14.15   60.72  
1 1 1 6   -10 22 o 15 167.59  19.62  851.86    185.20   966.72   258.29   730.32    265.68   175.03  26.54  148.67  32.07  26.36   41.63  
1 1 1 6   -10 23 o 11 148.80  29.00  723.26    238.84   0.00     0.00     723.26    238.84   ?       ?      148.80  29.00  0.00    29.00  
1 1 1 6   -9  0  f 0  278.69  28.78  2293.57   453.78   2340.63  641.59   2246.46   641.89   277.52  41.55  271.40  42.60  6.12    59.51  
1 1 1 6   -9  1  x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   -9  2  o 7  305.97  47.19  2870.15   802.30   2870.15  802.30   0.00      0.00     305.97  47.19  ?       ?      0.00    47.19  
1 1 1 6   -9  3  o 19 221.97  33.73  1478.34   416.33   1478.34  416.33   0.00      0.00     221.97  33.73  ?       ?      0.00    33.73  
1 1 1 6   -9  4  o 6  246.48  37.50  1831.86   513.95   1831.86  513.95   0.00      0.00     246.48  37.50  ?       ?      0.00    37.50  
1 1 1 6   -9  5  o 14 558.98  60.89  9755.71   1922.26  9825.74  2718.38  9685.67   2718.59  535.51  91.72  530.83  92.58  4.68    130.32 
1 1 1 6   -9  6  o 7  444.07  47.06  5991.75   1181.46  6076.36  1670.59  5907.08   1671.08  433.96  69.40  426.93  70.65  7.02    99.03  
1 1 1 6   -9  7  o 10 38.81   14.86  29.26     46.31    11.66    61.85    51.72     69.86    39.89   16.52  49.02   18.37  -9.13   24.71  
1 1 1 6   -9  8  o 4  611.96  69.94  12242.33  2412.86  12202.13 3412.15  12282.52  3412.45  565.65  109.03 568.14  108.59 -2.49   153.88 
1 1 1 6   -9  9  f 0  155.26  16.72  705.45    146.72   813.11   206.50   595.69    208.51   165.70  22.27  140.37  26.85  25.33   34.89  
1 1 1 6   -9  10 o 19 137.23  15.60  551.46    120.70   621.24   167.06   475.25    174.59   144.77  20.69  125.33  25.14  19.43   32.56  
1 1 1 6   -9  11 o 6  105.67  14.48  328.41    85.55    343.97   115.35   309.39    127.53   107.26  19.45  101.12  22.54  6.14    29.77  
1 1 1 6   -9  12 o 5  446.58  76.16  6743.31   1882.56  0.00     0.00     6743.31   1882.56  ?       ?      446.58  76.16  0.00    76.16  
1 1 1 6   -9  13 o 5  96.12   25.10  279.67    139.96   0.00     0.00     279.67    139.96   ?       ?      96.12   25.10  0.00    25.10  
1 1 1 6   -9  14 o 15 271.56  42.72  2277.37   644.01   0.00     0.00     2277.37   644.01   ?       ?      271.56  42.72  0.00    42.72  
1 1 1 6   -9  15 o 7  167.11  18.39  821.04    173.52   850.27   241.74   789.96    249.23   168.23  25.86  161.46  27.90  6.77    38.04  
1 1 1 6   -9  16 o 16 177.06  28.48  953.66    279.62   953.66   279.62   0.00      0.00     177.06  28.48  ?       ?      0.00    28.48  
1 1 1 6   -9  17 o 11 52.57   19.59  62.51     79.13    62.51    79.13    0.00      0.00     52.57   19.59  ?       ?      0.00    19.59  
1 1 1 6   -9  18 o 6  80.82   17.14  197.73    77.06    183.68   101.66   216.70    118.14   77.79   21.86  84.26   23.53  -6.47   32.12  
1 1 1 6   -9  19 o 15 277.75  30.16  2375.67   473.15   2471.89  667.89   2278.74   670.39   273.56  44.02  260.53  46.53  13.03   64.06  
1 1 1 6   -9  20 o 18 156.56  18.22  731.35    160.70   748.25   223.32   713.20    231.43   155.52  25.93  151.01  27.72  4.51    37.95  
1 1 1 6   -9  21 o 10 195.21  21.37  1150.94   235.58   1311.74  330.65   985.16    335.72   204.56  28.97  173.56  34.91  31.00   45.36  
1 1 1 6   -9  22 o 13 238.07  26.10  1755.69   350.84   1964.51  494.51   1544.03   497.84   244.05  36.41  210.97  42.58  33.07   56.02  
1 1 1 6   -9  23 o 1  143.65  17.66  621.59    142.59   711.05   200.36   529.79    202.97   151.03  23.90  127.95  28.38  23.08   37.10  
1 1 1 6   -9  24 o 1  51.00   21.88  6.39      114.74   0.00     0.00     6.39      114.74   ?       ?      51.00   21.88  0.00    21.88  
1 1 1 6   -9  25 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   -8  0  x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   -8  1  o 13 568.88  110.60 12497.63  3481.78  0.00     0.00     12497.63  3481.78  ?       ?      568.88  110.60 0.00    110.60 
1 1 1 6   -8  2  o 11 189.84  19.70  1055.75   211.62   1052.53  298.49   1058.99   300.07   187.51  28.64  188.08  28.70  -0.57   40.54  
1 1 1 6   -8  3  o 10 458.20  49.00  6435.14   1268.96  6334.83  1794.37  6535.50   1794.79  437.84  74.03  445.91  72.61  -8.07   103.69 
1 1 1 6   -8  4  o 17 419.33  68.02  5670.51   1581.36  5670.51  1581.36  0.00      0.00     419.33  68.02  ?       ?      0.00    68.02  
1 1 1 6   -8  5  o 1  353.77  55.41  3899.89   1088.46  3899.89  1088.46  0.00      0.00     353.77  55.41  ?       ?      0.00    55.41  
1 1 1 6   -8  6  f 0  137.22  14.99  549.33    116.17   456.45   162.43   646.60    166.21   123.37  23.80  148.17  20.05  -24.80  31.12  
1 1 1 6   -8  7  o 8  482.43  51.38  7098.98   1401.18  6714.82  1981.34  7483.31   1981.80  451.70  79.30  481.03  74.15  -29.33  108.56 
1 1 1 6   -8  8  o 19 252.46  26.05  1873.46   372.16   1879.49  525.67   1867.40   526.97   249.72  37.85  248.82  38.10  0.90    53.71  
1 1 1 6   -8  9  o 7  403.41  42.46  4901.77   968.56   4798.98  1369.12  5004.75   1370.37  388.32  63.62  397.61  62.06  -9.29   88.88  
1 1 1 6   -8  10 o 17 411.82  43.61  5148.77   1015.45  5304.33  1435.91  4993.14   1436.22  406.28  63.66  392.38  66.11  13.90   91.77  
1 1 1 6   -8  11 f 0  574.94  65.03  10708.54  2108.66  11056.61 2981.96  10360.41  2982.22  547.18  98.55  524.19  102.78 23.00   142.40 
1 1 1 6   -8  12 o 11 60.76   15.13  110.91    52.57    112.21   66.24    108.68    86.38    61.56   17.76  62.59   20.68  -1.02   27.26  
1 1 1 6   -8  13 o 18 231.17  36.11  1626.39   463.54   0.00     0.00     1626.39   463.54   ?       ?      231.17  36.11  0.00    36.11  
1 1 1 6   -8  14 o 15 253.00  39.61  1956.13   556.42   0.00     0.00     1956.13   556.42   ?       ?      253.00  39.61  0.00    39.61  
1 1 1 6   -8  15 o 3  287.81  30.25  2463.55   492.30   2384.61  693.96   2543.53   698.51   277.42  45.12  287.31  43.73  -9.89   62.84  
1 1 1 6   -8  16 o 7  221.16  23.40  1444.43   292.57   1505.07  410.95   1382.10   416.63   222.81  33.14  212.56  35.39  10.25   48.48  
1 1 1 6   -8  17 f 0  75.75   20.14  173.38    89.08    173.38   89.08    0.00      0.00     75.75   20.14  ?       ?      0.00    20.14  
1 1 1 6   -8  18 o 18 255.69  41.36  2077.24   586.43   2077.24  586.43   0.00      0.00     255.69  41.36  ?       ?      0.00    41.36  
1 1 1 6   -8  19 f 0  278.97  46.51  2553.11   718.65   2553.11  718.65   0.00      0.00     278.97  46.51  ?       ?      0.00    46.51  
1 1 1 6   -8  20 o 17 245.61  26.38  1830.11   366.18   1933.82  516.48   1725.28   519.23   245.99  37.78  230.24  40.78  15.75   55.59  
1 1 1 6   -8  21 o 3  174.17  19.59  907.59    192.44   932.58   271.03   882.19    273.28   172.99  28.27  167.59  29.48  5.39    40.84  
1 1 1 6   -8  22 o 13 121.27  16.24  439.38    110.24   481.61   153.93   394.92    157.94   125.09  22.25  112.09  25.16  13.00   33.59  
1 1 1 6   -8  23 o 15 103.95  16.43  325.87    94.79    351.52   128.21   294.97    140.76   106.38  21.73  96.49   25.16  9.88    33.24  
1 1 1 6   -8  24 o 3  202.95  22.64  1265.68   259.27   1358.69  364.94   1170.89   368.41   203.90  32.25  186.51  35.71  17.38   48.12  
1 1 1 6   -8  25 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   -8  26 o 8  172.85  32.11  1008.52   306.87   0.00     0.00     1008.52   306.87   ?       ?      172.85  32.11  0.00    32.11  
1 1 1 6   -7  0  x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   -7  1  o 9  173.77  18.00  885.98    176.96   903.49   250.14   868.44    250.37   173.55  25.90  169.91  26.54  3.64    37.08  
1 1 1 6   -7  2  o 14 318.92  51.15  3242.19   904.84   0.00     0.00     3242.19   904.84   ?       ?      318.92  51.15  0.00    51.15  
1 1 1 6   -7  3  o 3  477.96  87.57  8303.85   2314.12  0.00     0.00     8303.85   2314.12  ?       ?      477.96  87.57  0.00    87.57  
1 1 1 6   -7  4  o 3  227.75  23.55  1529.39   303.51   1625.20  429.21   1433.56   429.26   231.98  33.17  216.76  35.74  15.22   48.76  
1 1 1 6   -7  5  o 7  182.50  18.92  975.62    195.38   965.83   275.61   985.51    277.00   179.59  27.62  181.49  27.44  -1.90   38.93  
1 1 1 6   -7  6  o 16 67.93   14.68  138.27    55.57    138.27   55.57    0.00      0.00     67.93   14.68  ?       ?      0.00    14.68  
1 1 1 6   -7  7  o 19 259.76  39.64  2045.01   572.47   2045.01  572.47   0.00      0.00     259.76  39.64  ?       ?      0.00    39.64  
1 1 1 6   -7  8  o 10 496.68  53.09  7561.58   1490.40  7543.23  2107.70  7579.93   2107.79  478.32  79.55  479.68  79.31  -1.36   112.34 
1 1 1 6   -7  9  o 7  215.18  22.23  1355.78   270.67   1386.96  382.23   1324.43   383.34   215.50  31.85  210.24  32.83  5.26    45.75  
1 1 1 6   -7  10 o 13 524.86  56.32  8483.75   1670.45  9162.97  2362.48  7804.65   2362.26  528.20  80.45  480.27  88.96  47.93   119.94 
1 1 1 6   -7  11 o 13 293.16  30.31  2541.06   502.83   2681.29  710.70   2400.50   711.53   297.08  42.91  279.72  45.90  17.37   62.84  
1 1 1 6   -7  12 o 8  300.03  31.18  2674.06   529.17   2655.23  747.61   2692.96   749.13   293.42  45.88  295.66  45.60  -2.24   64.69  
1 1 1 6   -7  13 o 7  138.60  17.01  564.19    132.54   -206.37  181.73   1439.69   193.71   50.40   23.82  222.69  15.24  -172.30 28.28  
1 1 1 6   -7  14 o 7  196.05  20.64  1129.52   228.76   1135.05  322.26   1123.90   324.79   194.14  29.87  193.03  30.31  1.10    42.55  
1 1 1 6   -7  15 o 5  182.70  28.82  1002.94   292.26   0.00     0.00     1002.94   292.26   ?       ?      182.70  28.82  0.00    28.82  
1 1 1 6   -7  16 o 13 314.53  49.76  3093.70   868.67   0.00     0.00     3093.70   868.67   ?       ?      314.53  49.76  0.00    49.76  
1 1 1 6   -7  17 f 0  61.01   17.60  110.20    65.02    105.39   86.05    116.59    99.27    61.90   20.65  65.53   22.18  -3.62   30.31  
1 1 1 6   -7  18 o 14 326.11  34.54  3227.76   636.74   3462.95  900.46   2992.53   900.51   329.30  49.13  302.79  53.78  26.51   72.84  
1 1 1 6   -7  19 o 4  191.27  30.51  1121.97   323.72   1121.97  323.72   0.00      0.00     191.27  30.51  ?       ?      0.00    30.51  
1 1 1 6   -7  20 o 9  102.79  21.02  321.67    119.88   321.67   119.88   0.00      0.00     102.79  21.02  ?       ?      0.00    21.02  
1 1 1 6   -7  21 o 17 147.64  17.00  645.76    141.43   718.42   200.57   573.91    199.44   153.81  23.46  136.15  26.47  17.66   35.37  
1 1 1 6   -7  22 o 10 261.75  45.51  2331.22   658.97   0.00     0.00     2331.22   658.97   ?       ?      261.75  45.51  0.00    45.51  
1 1 1 6   -7  23 o 4  139.35  17.03  580.32    133.42   598.43   188.50   562.14    188.86   138.76  24.56  134.03  25.48  4.74    35.39  
1 1 1 6   -7  24 o 1  98.33   22.67  303.35    125.36   303.35   125.36   0.00      0.00     98.33   22.67  ?       ?      0.00    22.67  
1 1 1 6   -7  25 o 6  206.37  36.47  1443.27   416.27   0.00     0.00     1443.27   416.27   ?       ?      206.37  36.47  0.00    36.47  
1 1 1 6   -7  26 o 13 225.35  25.63  1608.68   325.62   1688.72  461.50   1529.33   459.50   219.52  38.00  206.48  40.21  13.05   55.32  
1 1 1 6   -7  27 o 7  124.15  17.63  471.79    122.09   497.13   169.24   444.29    176.31   124.11  24.62  115.96  26.99  8.15    36.54  
1 1 1 6   -6  0  o 16 123.28  19.19  453.20    131.38   0.00     0.00     453.20    131.38   ?       ?      123.28  19.19  0.00    19.19  
1 1 1 6   -6  1  o 9  239.28  37.35  1774.71   496.27   0.00     0.00     1774.71   496.27   ?       ?      239.28  37.35  0.00    37.35  
1 1 1 6   -6  2  o 12 189.25  19.58  1054.93   209.69   1071.40  296.46   1038.45   296.63   188.22  28.31  185.07  28.86  3.15    40.43  
1 1 1 6   -6  3  f 0  285.96  45.54  2587.65   722.57   0.00     0.00     2587.65   722.57   ?       ?      285.96  45.54  0.00    45.54  
1 1 1 6   -6  4  o 1  344.81  56.89  3896.59   1086.96  0.00     0.00     3896.59   1086.96  ?       ?      344.81  56.89  0.00    56.89  
1 1 1 6   -6  5  o 6  459.09  50.66  6663.77   1313.03  6840.99  1856.92  6486.56   1856.88  441.72  75.97  427.23  78.61  14.49   109.32 
1 1 1 6   -6  6  o 7  220.17  22.76  1429.45   283.55   1507.92  400.78   1350.81   401.22   223.37  32.18  210.45  34.40  12.92   47.11  
1 1 1 6   -6  7  o 11 371.55  60.51  4467.64   1246.26  4467.64  1246.26  0.00      0.00     371.55  60.51  ?       ?      0.00    60.51  
1 1 1 6   -6  8  o 13 207.57  31.55  1294.92   364.15   1294.92  364.15   0.00      0.00     207.57  31.55  ?       ?      0.00    31.55  
1 1 1 6   -6  9  o 8  304.63  47.06  2850.97   796.52   2850.97  796.52   0.00      0.00     304.63  47.06  ?       ?      0.00    47.06  
1 1 1 6   -6  10 f 0  543.69  58.84  9168.67   1807.25  9067.45  2555.73  9269.92   2555.94  517.20  89.31  524.11  88.07  -6.91   125.43 
1 1 1 6   -6  11 o 9  110.56  12.67  356.51    78.93    332.16   109.22   383.13    114.20   105.68  18.69  113.79  18.09  -8.12   26.01  
1 1 1 6   -6  12 o 16 174.79  19.52  894.45    192.48   -0.90    267.53   1855.29   277.14   78.38   33.51  252.57  19.26  -174.18 38.65  
1 1 1 6   -6  13 o 14 225.54  34.51  1532.03   432.60   0.00     0.00     1532.03   432.60   ?       ?      225.54  34.51  0.00    34.51  
1 1 1 6   -6  14 o 4  64.51   13.14  124.37    46.99    137.37   61.57    106.23    72.73    67.60   16.10  60.71   18.88  6.89    24.81  
1 1 1 6   -6  15 f 0  108.43  13.51  344.54    82.25    347.91   114.79   340.98    117.92   107.91  19.24  106.66  19.99  1.25    27.74  
1 1 1 6   -6  16 o 7  229.63  24.00  1555.59   311.66   1597.34  440.48   1513.74   441.02   229.55  34.49  222.95  35.66  6.60    49.61  
1 1 1 6   -6  17 o 8  156.20  25.91  731.56    224.23   0.00     0.00     731.56    224.23   ?       ?      156.20  25.91  0.00    25.91  
1 1 1 6   -6  18 o 5  313.62  49.99  3097.66   869.86   0.00     0.00     3097.66   869.86   ?       ?      313.62  49.99  0.00    49.99  
1 1 1 6   -6  19 o 12 291.63  30.76  2557.38   507.20   2651.46  717.27   2463.30   717.30   290.20  44.47  278.41  46.52  11.79   64.36  
1 1 1 6   -6  20 o 11 174.68  18.99  901.64    187.34   926.33   264.76   876.89    265.12   174.52  27.32  169.39  28.26  5.14    39.31  
1 1 1 6   -6  21 o 17 123.92  22.83  467.44    156.44   467.44   156.44   0.00      0.00     123.92  22.83  ?       ?      0.00    22.83  
1 1 1 6   -6  22 o 5  212.60  34.85  1434.43   410.57   1434.43  410.57   0.00      0.00     212.60  34.85  ?       ?      0.00    34.85  
1 1 1 6   -6  23 o 16 258.67  28.33  2070.26   413.86   2098.91  585.20   2041.59   585.36   250.14  42.26  246.01  43.01  4.12    60.30  
1 1 1 6   -6  24 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   -6  25 o 19 76.59   17.05  180.29    73.05    204.61   104.52   157.06    102.14   80.88   21.95  71.84   22.37  9.04    31.35  
1 1 1 6   -6  26 o 6  120.83  24.42  464.56    163.58   0.00     0.00     464.56    163.58   ?       ?      120.83  24.42  0.00    24.42  
1 1 1 6   -6  27 o 12 164.38  19.48  829.97    180.30   860.67   256.18   799.85    253.79   161.69  28.65  155.10  29.58  6.59    41.18  
1 1 1 6   -5  0  o 5  249.06  25.93  1851.55   365.37   1784.92  516.53   1918.26   516.88   238.95  39.00  248.68  37.36  -9.73   54.01  
1 1 1 6   -5  1  o 10 241.16  25.07  1732.25   341.96   1605.17  483.33   1859.62   483.88   226.64  38.53  245.81  35.30  -19.17  52.25  
1 1 1 6   -5  2  o 13 261.04  27.27  2038.54   402.69   2081.94  569.33   1995.10   569.65   258.29  39.66  252.22  40.73  6.08    56.85  
1 1 1 6   -5  3  o 5  87.07   9.95   221.34    48.85    215.15   67.84    228.00    70.41    85.06   14.41  87.60   14.51  -2.54   20.45  
1 1 1 6   -5  4  o 18 125.85  13.28  462.97    94.51    488.28   133.30   437.38    134.03   128.20  18.66  120.90  20.01  7.31    27.36  
1 1 1 6   -5  5  f 0  227.60  35.32  1594.41   446.53   0.00     0.00     1594.41   446.53   ?       ?      227.60  35.32  0.00    35.32  
1 1 1 6   -5  6  o 3  350.72  58.38  4065.54   1134.07  0.00     0.00     4065.54   1134.07  ?       ?      350.72  58.38  0.00    58.38  
1 1 1 6   -5  7  o 9  544.64  63.08  9826.49   1935.76  10005.48 2737.60  9647.50   2737.55  506.32  97.73  493.74  100.02 12.58   139.83 
1 1 1 6   -5  8  o 12 271.68  28.27  2196.39   434.39   2226.18  614.18   2166.57   614.47   268.45  41.16  264.46  41.87  4.00    58.71  
1 1 1 6   -5  9  o 8  385.51  63.25  4845.37   1351.37  4845.37  1351.37  0.00      0.00     385.51  63.25  ?       ?      0.00    63.25  
1 1 1 6   -5  10 o 10 440.57  73.31  6417.82   1789.09  6417.82  1789.09  0.00      0.00     440.57  73.31  ?       ?      0.00    73.31  
1 1 1 6   -5  11 o 15 463.42  76.67  7060.88   1968.46  0.00     0.00     7060.88   1968.46  ?       ?      463.42  76.67  0.00    76.67  
1 1 1 6   -5  12 o 12 232.31  35.27  1620.50   455.63   0.00     0.00     1620.50   455.63   ?       ?      232.31  35.27  0.00    35.27  
1 1 1 6   -5  13 o 16 463.24  49.07  6519.57   1285.20  6579.39  1817.47  6459.73   1817.61  451.42  72.59  446.67  73.43  4.75    103.26 
1 1 1 6   -5  14 o 16 268.60  41.16  2193.19   614.54   2193.19  614.54   0.00      0.00     268.60  41.16  ?       ?      0.00    41.16  
1 1 1 6   -5  15 o 14 276.51  28.74  2266.85   449.54   2247.23  635.57   2286.50   635.91   270.46  42.32  273.03  41.91  -2.56   59.56  
1 1 1 6   -5  16 o 17 141.35  22.96  597.21    179.95   0.00     0.00     597.21    179.95   ?       ?      141.35  22.96  0.00    22.96  
1 1 1 6   -5  17 o 2  243.99  25.45  1760.94   351.26   1854.65  496.92   1667.36   496.60   246.93  36.12  233.04  38.46  13.89   52.77  
1 1 1 6   -5  18 o 10 413.17  69.28  5675.24   1585.18  0.00     0.00     5675.24   1585.18  ?       ?      413.17  69.28  0.00    69.28  
1 1 1 6   -5  19 o 6  258.49  40.55  2058.49   581.95   0.00     0.00     2058.49   581.95   ?       ?      258.49  40.55  0.00    40.55  
1 1 1 6   -5  20 o 4  57.69   17.11  98.02     60.75    44.05    85.41    153.27    86.41    50.81   19.98  71.50   20.18  -20.69  28.40  
1 1 1 6   -5  21 o 1  45.61   16.63  49.59     56.52    20.33    78.39    81.26     81.55    45.46   18.69  56.42   20.05  -10.96  27.41  
1 1 1 6   -5  22 o 16 122.56  22.22  456.88    150.58   456.88   150.58   0.00      0.00     122.56  22.22  ?       ?      0.00    22.22  
1 1 1 6   -5  23 o 19 279.60  48.77  2680.32   754.28   2680.32  754.28   0.00      0.00     279.60  48.77  ?       ?      0.00    48.77  
1 1 1 6   -5  24 o 4  189.58  31.90  1149.04   334.81   0.00     0.00     1149.04   334.81   ?       ?      189.58  31.90  0.00    31.90  
1 1 1 6   -5  25 o 17 241.13  42.95  2022.50   572.79   0.00     0.00     2022.50   572.79   ?       ?      241.13  42.95  0.00    42.95  
1 1 1 6   -5  26 o 1  170.92  19.55  887.11    188.34   876.18   267.44   897.86    265.28   164.49  29.40  166.98  28.71  -2.49   41.09  
1 1 1 6   -5  27 o 11 89.30   16.96  245.22    83.79    312.22   120.81   183.12    116.32   99.31   21.79  76.52   23.88  22.78   32.33  
1 1 1 6   -5  28 o 2  154.76  18.94  737.22    164.74   704.18   235.00   769.16    231.01   144.82  29.27  152.91  27.32  -8.09   40.04  
1 1 1 6   -4  0  o 16 543.63  64.24  10008.63  1966.20  9366.20  2780.50  10651.17  2780.76  468.48  105.89 513.97  97.82  -45.49  144.15 
1 1 1 6   -4  1  o 7  274.10  28.69  2252.16   444.83   2307.31  628.98   2196.97   629.18   271.39  41.70  264.04  42.99  7.35    59.89  
1 1 1 6   -4  2  o 17 211.02  21.87  1316.80   261.11   1376.85  369.18   1256.71   369.35   212.76  31.15  202.45  32.91  10.32   45.31  
1 1 1 6   -4  3  o 18 161.77  16.71  767.78    152.94   718.65   216.21   816.98    216.38   154.31  25.28  165.26  23.47  -10.96  34.49  
1 1 1 6   -4  4  o 18 387.56  42.08  4680.37   921.31   4473.93  1302.85  4886.85   1303.01  360.07  65.44  379.92  61.87  -19.85  90.06  
1 1 1 6   -4  5  f 0  300.74  31.72  2732.96   539.37   2732.13  762.70   2733.80   762.87   292.39  47.03  292.49  47.03  -0.09   66.51  
1 1 1 6   -4  6  o 11 237.04  36.94  1738.44   486.34   0.00     0.00     1738.44   486.34   ?       ?      237.04  36.94  0.00    36.94  
1 1 1 6   -4  7  o 15 340.13  56.54  3818.90   1065.17  0.00     0.00     3818.90   1065.17  ?       ?      340.13  56.54  0.00    56.54  
1 1 1 6   -4  8  o 11 274.77  28.71  2257.98   446.11   2231.63  630.85   2284.34   630.94   266.98  42.59  270.47  42.00  -3.49   59.81  
1 1 1 6   -4  9  o 18 484.29  54.04  7493.62   1476.92  7648.07  2088.62  7339.14   2088.75  461.34  81.86  449.30  84.07  12.04   117.34 
1 1 1 6   -4  10 o 4  254.89  39.37  1994.04   557.50   1994.04  557.50   0.00      0.00     254.89  39.37  ?       ?      0.00    39.37  
1 1 1 6   -4  11 o 11 12.90   5.69   -2.56     8.22     -2.56    8.22     0.00      0.00     12.90   5.69   ?       ?      0.00    5.69   
1 1 1 6   -4  12 o 2  729.06  85.99  17918.23  3529.70  17664.71 4991.63  18171.79  4991.87  654.66  137.22 668.03  134.82 -13.37  192.37 
1 1 1 6   -4  13 o 19 182.66  19.03  974.96    196.60   887.56   277.36   1063.22   278.70   172.11  29.11  189.38  26.35  -17.27  39.26  
1 1 1 6   -4  14 o 5  282.20  29.15  2348.94   465.47   2263.76  657.83   2434.35   658.73   272.61  43.50  283.52  41.72  -10.91  60.27  
1 1 1 6   -4  15 o 11 136.18  14.78  541.13    113.67   588.40   159.83   492.74    161.69   141.11  20.32  128.42  22.77  12.70   30.51  
1 1 1 6   -4  16 o 4  319.90  33.42  3059.50   604.73   3128.06  855.16   2990.92   855.27   316.82  48.57  309.00  49.92  7.81    69.64  
1 1 1 6   -4  17 o 1  320.44  33.73  3086.15   611.11   3071.11  863.94   3101.21   864.55   311.70  49.97  313.39  49.71  -1.69   70.49  
1 1 1 6   -4  18 o 19 201.05  21.32  1189.54   242.28   1148.78  341.92   1230.64   343.35   194.70  31.68  202.01  30.56  -7.31   44.02  
1 1 1 6   -4  19 o 11 73.37   21.67  159.15    97.54    0.00     0.00     159.15    97.54    ?       ?      73.37   21.67  0.00    21.67  
1 1 1 6   -4  20 o 5  119.17  22.22  427.22    146.39   0.00     0.00     427.22    146.39   ?       ?      119.17  22.22  0.00    22.22  
1 1 1 6   -4  21 o 17 145.57  16.73  623.71    137.25   622.22   192.98   625.24    195.25   143.50  24.29  143.79  24.53  -0.29   34.52  
1 1 1 6   -4  22 o 1  248.30  26.56  1860.09   372.76   1843.30  527.40   1876.86   526.93   240.40  39.59  242.90  39.12  -2.50   55.66  
1 1 1 6   -4  23 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   -4  24 o 10 183.12  30.60  1057.88   310.33   1057.88  310.33   0.00      0.00     183.12  30.60  ?       ?      0.00    30.60  
1 1 1 6   -4  25 o 17 201.84  22.12  1239.06   252.09   1331.03  358.10   1148.72   354.93   203.64  31.66  187.26  34.28  16.38   46.66  
1 1 1 6   -4  26 o 2  66.56   22.39  128.79    101.09   128.79   101.09   0.00      0.00     66.56   22.39  ?       ?      0.00    22.39  
1 1 1 6   -4  27 o 13 115.31  23.58  422.26    150.83   0.00     0.00     422.26    150.83   ?       ?      115.31  23.58  0.00    23.58  
1 1 1 6   -4  28 o 11 100.91  16.82  312.40    93.99    319.34   136.55   306.16    129.56   99.16   24.20  97.34   23.46  1.82    33.71  
1 1 1 6   -4  29 o 19 115.55  17.22  411.17    110.72   432.75   161.53   392.05    152.06   114.51  25.25  109.08  24.84  5.43    35.42  
1 1 1 6   -3  0  o 2  313.19  32.96  2962.98   583.78   2884.61  825.46   3041.41   825.72   299.98  49.67  309.14  48.09  -9.16   69.14  
1 1 1 6   -3  1  o 4  358.23  38.22  3929.81   773.92   3807.05  1094.38  4052.61   1094.59  339.29  58.29  351.93  56.06  -12.65  80.87  
1 1 1 6   -3  2  o 9  217.72  22.49  1401.54   277.04   1371.53  391.52   1431.63   392.08   211.78  33.30  216.76  32.51  -4.98   46.54  
1 1 1 6   -3  3  o 12 355.84  38.08  3878.77   765.77   4130.04  1082.95  3627.48   1082.98  356.11  54.72  330.02  59.34  26.08   80.72  
1 1 1 6   -3  4  f 0  219.91  22.72  1430.93   282.74   1393.88  399.73   1468.03   399.99   213.28  33.77  219.38  32.76  -6.10   47.05  
1 1 1 6   -3  5  o 2  272.92  28.55  2231.70   440.71   2290.21  623.25   2173.19   623.28   270.55  41.45  262.73  42.80  7.82    59.58  
1 1 1 6   -3  6  o 8  411.10  45.29  5320.80   1051.26  5919.40  1486.91  4722.53   1486.50  416.55  64.24  362.06  74.02  54.49   98.01  
1 1 1 6   -3  7  o 2  61.05   12.46  111.56    42.20    0.00     0.00     111.56    42.20    ?       ?      61.05   12.46  0.00    12.46  
1 1 1 6   -3  8  o 19 223.15  34.56  1530.40   428.44   0.00     0.00     1530.40   428.44   ?       ?      223.15  34.56  0.00    34.56  
1 1 1 6   -3  9  o 7  237.92  24.80  1681.17   333.73   1910.44  472.39   1452.73   471.54   250.44  33.71  215.51  39.57  34.93   51.99  
1 1 1 6   -3  10 o 11 176.64  18.31  915.94    182.95   949.04   257.85   882.39    259.61   177.91  26.02  171.04  27.36  6.86    37.76  
1 1 1 6   -3  11 f 0  17.02   8.46   -80.47    32.20    -80.47   32.20    0.00      0.00     17.02   8.46   ?       ?      0.00    8.46   
1 1 1 6   -3  12 o 2  463.71  79.88  7354.29   2049.73  7354.29  2049.73  0.00      0.00     463.71  79.88  ?       ?      0.00    79.88  
1 1 1 6   -3  13 o 15 69.73   12.14  144.07    46.84    142.44   68.64    145.49    64.08    68.88   17.37  69.60   16.32  -0.72   23.83  
1 1 1 6   -3  14 o 4  139.67  15.11  569.10    119.26   576.76   170.46   561.77    166.90   139.40  22.03  137.57  21.86  1.83    31.04  
1 1 1 6   -3  15 o 1  447.77  47.44  6085.21   1200.88  5882.88  1698.27  6287.56   1698.33  425.94  72.02  442.55  69.11  -16.60  99.81  
1 1 1 6   -3  16 o 3  348.98  55.15  3823.38   1068.24  0.00     0.00     3823.38   1068.24  ?       ?      348.98  55.15  0.00    55.15  
1 1 1 6   -3  17 o 13 395.22  65.59  5142.51   1435.86  5142.51  1435.86  0.00      0.00     395.22  65.59  ?       ?      0.00    65.59  
1 1 1 6   -3  18 o 17 142.01  16.18  591.37    129.52   646.81   186.55   539.77    179.98   147.18  22.82  133.83  24.32  13.34   33.35  
1 1 1 6   -3  19 o 17 119.06  15.50  416.75    103.43   380.94   151.87   447.72    141.25   112.06  24.31  122.41  20.85  -10.35  32.02  
1 1 1 6   -3  20 o 14 284.76  45.04  2525.28   711.78   0.00     0.00     2525.28   711.78   ?       ?      284.76  45.04  0.00    45.04  
1 1 1 6   -3  21 o 19 232.11  36.67  1659.53   472.36   0.00     0.00     1659.53   472.36   ?       ?      232.11  36.67  0.00    36.67  
1 1 1 6   -3  22 o 10 215.94  35.06  1452.40   419.67   1452.40  419.67   0.00      0.00     215.94  35.06  ?       ?      0.00    35.06  
1 1 1 6   -3  23 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   -3  24 o 4  59.19   22.99  69.92     111.92   69.92    111.92   0.00      0.00     59.19   22.99  ?       ?      0.00    22.99  
1 1 1 6   -3  25 o 2  116.95  25.62  430.78    167.20   430.78   167.20   0.00      0.00     116.95  25.62  ?       ?      0.00    25.62  
1 1 1 6   -3  26 o 6  112.36  25.34  401.77    159.53   401.77   159.53   0.00      0.00     112.36  25.34  ?       ?      0.00    25.34  
1 1 1 6   -3  27 o 17 60.63   19.08  110.15    74.08    116.58   125.71   106.73    91.69    66.82   24.73  61.50   21.30  5.32    32.64  
1 1 1 6   -3  28 o 15 47.97   18.88  44.43     76.25    115.45   128.76   6.08      94.63    66.57   24.95  46.51   19.91  20.06   31.92  
1 1 1 6   -3  29 o 14 48.41   20.41  20.07     96.84    31.07    134.59   8.26      139.45   56.56   23.96  55.09   23.88  1.46    33.83  
1 1 1 6   -2  0  o 16 107.64  11.22  337.60    68.31    313.07   95.98    362.79    97.25    102.61  16.88  110.87  15.72  -8.25   23.07  
1 1 1 6   -2  1  o 9  322.66  33.94  3140.09   619.27   3189.73  875.70   3090.43   875.86   316.88  49.78  311.24  50.77  5.64    71.10  
1 1 1 6   -2  2  o 12 570.01  66.86  10901.07  2146.34  10715.37 3035.35  11086.79  3035.42  512.51  106.64 525.03  104.39 -12.52  149.23 
1 1 1 6   -2  3  o 11 152.61  15.71  681.51    135.65   732.55   191.74   630.38    191.93   156.95  21.87  144.88  23.91  12.06   32.41  
1 1 1 6   -2  4  f 0  73.83   12.01  161.32    49.17    161.32   49.17    0.00      0.00     73.83   12.01  ?       ?      0.00    12.01  
1 1 1 6   -2  5  o 8  193.10  29.47  1129.25   316.31   0.00     0.00     1129.25   316.31   ?       ?      193.10  29.47  0.00    29.47  
1 1 1 6   -2  6  o 10 116.10  12.27  393.53    80.52    381.04   113.01   406.41    114.76   113.14  18.00  117.00  17.63  -3.86   25.20  
1 1 1 6   -2  7  o 11 136.92  14.31  548.55    110.83   594.97   156.44   501.77    157.04   141.50  19.80  129.22  21.95  12.28   29.56  
1 1 1 6   -2  8  o 3  302.14  48.94  2937.96   819.89   0.00     0.00     2937.96   819.89   ?       ?      302.14  48.94  0.00    48.94  
1 1 1 6   -2  9  o 6  233.65  36.38  1687.00   472.10   0.00     0.00     1687.00   472.10   ?       ?      233.65  36.38  0.00    36.38  
1 1 1 6   -2  10 o 1  111.73  12.78  365.26    80.48    -2.49    109.81   792.07    118.29   50.09   21.44  165.12  12.57  -115.03 24.86  
1 1 1 6   -2  11 f 0  348.58  37.02  3697.72   729.43   3683.16  1031.22  3712.30   1031.91  336.82  55.25  338.33  55.02  -1.51   77.97  
1 1 1 6   -2  12 o 18 409.92  69.43  5651.99   1575.61  5651.99  1575.61  0.00      0.00     409.92  69.43  ?       ?      0.00    69.43  
1 1 1 6   -2  13 f 0  292.55  45.44  2641.94   738.38   2641.94  738.38   0.00      0.00     292.55  45.44  ?       ?      0.00    45.44  
1 1 1 6   -2  14 o 17 724.94  85.41  17701.67  3486.20  18267.38 4930.27  17135.98  4930.18  672.91  132.35 642.89  137.73 30.01   191.01 
1 1 1 6   -2  15 o 10 201.14  20.87  1184.21   237.44   1187.38  336.10   1181.04   335.50   199.33  30.33  198.78  30.36  0.55    42.91  
1 1 1 6   -2  16 o 14 365.77  38.21  4003.87   790.49   4163.08  1118.23  3844.84   1117.60  365.45  55.01  349.61  57.70  15.84   79.72  
1 1 1 6   -2  17 o 6  196.28  20.55  1130.32   228.11   1167.77  323.77   1093.42   321.42   197.37  29.48  190.61  30.40  6.76    42.34  
1 1 1 6   -2  18 o 4  263.66  41.35  2149.57   605.26   2149.57  605.26   0.00      0.00     263.66  41.35  ?       ?      0.00    41.35  
1 1 1 6   -2  19 o 15 108.54  14.83  346.88    89.96    366.51   129.34   328.48    125.21   110.36  21.19  104.27  21.63  6.09    30.28  
1 1 1 6   -2  20 o 12 444.40  48.33  6152.18   1213.21  6342.07  1716.40  5962.58   1715.07  432.33  71.67  416.48  74.47  15.85   103.35 
1 1 1 6   -2  21 o 1  303.96  48.68  2923.34   820.74   0.00     0.00     2923.34   820.74   ?       ?      303.96  48.68  0.00    48.68  
1 1 1 6   -2  22 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   -2  23 o 4  131.30  23.52  525.33    170.73   0.00     0.00     525.33    170.73   ?       ?      131.30  23.52  0.00    23.52  
1 1 1 6   -2  24 o 16 211.34  22.95  1344.19   273.97   1397.85  390.76   1292.31   384.23   210.39  33.47  201.62  34.43  8.77    48.02  
1 1 1 6   -2  25 o 11 271.18  30.22  2300.90   462.53   2222.44  656.01   2378.46   652.24   252.74  46.94  263.78  44.67  -11.03  64.80  
1 1 1 6   -2  26 o 7  77.12   24.46  181.42    121.54   181.42   121.54   0.00      0.00     77.12   24.46  ?       ?      0.00    24.46  
1 1 1 6   -2  27 o 18 73.77   24.02  165.27    116.65   165.27   116.65   0.00      0.00     73.77   24.02  ?       ?      0.00    24.02  
1 1 1 6   -2  28 o 2  97.86   17.37  294.51    94.01    232.00   138.94   347.30    127.67   84.98   26.03  104.66  21.95  -19.69  34.05  
1 1 1 6   -2  29 o 16 184.47  22.73  1076.72   235.64   1022.31  338.29   1128.01   328.43   168.54  36.05  180.31  32.94  -11.77  48.84  
1 1 1 6   -2  30 o 17 78.65   22.35  201.82    105.64   97.85    167.97   269.87    135.89   67.58   27.52  89.69   25.30  -22.12  37.39  
1 1 1 6   -1  0  o 5  73.66   8.12   157.98    33.77    179.48   47.44    135.90    48.07    78.18   10.86  67.51   12.87  10.67   16.84  
1 1 1 6   -1  1  o 3  391.54  41.82  4702.76   925.42   4591.49  1308.68  4814.04   1308.80  372.14  63.54  382.64  61.68  -10.50  88.55  
1 1 1 6   -1  2  o 7  400.06  42.83  4925.46   968.37   4752.45  1369.41  5098.50   1369.55  376.82  65.69  392.83  62.85  -16.01  90.91  
1 1 1 6   -1  3  o 15 390.27  65.84  5106.00   1422.70  5106.00  1422.70  0.00      0.00     390.27  65.84  ?       ?      0.00    65.84  
1 1 1 6   -1  4  o 12 324.36  52.32  3375.63   941.00   3375.63  941.00   0.00      0.00     324.36  52.32  ?       ?      0.00    52.32  
1 1 1 6   -1  5  o 2  594.42  71.80  12198.01  2400.40  11885.22 3394.62  12510.83  3394.75  519.93  116.61 540.27  113.09 -20.33  162.44 
1 1 1 6   -1  6  o 17 175.79  18.12  907.60    180.20   940.37   254.74   874.77    254.95   176.98  25.84  170.24  26.99  6.74    37.36  
1 1 1 6   -1  7  o 11 357.57  38.33  3927.40   774.59   4101.25  1095.51  3753.61   1095.36  353.28  55.87  335.30  59.06  17.97   81.30  
1 1 1 6   -1  8  o 15 311.19  50.78  3140.02   875.84   0.00     0.00     3140.02   875.84   ?       ?      311.19  50.78  0.00    50.78  
1 1 1 6   -1  9  o 8  237.96  37.10  1753.95   490.24   0.00     0.00     1753.95   490.24   ?       ?      237.96  37.10  0.00    37.10  
1 1 1 6   -1  10 o 9  276.69  44.06  2422.61   676.40   0.00     0.00     2422.61   676.40   ?       ?      276.69  44.06  0.00    44.06  
1 1 1 6   -1  11 o 12 308.43  32.48  2871.83   566.54   3064.17  801.28   2679.57   801.13   311.27  46.24  288.43  50.21  22.84   68.26  
1 1 1 6   -1  12 o 13 364.35  60.47  4375.74   1220.54  0.00     0.00     4375.74   1220.54  ?       ?      364.35  60.47  0.00    60.47  
1 1 1 6   -1  13 o 16 124.13  19.44  457.68    133.95   457.68   133.95   0.00      0.00     124.13  19.44  ?       ?      0.00    19.44  
1 1 1 6   -1  14 o 11 219.33  33.35  1448.53   406.75   1448.53  406.75   0.00      0.00     219.33  33.35  ?       ?      0.00    33.35  
1 1 1 6   -1  15 o 4  547.02  59.60  9348.54   1841.40  9482.11  2604.13  9214.97   2604.15  526.12  89.42  517.00  91.07  9.11    127.63 
1 1 1 6   -1  16 o 11 172.96  18.09  874.11    176.92   850.85   249.77   897.54    250.65   168.90  26.64  173.73  25.92  -4.83   37.17  
1 1 1 6   -1  17 o 7  370.92  38.85  4137.10   815.08   4357.01  1152.77  3917.24   1152.63  372.36  55.63  350.69  59.37  21.67   81.36  
1 1 1 6   -1  18 o 15 231.72  24.11  1585.28   316.09   1592.30  446.50   1578.22   447.54   228.81  35.11  227.68  35.39  1.13    49.85  
1 1 1 6   -1  19 o 17 338.47  35.85  3473.90   686.02   3581.49  970.13   3366.30   970.24   334.25  52.27  322.57  54.32  11.68   75.39  
1 1 1 6   -1  20 o 4  407.88  44.05  5141.28   1015.01  5163.13  1435.35  5119.42   1435.53  392.47  66.05  390.47  66.42  2.00    93.67  
1 1 1 6   -1  21 o 12 338.21  35.93  3461.37   686.84   3379.35  971.06   3543.49   971.61   324.13  54.09  333.01  52.57  -8.88   75.43  
1 1 1 6   -1  22 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   -1  23 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   -1  24 o 13 265.21  28.89  2157.79   432.67   2064.98  611.37   2250.92   612.42   249.13  44.37  262.02  42.14  -12.89  61.20  
1 1 1 6   -1  25 o 3  208.29  22.72  1312.86   267.30   1320.94  378.26   1304.80   377.78   203.08  33.62  201.69  33.82  1.39    47.69  
1 1 1 6   -1  26 o 5  139.81  25.34  613.72    195.91   613.72   195.91   0.00      0.00     139.81  25.34  ?       ?      0.00    25.34  
1 1 1 6   -1  27 o 5  158.82  28.02  812.13    246.10   812.13   246.10   0.00      0.00     158.82  28.02  ?       ?      0.00    28.02  
1 1 1 6   -1  28 o 6  124.25  24.67  495.74    169.77   495.74   169.77   0.00      0.00     124.25  24.67  ?       ?      0.00    24.67  
1 1 1 6   -1  29 o 7  200.95  24.70  1293.91   278.94   1255.05  395.89   1332.23   393.07   184.94  38.54  192.46  36.92  -7.51   53.37  
1 1 1 6   -1  30 o 10 184.32  23.40  1097.03   242.06   1062.75  349.53   1128.62   335.55   167.91  37.24  176.45  34.36  -8.54   50.67  
1 1 1 6   0   0  o 14 143.46  14.70  601.09    119.34   602.40   168.63   599.77    168.91   142.31  21.30  141.97  21.39  0.34    30.18  
1 1 1 6   0   1  o 8  217.54  22.42  1394.62   275.96   1458.67  390.23   1330.53   390.30   219.74  31.86  209.10  33.66  10.65   46.35  
1 1 1 6   0   2  o 8  186.11  19.10  1016.38   201.18   1042.76  284.51   990.00    284.52   186.46  27.40  181.35  28.25  5.11    39.35  
1 1 1 6   0   3  o 9  293.34  30.63  2573.44   508.14   2686.25  718.61   2460.63   718.62   293.83  43.95  279.82  46.36  14.02   63.88  
1 1 1 6   0   4  o 1  148.47  15.26  644.43    128.25   663.72   181.31   625.12    181.42   149.34  21.79  144.66  22.58  4.68    31.38  
1 1 1 6   0   5  o 19 541.48  62.85  9712.47   1917.51  10212.47 2711.78  9212.48   2711.75  514.62  95.30  479.30  101.71 35.32   139.38 
1 1 1 6   0   6  o 3  205.56  21.19  1246.61   246.50   1243.30  348.49   1249.93   348.71   202.27  31.00  202.85  30.92  -0.57   43.78  
1 1 1 6   0   7  o 9  148.19  15.48  643.19    129.73   744.05   184.04   543.60    182.89   158.35  20.74  133.99  24.69  24.36   32.24  
1 1 1 6   0   8  o 4  481.58  54.89  7571.18   1490.39  7446.80  2107.66  7695.58   2107.79  441.59  86.24  451.42  84.44  -9.83   120.69 
1 1 1 6   0   9  o 14 115.55  17.91  397.34    114.96   0.00     0.00     397.34    114.96   ?       ?      115.55  17.91  0.00    17.91  
1 1 1 6   0   10 o 9  278.67  44.52  2465.17   688.22   0.00     0.00     2465.17   688.22   ?       ?      278.67  44.52  0.00    44.52  
1 1 1 6   0   11 f 0  382.54  41.41  4539.57   894.83   4491.11  1265.50  4588.02   1265.47  363.95  62.84  368.66  61.99  -4.71   88.27  
1 1 1 6   0   12 o 16 345.23  36.70  3629.70   716.21   3668.69  1012.76  3590.69   1012.98  336.28  54.31  332.12  55.06  4.17    77.34  
1 1 1 6   0   13 o 14 224.16  34.45  1528.85   429.13   1528.85  429.13   0.00      0.00     224.16  34.45  ?       ?      0.00    34.45  
1 1 1 6   0   14 o 5  318.31  50.01  3164.94   883.75   3164.94  883.75   0.00      0.00     318.31  50.01  ?       ?      0.00    50.01  
1 1 1 6   0   15 o 19 442.69  73.14  6434.98   1793.96  6434.98  1793.96  0.00      0.00     442.69  73.14  ?       ?      0.00    73.14  
1 1 1 6   0   16 o 11 224.15  23.14  1474.31   293.45   1486.13  414.93   1462.50   415.06   222.47  33.53  220.57  33.86  1.90    47.65  
1 1 1 6   0   17 f 0  549.73  60.59  9528.05   1880.56  9060.53  2659.39  9995.66   2659.65  505.08  95.21  536.96  89.43  -31.87  130.62 
1 1 1 6   0   18 o 6  134.16  14.77  526.20    111.90   536.33   158.41   516.11    158.10   134.20  21.27  131.50  21.70  2.70    30.39  
1 1 1 6   0   19 o 8  196.69  20.71  1139.68   230.35   1140.70  325.51   1138.66   326.01   194.08  30.20  193.88  30.28  0.20    42.77  
1 1 1 6   0   20 o 13 279.76  29.43  2341.18   465.57   2307.63  658.34   2374.74   658.49   271.40  43.74  275.77  43.00  -4.37   61.34  
1 1 1 6   0   21 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   0   22 o 7  232.14  36.71  1662.34   472.90   0.00     0.00     1662.34   472.90   ?       ?      232.14  36.71  0.00    36.71  
1 1 1 6   0   23 o 19 97.84   21.50  292.13    117.45   0.00     0.00     292.13    117.45   ?       ?      97.84   21.50  0.00    21.50  
1 1 1 6   0   24 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   0   25 o 18 263.67  29.23  2157.37   434.94   1991.33  615.20   2323.30   614.99   240.49  46.24  263.89  42.00  -23.40  62.47  
1 1 1 6   0   26 o 16 191.21  32.85  1188.64   347.57   1188.64  347.57   0.00      0.00     191.21  32.85  ?       ?      0.00    32.85  
1 1 1 6   0   27 o 3  264.53  52.92  2745.95   775.50   2745.95  775.50   0.00      0.00     264.53  52.92  ?       ?      0.00    52.92  
1 1 1 6   0   28 o 3  109.51  29.20  401.34    186.89   401.34   186.89   0.00      0.00     109.51  29.20  ?       ?      0.00    29.20  
1 1 1 6   0   29 o 18 113.72  20.37  407.41    128.10   380.30   191.46   429.37    172.35   105.19  30.15  113.44  26.88  -8.25   40.39  
1 1 1 6   0   30 o 10 105.20  22.11  360.24    129.28   300.34   191.35   410.54    175.35   92.76   30.79  109.03  27.90  -16.27  41.55  
1 1 1 6   1   0  o 5  323.16  33.89  3142.76   619.36   3139.13  875.86   3146.39   875.96   314.78  50.15  315.18  50.09  -0.41   70.88  
1 1 1 6   1   1  o 10 231.02  23.86  1576.52   311.83   1653.26  440.99   1499.76   441.01   233.43  33.90  221.41  35.93  12.03   49.40  
1 1 1 6   1   2  o 3  183.10  18.82  983.66    195.02   1029.02  275.73   938.25    275.88   185.38  26.68  176.44  28.18  8.94    38.81  
1 1 1 6   1   3  o 6  298.64  31.22  2670.93   527.35   2736.36  745.75   2605.49   745.82   295.84  45.35  287.85  46.74  7.99    65.12  
1 1 1 6   1   4  o 18 217.88  22.49  1400.70   277.24   1451.91  392.01   1349.45   392.13   218.89  32.16  210.38  33.60  8.51    46.51  
1 1 1 6   1   5  o 10 538.37  62.34  9588.11   1891.23  9885.00  2674.61  9291.23   2674.61  505.24  95.72  484.14  99.56  21.10   138.11 
1 1 1 6   1   6  o 18 208.11  21.48  1278.47   252.94   1307.85  357.66   1249.06   357.76   207.55  30.96  202.44  31.83  5.11    44.41  
1 1 1 6   1   7  o 14 200.34  20.74  1184.02   235.13   1293.81  332.77   1074.55   332.29   207.08  28.77  187.29  32.06  19.78   43.07  
1 1 1 6   1   8  o 6  206.91  21.38  1265.40   250.26   1262.67  353.72   1268.13   354.11   203.45  31.29  203.91  31.24  -0.46   44.22  
1 1 1 6   1   9  o 11 493.88  108.02 10687.02  2977.02  0.00     0.00     10687.02  2977.02  ?       ?      493.88  108.02 0.00    108.02 
1 1 1 6   1   10 o 12 237.29  37.06  1746.79   488.31   0.00     0.00     1746.79   488.31   ?       ?      237.29  37.06  0.00    37.06  
1 1 1 6   1   11 o 12 203.27  21.09  1220.55   242.48   1264.88  343.27   1176.39   342.56   204.06  30.22  196.20  31.48  7.85    43.63  
1 1 1 6   1   12 o 13 383.44  41.35  4543.50   895.77   4522.00  1266.71  4565.01   1266.89  366.97  62.36  369.05  62.00  -2.07   87.93  
1 1 1 6   1   13 o 3  230.94  23.92  1576.54   312.57   1540.81  441.87   1612.34   442.22   224.51  35.46  230.10  34.54  -5.60   49.50  
1 1 1 6   1   14 o 14 510.66  93.39  9463.89   2637.04  9463.89  2637.04  0.00      0.00     510.66  93.39  ?       ?      0.00    93.39  
1 1 1 6   1   15 o 4  226.34  34.49  1544.35   433.94   1544.35  433.94   0.00      0.00     226.34  34.49  ?       ?      0.00    34.49  
1 1 1 6   1   16 o 12 150.92  16.02  664.88    136.66   646.63   193.24   683.14    193.30   147.38  23.64  151.73  22.90  -4.35   32.92  
1 1 1 6   1   17 o 15 354.53  37.08  3764.65   743.51   3738.84  1051.41  3790.46   1051.56  345.13  54.91  347.78  54.46  -2.65   77.33  
1 1 1 6   1   18 o 15 100.94  12.87  298.60    72.89    290.09   104.56   306.65    101.68   98.34   19.21  101.37  18.14  -3.03   26.42  
1 1 1 6   1   19 o 19 449.47  49.57  6377.29   1257.91  6400.09  1779.02  6354.49   1778.89  426.78  75.37  424.88  75.71  1.90    106.83 
1 1 1 6   1   20 o 9  74.50   15.21  166.48    62.85    165.49   87.90    167.52    89.90    74.13   20.14  74.60   20.41  -0.47   28.67  
1 1 1 6   1   21 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   1   22 o 8  179.77  19.56  952.26    198.58   979.14   281.26   925.54    280.42   179.93  28.15  174.57  29.00  5.36    40.42  
1 1 1 6   1   23 f 0  249.53  26.57  1872.87   374.78   1978.08  530.70   1768.20   529.33   250.83  38.05  235.52  40.62  15.31   55.66  
1 1 1 6   1   24 o 2  135.39  23.95  561.69    179.36   0.00     0.00     561.69    179.36   ?       ?      135.39  23.95  0.00    23.95  
1 1 1 6   1   25 o 3  215.61  36.11  1506.86   431.18   0.00     0.00     1506.86   431.18   ?       ?      215.61  36.11  0.00    36.11  
1 1 1 6   1   26 o 16 161.11  18.82  781.57    170.75   770.26   244.87   792.26    238.22   155.50  28.48  158.43  27.17  -2.93   39.36  
1 1 1 6   1   27 o 3  54.60   18.93  82.42     72.40    97.10    109.86   71.14     96.26    62.05   23.08  56.09   21.44  5.96    31.51  
1 1 1 6   1   28 o 12 164.46  32.40  918.21    295.04   918.21   295.04   0.00      0.00     164.46  32.40  ?       ?      0.00    32.40  
1 1 1 6   1   29 o 13 219.86  46.38  1937.00   566.88   1937.00  566.88   0.00      0.00     219.86  46.38  ?       ?      0.00    46.38  
1 1 1 6   1   30 o 2  79.85   21.43  208.02    100.29   215.83   177.23   204.33    121.65   81.58   29.49  78.72   24.40  2.85    38.27  
1 1 1 6   1   31 o 16 170.17  35.30  1101.84   333.51   0.00     0.00     1101.84   333.51   ?       ?      170.17  35.30  0.00    35.30  
1 1 1 6   2   0  o 16 479.76  53.25  7318.05   1441.80  7345.58  2038.97  7290.52   2039.05  453.59  81.29  451.43  81.69  2.16    115.24 
1 1 1 6   2   1  o 8  493.79  55.09  7795.92   1535.07  7761.15  2170.87  7830.69   2170.97  462.76  84.84  465.41  84.36  -2.65   119.65 
1 1 1 6   2   2  o 17 431.40  46.76  5798.67   1139.57  5556.39  1611.52  6041.00   1611.67  401.43  72.60  422.35  68.84  -20.93  100.05 
1 1 1 6   2   3  o 19 100.33  10.53  293.21    59.77    316.06   84.40    270.22    84.66    103.55  14.60  95.33   16.04  8.22    21.69  
1 1 1 6   2   4  o 16 342.21  36.24  3556.97   701.15   3563.56  991.51   3550.38   991.62   332.14  53.84  331.43  53.97  0.71    76.24  
1 1 1 6   2   5  o 3  161.39  16.61  763.28    151.66   783.62   214.39   742.90    214.57   161.86  23.78  157.31  24.56  4.55    34.19  
1 1 1 6   2   6  o 11 264.37  27.54  2087.02   411.82   2088.31  582.29   2085.73   582.50   258.88  40.51  258.69  40.56  0.19    57.32  
1 1 1 6   2   7  o 10 440.81  49.02  6186.03   1219.48  6245.71  1724.58  6126.35   1724.63  417.98  74.61  412.87  75.55  5.10    106.18 
1 1 1 6   2   8  f 0  171.97  26.20  892.25    250.49   0.00     0.00     892.25    250.49   ?       ?      171.97  26.20  0.00    26.20  
1 1 1 6   2   9  o 4  172.55  26.31  898.92    252.42   0.00     0.00     898.92    252.42   ?       ?      172.55  26.31  0.00    26.31  
1 1 1 6   2   10 o 6  214.01  33.08  1405.83   393.35   0.00     0.00     1405.83   393.35   ?       ?      214.01  33.08  0.00    33.08  
1 1 1 6   2   11 o 12 181.36  18.82  968.10    193.09   1030.59  273.64   906.13    272.51   185.03  26.52  172.68  28.48  12.36   38.92  
1 1 1 6   2   12 o 19 358.95  38.37  3948.20   778.43   3886.84  1100.69  4009.60   1101.05  343.07  57.95  349.37  56.85  -6.30   81.18  
1 1 1 6   2   13 o 19 271.33  28.28  2192.86   434.09   2236.10  613.73   2149.59   614.06   268.86  41.06  263.05  42.08  5.81    58.80  
1 1 1 6   2   14 o 8  271.61  42.08  2269.44   634.87   2269.44  634.87   0.00      0.00     271.61  42.08  ?       ?      0.00    42.08  
1 1 1 6   2   15 o 10 283.92  43.82  2471.91   691.31   2471.91  691.31   0.00      0.00     283.92  43.82  ?       ?      0.00    43.82  
1 1 1 6   2   16 o 10 450.70  74.81  6699.34   1867.84  6699.34  1867.84  0.00      0.00     450.70  74.81  ?       ?      0.00    74.81  
1 1 1 6   2   17 o 18 164.91  17.41  795.01    162.37   741.70   229.08   848.84    230.18   157.39  26.28  169.05  24.43  -11.66  35.88  
1 1 1 6   2   18 o 19 262.57  27.35  2044.94   406.26   2177.11  574.53   1912.75   574.56   266.96  38.61  248.69  41.72  18.27   56.84  
1 1 1 6   2   19 o 18 387.75  41.84  4642.48   916.64   4720.47  1296.32  4564.50   1296.34  376.04  62.23  368.58  63.56  7.46    88.95  
1 1 1 6   2   20 o 16 184.38  29.28  1031.27   299.52   1031.27  299.52   0.00      0.00     184.38  29.28  ?       ?      0.00    29.28  
1 1 1 6   2   21 o 11 189.84  30.24  1093.34   318.49   0.00     0.00     1093.34   318.49   ?       ?      189.84  30.24  0.00    30.24  
1 1 1 6   2   22 o 9  46.12   17.58  43.17     64.60    51.78    93.97    35.45     88.95    53.76   21.02  50.26   20.19  3.50    29.14  
1 1 1 6   2   23 o 8  110.92  15.66  364.62    96.94    350.64   137.22   378.55    136.97   107.06  23.01  111.52  22.18  -4.46   31.96  
1 1 1 6   2   24 o 3  51.54   20.42  44.98     89.78    0.00     0.00     44.98     89.78    ?       ?      51.54   20.42  0.00    20.42  
1 1 1 6   2   25 o 12 93.81   22.05  273.06    116.71   0.00     0.00     273.06    116.71   ?       ?      93.81   22.05  0.00    22.05  
1 1 1 6   2   26 o 15 206.52  23.02  1306.29   268.27   1292.89  381.25   1319.43   377.56   197.94  34.82  200.59  34.00  -2.65   48.67  
1 1 1 6   2   27 o 11 131.04  19.74  527.94    143.90   436.44   202.43   621.40    204.59   114.39  30.34  138.95  26.62  -24.55  40.36  
1 1 1 6   2   28 o 9  52.36   21.03  48.19     96.46    48.32    138.60   48.07     134.33   59.48   24.69  58.78   24.35  0.70    34.68  
1 1 1 6   2   29 o 10 232.16  51.53  2324.37   668.87   2324.37  668.87   0.00      0.00     232.16  51.53  ?       ?      0.00    51.53  
1 1 1 6   2   30 f 0  114.65  30.46  470.64    203.88   470.64   203.88   0.00      0.00     114.65  30.46  ?       ?      0.00    30.46  
1 1 1 6   2   31 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   3   0  o 2  395.37  42.73  4839.86   954.50   4899.94  1349.84  4779.78   1349.90  381.85  63.83  376.20  64.85  5.65    90.99  
1 1 1 6   3   1  o 11 140.10  14.49  573.72    114.85   618.31   162.44   529.13    162.42   144.35  20.15  132.89  22.06  11.46   29.88  
1 1 1 6   3   2  o 14 311.06  49.96  3091.89   861.86   3091.89  861.86   0.00      0.00     311.06  49.96  ?       ?      0.00    49.96  
1 1 1 6   3   3  o 7  302.12  31.68  2747.12   541.21   2715.74  765.30   2778.50   765.46   292.55  47.17  296.34  46.53  -3.79   66.26  
1 1 1 6   3   4  o 6  214.89  22.19  1364.49   269.77   1378.03  381.44   1350.94   381.57   212.72  32.25  210.43  32.64  2.29    45.89  
1 1 1 6   3   5  o 13 235.92  24.42  1651.94   325.99   1638.62  460.95   1665.27   461.09   230.69  35.98  232.74  35.64  -2.04   50.65  
1 1 1 6   3   6  o 3  224.44  23.39  1493.51   296.96   1628.36  420.34   1359.15   419.59   231.18  32.57  209.45  36.21  21.73   48.70  
1 1 1 6   3   7  o 14 145.88  22.16  637.01    179.72   0.00     0.00     637.01    179.72   ?       ?      145.88  22.16  0.00    22.16  
1 1 1 6   3   8  o 14 344.83  58.21  3986.15   1111.29  0.00     0.00     3986.15   1111.29  ?       ?      344.83  58.21  0.00    58.21  
1 1 1 6   3   9  o 2  259.85  41.09  2122.42   592.65   0.00     0.00     2122.42   592.65   ?       ?      259.85  41.09  0.00    41.09  
1 1 1 6   3   10 o 8  584.11  73.50  12200.71  2410.05  12816.75 3408.37  11584.70  3408.28  527.84  115.68 487.15  122.12 40.69   168.21 
1 1 1 6   3   11 o 18 294.83  31.17  2621.00   519.52   2803.19  734.93   2439.04   734.49   298.12  44.29  275.52  48.19  22.60   65.45  
1 1 1 6   3   12 o 18 291.99  30.62  2559.25   505.71   2573.96  715.08   2544.53   715.27   285.92  45.06  284.08  45.39  1.85    63.95  
1 1 1 6   3   13 o 16 313.62  49.95  3113.20   869.10   3113.20  869.10   0.00      0.00     313.62  49.95  ?       ?      0.00    49.95  
1 1 1 6   3   14 o 10 242.57  37.20  1789.66   501.50   1789.66  501.50   0.00      0.00     242.57  37.20  ?       ?      0.00    37.20  
1 1 1 6   3   15 o 16 256.25  39.26  1996.03   559.11   1996.03  559.11   0.00      0.00     256.25  39.26  ?       ?      0.00    39.26  
1 1 1 6   3   16 o 19 111.18  12.99  361.03    81.37    355.84   114.45   366.33    115.70   109.35  18.92  111.00  18.83  -1.65   26.69  
1 1 1 6   3   17 o 1  225.46  23.47  1495.30   299.28   1618.63  423.28   1372.00   423.22   232.17  32.66  212.41  35.99  19.76   48.60  
1 1 1 6   3   18 o 1  342.85  36.19  3552.42   701.52   3459.01  991.83   3645.93   992.37   328.33  54.53  338.31  52.82  -9.97   75.92  
1 1 1 6   3   19 o 3  230.92  24.23  1581.95   316.40   1545.05  447.42   1618.87   447.51   223.94  36.02  229.74  35.04  -5.80   50.25  
1 1 1 6   3   20 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   3   21 o 19 280.88  29.71  2365.16   471.85   2376.24  667.60   2354.09   666.98   275.07  43.74  273.65  43.94  1.41    62.00  
1 1 1 6   3   22 o 16 155.76  17.76  714.52    155.95   681.03   221.37   747.52    219.75   149.69  26.74  157.46  25.16  -7.77   36.71  
1 1 1 6   3   23 o 12 206.21  22.26  1268.48   259.39   1249.63  367.74   1287.15   365.92   200.27  33.15  203.66  32.38  -3.39   46.34  
1 1 1 6   3   24 o 2  284.39  50.08  2801.69   787.81   0.00     0.00     2801.69   787.81   ?       ?      284.39  50.08  0.00    50.08  
1 1 1 6   3   25 o 6  211.80  35.76  1461.95   419.29   0.00     0.00     1461.95   419.29   ?       ?      211.80  35.76  0.00    35.76  
1 1 1 6   3   26 o 15 116.04  23.58  423.05    151.71   0.00     0.00     423.05    151.71   ?       ?      116.04  23.58  0.00    23.58  
1 1 1 6   3   27 o 19 181.95  22.11  1026.60   226.26   955.91   320.42   1096.91   319.54   167.07  34.55  181.43  31.84  -14.36  46.98  
1 1 1 6   3   28 o 3  188.96  36.89  1273.07   385.76   1273.07  385.76   0.00      0.00     188.96  36.89  ?       ?      0.00    36.89  
1 1 1 6   3   29 o 1  121.93  30.01  516.91    208.60   516.91   208.60   0.00      0.00     121.93  30.01  ?       ?      0.00    30.01  
1 1 1 6   3   30 o 9  69.75   27.31  131.95    158.88   131.95   158.88   0.00      0.00     69.75   27.31  ?       ?      0.00    27.31  
1 1 1 6   3   31 o 2  156.00  22.36  802.57    194.49   855.10   279.91   753.54    270.44   149.72  33.41  139.37  34.09  10.36   47.73  
1 1 1 6   4   0  o 16 321.97  34.11  3142.07   620.87   3320.20  878.04   2963.92   878.06   322.53  48.96  302.21  52.52  20.32   71.80  
1 1 1 6   4   1  o 18 116.36  12.08  394.99    79.49    411.19   112.27   378.71    112.57   117.83  17.10  112.80  17.99  5.03    24.82  
1 1 1 6   4   2  o 18 535.42  62.76  9580.84   1892.46  9919.25  2676.31  9242.41   2676.36  500.68  96.61  476.43  101.00 24.25   139.77 
1 1 1 6   4   3  o 13 342.04  36.41  3570.59   703.97   3582.06  995.52   3559.11   995.62   331.32  54.21  330.08  54.44  1.24    76.83  
1 1 1 6   4   4  o 9  148.57  15.43  646.44    129.71   679.36   184.08   613.98    182.79   150.89  21.89  143.01  23.05  7.88    31.79  
1 1 1 6   4   5  o 13 203.99  21.18  1229.47   244.38   1294.69  345.91   1164.47   345.31   206.55  30.05  195.02  31.95  11.53   43.86  
1 1 1 6   4   6  o 13 266.83  42.30  2244.23   626.34   0.00     0.00     2244.23   626.34   ?       ?      266.83  42.30  0.00    42.30  
1 1 1 6   4   7  o 11 413.72  75.90  6231.21   1736.33  0.00     0.00     6231.21   1736.33  ?       ?      413.72  75.90  0.00    75.90  
1 1 1 6   4   8  o 14 201.60  31.00  1240.64   347.25   0.00     0.00     1240.64   347.25   ?       ?      201.60  31.00  0.00    31.00  
1 1 1 6   4   9  o 14 280.91  29.70  2376.54   471.72   2562.04  667.41   2191.37   666.81   285.48  41.98  261.36  46.13  24.12   62.37  
1 1 1 6   4   10 o 3  326.94  34.87  3256.44   644.33   3408.48  911.34   3104.48   911.09   324.86  50.51  307.76  53.51  17.11   73.58  
1 1 1 6   4   11 o 19 340.18  36.12  3525.62   694.62   3449.12  982.23   3602.15   982.44   325.07  54.57  333.34  53.12  -8.27   76.15  
1 1 1 6   4   12 o 2  204.33  21.21  1229.93   245.14   1254.24  346.59   1205.59   346.77   203.65  30.59  199.34  31.34  4.31    43.79  
1 1 1 6   4   13 o 4  362.81  59.01  4254.27   1186.80  4254.27  1186.80  0.00      0.00     362.81  59.01  ?       ?      0.00    59.01  
1 1 1 6   4   14 o 11 362.62  58.00  4181.94   1166.73  4181.94  1166.73  0.00      0.00     362.62  58.00  ?       ?      0.00    58.00  
1 1 1 6   4   15 o 6  450.60  75.27  6737.94   1878.33  6737.94  1878.33  0.00      0.00     450.60  75.27  ?       ?      0.00    75.27  
1 1 1 6   4   16 o 8  226.74  23.45  1511.19   300.83   1457.21  424.53   1565.64   426.34   219.57  34.84  228.15  33.55  -8.58   48.37  
1 1 1 6   4   17 o 16 246.92  25.63  1800.67   358.03   1757.00  505.82   1844.52   506.86   239.97  37.98  246.35  36.98  -6.38   53.01  
1 1 1 6   4   18 o 16 324.28  34.23  3174.83   627.59   3108.49  887.12   3241.31   887.96   311.74  51.36  319.21  50.11  -7.47   71.75  
1 1 1 6   4   19 o 11 206.02  32.31  1297.56   369.60   1297.56  369.60   0.00      0.00     206.02  32.31  ?       ?      0.00    32.31  
1 1 1 6   4   20 o 11 225.74  35.68  1570.64   447.04   0.00     0.00     1570.64   447.04   ?       ?      225.74  35.68  0.00    35.68  
1 1 1 6   4   21 o 5  103.40  15.98  317.04    91.81    296.33   129.65   337.88    130.02   98.62   23.28  105.56  22.16  -6.95   32.14  
1 1 1 6   4   22 o 15 49.48   17.74  60.60     64.02    67.73    90.48    53.45     90.59    55.58   20.90  53.29   20.69  2.29    29.41  
1 1 1 6   4   23 o 13 350.27  38.98  3890.49   770.47   3833.47  1089.61  3947.51   1089.60  327.86  60.11  333.98  58.99  -6.12   84.22  
1 1 1 6   4   24 o 9  291.94  52.96  3041.71   854.81   0.00     0.00     3041.71   854.81   ?       ?      291.94  52.96  0.00    52.96  
1 1 1 6   4   25 o 15 160.84  27.78  815.42    247.20   0.00     0.00     815.42    247.20   ?       ?      160.84  27.78  0.00    27.78  
1 1 1 6   4   26 o 13 172.76  32.34  984.64    308.96   0.00     0.00     984.64    308.96   ?       ?      172.76  32.34  0.00    32.34  
1 1 1 6   4   27 o 3  57.28   20.44  89.26     84.80    121.52   105.34   29.85     142.94   65.15   22.82  58.36   24.70  6.79    33.63  
1 1 1 6   4   28 o 1  121.39  19.16  458.70    129.13   371.82   173.28   567.18    193.64   104.84  28.19  130.95  26.67  -26.11  38.80  
1 1 1 6   4   29 o 11 161.53  31.86  920.50    284.93   920.50   284.93   0.00      0.00     161.53  31.86  ?       ?      0.00    31.86  
1 1 1 6   4   30 o 12 57.20   23.74  56.05     128.11   56.05    128.11   0.00      0.00     57.20   23.74  ?       ?      0.00    23.74  
1 1 1 6   4   31 o 3  62.61   25.60  91.53     145.93   91.53    145.93   0.00      0.00     62.61   25.60  ?       ?      0.00    25.60  
1 1 1 6   5   0  o 5  303.50  32.07  2781.16   550.29   2979.69  778.33   2582.72   778.14   307.00  45.54  283.04  49.70  23.96   67.41  
1 1 1 6   5   1  o 10 426.80  47.07  5755.43   1134.04  5764.57  1603.77  5746.30   1603.77  404.54  71.68  403.73  71.83  0.80    101.48 
1 1 1 6   5   2  o 8  153.15  23.20  702.73    197.59   0.00     0.00     702.73    197.59   ?       ?      153.15  23.20  0.00    23.20  
1 1 1 6   5   3  o 7  232.09  36.01  1662.20   464.24   0.00     0.00     1662.20   464.24   ?       ?      232.09  36.01  0.00    36.01  
1 1 1 6   5   4  o 5  174.54  26.57  919.20    257.80   0.00     0.00     919.20    257.80   ?       ?      174.54  26.57  0.00    26.57  
1 1 1 6   5   5  o 11 84.66   13.46  212.32    63.21    0.00     0.00     212.32    63.21    ?       ?      84.66   13.46  0.00    13.46  
1 1 1 6   5   6  o 15 190.41  29.14  1100.90   308.42   0.00     0.00     1100.90   308.42   ?       ?      190.41  29.14  0.00    29.14  
1 1 1 6   5   7  o 12 204.82  31.52  1281.50   358.78   0.00     0.00     1281.50   358.78   ?       ?      204.82  31.52  0.00    31.52  
1 1 1 6   5   8  o 16 300.35  31.74  2727.16   538.98   2778.03  762.21   2676.28   762.25   295.07  46.54  288.86  47.63  6.21    66.59  
1 1 1 6   5   9  o 3  143.79  15.10  605.45    122.82   663.03   174.32   548.70    173.07   149.27  20.92  134.99  23.17  14.28   31.21  
1 1 1 6   5   10 o 1  429.21  47.00  5792.23   1139.05  5643.14  1610.71  5941.37   1611.02  401.10  72.62  414.10  70.28  -12.99  101.06 
1 1 1 6   5   11 o 14 78.41   10.76  180.46    47.17    181.30   67.33    179.64    66.09    77.78   15.62  77.45   15.41  0.33    21.94  
1 1 1 6   5   12 o 1  289.56  45.39  2611.10   729.70   2611.10  729.70   0.00      0.00     289.56  45.39  ?       ?      0.00    45.39  
1 1 1 6   5   13 o 17 466.17  80.40  7440.76   2073.89  7440.76  2073.89  0.00      0.00     466.17  80.40  ?       ?      0.00    80.40  
1 1 1 6   5   14 o 3  216.88  33.01  1415.68   398.07   1415.68  398.07   0.00      0.00     216.88  33.01  ?       ?      0.00    33.01  
1 1 1 6   5   15 o 4  331.13  34.64  3272.70   648.78   3413.93  917.44   3131.42   917.58   331.90  49.68  316.37  52.35  15.53   72.17  
1 1 1 6   5   16 o 16 507.87  55.54  8084.84   1592.81  8027.72  2252.43  8141.97   2252.71  481.17  84.63  485.36  83.88  -4.19   119.16 
1 1 1 6   5   17 o 3  388.29  41.47  4614.12   910.15   4557.69  1286.96  4670.58   1287.34  372.13  62.45  377.48  61.52  -5.35   87.67  
1 1 1 6   5   18 o 14 342.61  36.64  3582.29   709.42   3721.90  1003.32  3442.71   1003.22  338.68  53.37  323.67  56.02  15.01   77.37  
1 1 1 6   5   19 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   5   20 o 16 418.30  46.05  5506.69   1087.44  5492.78  1537.73  5520.60   1538.02  396.44  70.13  397.67  69.92  -1.23   99.04  
1 1 1 6   5   21 o 16 110.98  16.35  364.91    101.07   339.36   139.06   393.50    147.14   105.50  23.56  113.81  23.31  -8.31   33.14  
1 1 1 6   5   22 o 19 243.48  26.00  1779.88   357.79   1791.69  505.80   1768.04   506.19   238.51  38.23  236.72  38.58  1.79    54.31  
1 1 1 6   5   23 o 12 251.92  27.30  1936.24   388.48   1943.04  549.25   1929.44   549.53   244.13  40.62  243.11  40.82  1.01    57.59  
1 1 1 6   5   24 o 9  354.62  80.63  5739.34   1604.15  0.00     0.00     5739.34   1604.15  ?       ?      354.62  80.63  0.00    80.63  
1 1 1 6   5   25 o 17 179.83  31.05  1042.86   308.94   0.00     0.00     1042.86   308.94   ?       ?      179.83  31.05  0.00    31.05  
1 1 1 6   5   26 o 19 204.01  37.93  1443.58   427.90   0.00     0.00     1443.58   427.90   ?       ?      204.01  37.93  0.00    37.93  
1 1 1 6   5   27 o 16 200.07  24.06  1268.37   270.80   1166.14  379.11   1374.87   386.94   179.94  37.90  198.50  35.25  -18.56  51.76  
1 1 1 6   5   28 o 8  125.07  19.69  490.62    136.69   409.52   185.65   586.64    202.00   109.01  29.12  132.10  27.53  -23.08  40.07  
1 1 1 6   5   29 o 18 192.42  39.64  1448.54   423.32   1448.54  423.32   0.00      0.00     192.42  39.64  ?       ?      0.00    39.64  
1 1 1 6   5   30 o 5  76.56   25.65  198.68    132.75   198.68   132.75   0.00      0.00     76.56   25.65  ?       ?      0.00    25.65  
1 1 1 6   5   31 o 12 42.25   20.26  -151.30   141.24   -151.30  141.24   0.00      0.00     42.25   20.26  ?       ?      0.00    20.26  
1 1 1 6   6   0  o 16 165.64  25.09  823.45    231.11   0.00     0.00     823.45    231.11   ?       ?      165.64  25.09  0.00    25.09  
1 1 1 6   6   1  o 18 297.47  47.65  2818.97   786.21   0.00     0.00     2818.97   786.21   ?       ?      297.47  47.65  0.00    47.65  
1 1 1 6   6   2  o 11 296.35  47.52  2800.47   781.18   0.00     0.00     2800.47   781.18   ?       ?      296.35  47.52  0.00    47.52  
1 1 1 6   6   3  f 0  134.23  20.40  537.32    152.29   0.00     0.00     537.32    152.29   ?       ?      134.23  20.40  0.00    20.40  
1 1 1 6   6   4  o 17 95.04   10.39  263.48    55.75    273.44   79.69    253.92    78.03    96.06   14.94  92.43   15.23  3.62    21.34  
1 1 1 6   6   5  o 11 76.30   9.00   169.95    38.67    201.16   55.67    140.85    53.76    82.61   12.10  68.53   14.13  14.08   18.60  
1 1 1 6   6   6  o 8  12.29   5.98   -24.53    13.56    -73.78   16.50    77.94     23.79    ?       ?      51.38   8.35   0.00    8.35   
1 1 1 6   6   7  o 12 371.23  39.23  4235.48   823.44   3627.43  1164.09  4844.44   1164.95  325.90  64.50  386.57  53.96  -60.67  84.10  
1 1 1 6   6   8  o 13 294.41  30.80  2603.45   512.79   2540.13  724.93   2666.86   725.45   283.31  46.16  291.16  44.84  -7.84   64.35  
1 1 1 6   6   9  o 16 347.28  57.03  3934.36   1097.54  0.00     0.00     3934.36   1097.54  ?       ?      347.28  57.03  0.00    57.03  
1 1 1 6   6   10 o 17 97.93   16.49  285.20    89.42    285.20   89.42    0.00      0.00     97.93   16.49  ?       ?      0.00    16.49  
1 1 1 6   6   11 o 15 444.56  76.60  6761.77   1884.43  6761.77  1884.43  0.00      0.00     444.56  76.60  ?       ?      0.00    76.60  
1 1 1 6   6   12 o 14 159.67  24.39  759.50    216.46   759.50   216.46   0.00      0.00     159.67  24.39  ?       ?      0.00    24.39  
1 1 1 6   6   13 o 7  153.84  23.68  704.10    202.41   704.10   202.41   0.00      0.00     153.84  23.68  ?       ?      0.00    23.68  
1 1 1 6   6   14 f 0  441.42  46.97  5952.62   1172.07  5859.73  1657.44  6045.54   1657.68  422.66  70.81  430.41  69.45  -7.75   99.19  
1 1 1 6   6   15 o 2  637.25  73.58  13416.85  2642.34  13371.32 3736.76  13462.39  3736.91  584.76  115.41 587.49  114.92 -2.73   162.87 
1 1 1 6   6   16 o 11 273.55  28.61  2224.65   442.71   2297.45  626.11   2151.87   626.07   273.22  41.20  263.56  42.85  9.66    59.44  
1 1 1 6   6   17 o 17 183.88  28.78  1022.43   293.83   0.00     0.00     1022.43   293.83   ?       ?      183.88  28.78  0.00    28.78  
1 1 1 6   6   18 o 17 134.47  22.82  544.44    169.84   544.44   169.84   0.00      0.00     134.47  22.82  ?       ?      0.00    22.82  
1 1 1 6   6   19 o 3  93.40   21.12  265.01    110.55   0.00     0.00     265.01    110.55   ?       ?      93.40   21.12  0.00    21.12  
1 1 1 6   6   20 o 17 257.73  27.29  1985.68   397.60   1962.88  562.00   2008.53   562.59   250.53  40.45  253.73  39.94  -3.20   56.85  
1 1 1 6   6   21 o 3  233.63  24.88  1628.69   328.61   1614.16  463.72   1643.35   465.75   227.70  36.73  229.88  36.51  -2.19   51.79  
1 1 1 6   6   22 o 18 160.38  18.29  762.71    165.37   781.86   231.49   742.75    236.31   159.87  26.12  155.24  27.52  4.64    37.95  
1 1 1 6   6   23 o 18 270.13  29.60  2264.30   451.52   2110.98  637.50   2418.63   639.61   247.97  46.49  268.98  42.86  -21.01  63.23  
1 1 1 6   6   24 o 3  232.07  40.54  1820.68   520.43   0.00     0.00     1820.68   520.43   ?       ?      232.07  40.54  0.00    40.54  
1 1 1 6   6   25 o 13 95.15   24.39  288.32    133.83   0.00     0.00     288.32    133.83   ?       ?      95.15   24.39  0.00    24.39  
1 1 1 6   6   26 f 0  148.63  28.85  728.11    237.31   0.00     0.00     728.11    237.31   ?       ?      148.63  28.85  0.00    28.85  
1 1 1 6   6   27 o 17 160.56  20.26  802.72    182.58   815.52   261.85   790.61    254.71   154.64  30.58  152.53  30.16  2.11    42.95  
1 1 1 6   6   28 o 1  60.10   21.66  102.33    95.57    150.56   145.65   65.86     126.65   71.68   26.60  58.83   23.92  12.85   35.77  
1 1 1 6   6   29 o 6  91.30   29.18  296.58    172.67   296.58   172.67   0.00      0.00     91.30   29.18  ?       ?      0.00    29.18  
1 1 1 6   6   30 o 7  90.77   30.04  309.32    182.17   309.32   182.17   0.00      0.00     90.77   30.04  ?       ?      0.00    30.04  
1 1 1 6   7   0  o 16 284.09  29.64  2405.86   476.28   2523.36  673.57   2288.38   673.56   285.79  42.34  270.74  44.91  15.05   61.72  
1 1 1 6   7   1  o 9  208.00  21.48  1273.86   252.77   1258.20  357.16   1289.58   357.78   203.84  31.54  206.54  31.14  -2.70   44.32  
1 1 1 6   7   2  o 3  203.94  21.09  1224.42   243.38   1249.84  343.58   1198.82   344.80   203.45  30.35  198.89  31.23  4.56    43.54  
1 1 1 6   7   3  o 3  111.31  12.07  361.60    75.89    387.69   105.89   334.05    108.81   114.52  16.59  105.74  18.61  8.78    24.93  
1 1 1 6   7   4  o 16 469.80  51.96  6998.13   1377.99  6920.75  1948.52  7075.55   1949.01  440.77  79.95  446.94  78.84  -6.17   112.29 
1 1 1 6   7   5  o 4  291.60  30.43  2544.31   501.84   2497.49  709.11   2591.30   710.31   282.19  45.31  288.01  44.38  -5.82   63.42  
1 1 1 6   7   6  o 1  12.28   4.74   2.75      4.74     2.75     4.74     0.00      0.00     12.28   4.74   ?       ?      0.00    4.74   
1 1 1 6   7   7  o 3  409.77  69.80  5680.61   1583.19  5680.61  1583.19  0.00      0.00     409.77  69.80  ?       ?      0.00    69.80  
1 1 1 6   7   8  o 11 327.59  52.28  3405.52   950.14   3405.52  950.14   0.00      0.00     327.59  52.28  ?       ?      0.00    52.28  
1 1 1 6   7   9  o 13 433.14  73.53  6325.48   1763.01  6325.48  1763.01  0.00      0.00     433.14  73.53  ?       ?      0.00    73.53  
1 1 1 6   7   10 o 14 590.13  117.77 13820.82  3849.87  13820.82 3849.87  0.00      0.00     590.13  117.77 ?       ?      0.00    117.77 
1 1 1 6   7   11 o 14 129.55  20.61  498.50    148.15   498.50   148.15   0.00      0.00     129.55  20.61  ?       ?      0.00    20.61  
1 1 1 6   7   12 f 0  268.14  27.92  2124.04   423.43   2237.82  598.86   2010.28   598.77   271.60  39.57  256.24  42.17  15.36   57.83  
1 1 1 6   7   13 o 1  799.64  101.51 23134.47  4554.70  23073.23 6441.19  23195.72  6441.45  687.20  165.30 690.14  164.85 -2.94   233.46 
1 1 1 6   7   14 o 17 270.09  28.23  2160.00   431.19   2282.08  609.57   2037.73   610.03   273.69  39.98  257.28  42.81  16.41   58.57  
1 1 1 6   7   15 o 19 392.49  41.79  4707.96   927.12   4624.74  1310.77  4791.27   1311.51  375.25  63.08  383.05  61.74  -7.79   88.27  
1 1 1 6   7   16 o 8  327.63  34.57  3250.46   640.47   3147.86  905.31   3353.26   906.22   312.42  52.33  323.89  50.38  -11.47  72.63  
1 1 1 6   7   17 o 11 333.64  35.60  3402.17   671.37   3327.32  949.01   3477.18   949.92   318.18  53.88  326.42  52.47  -8.24   75.21  
1 1 1 6   7   18 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   7   19 o 13 129.19  16.11  491.54    116.88   433.32   165.71   549.18    164.88   119.20  25.02  135.33  21.98  -16.13  33.30  
1 1 1 6   7   20 o 4  179.72  19.91  954.57    201.96   988.20   285.92   921.07    285.31   180.29  28.58  173.55  29.70  6.74    41.22  
1 1 1 6   7   21 o 18 98.87   15.58  291.09    85.49    232.20   125.57   341.96    116.71   87.15   24.23  106.34  19.85  -19.19  31.32  
1 1 1 6   7   22 o 8  152.44  26.27  718.34    221.59   0.00     0.00     718.34    221.59   ?       ?      152.44  26.27  0.00    26.27  
1 1 1 6   7   23 o 8  74.79   22.34  170.77    103.27   0.00     0.00     170.77    103.27   ?       ?      74.79   22.34  0.00    22.34  
1 1 1 6   7   24 o 19 176.50  30.95  1007.99   302.13   0.00     0.00     1007.99   302.13   ?       ?      176.50  30.95  0.00    30.95  
1 1 1 6   7   25 o 10 198.11  36.61  1353.09   400.99   0.00     0.00     1353.09   400.99   ?       ?      198.11  36.61  0.00    36.61  
1 1 1 6   7   26 o 8  71.13   22.36  158.21    101.73   92.31    142.13   227.44    145.68   64.83   25.69  83.82   26.80  -18.99  37.13  
1 1 1 6   7   27 o 16 115.58  19.91  421.84    127.35   455.95   180.38   387.95    179.83   115.87  27.53  106.04  28.80  9.83    39.84  
1 1 1 6   7   28 o 2  97.75   20.61  309.56    112.01   231.17   170.84   368.67    148.33   82.90   29.06  104.33  25.08  -21.42  38.38  
1 1 1 6   7   29 o 2  71.43   27.83  152.00    164.37   152.00   164.37   0.00      0.00     71.43   27.83  ?       ?      0.00    27.83  
1 1 1 6   7   30 o 14 91.95   31.00  331.15    193.90   331.15   193.90   0.00      0.00     91.95   31.00  ?       ?      0.00    31.00  
1 1 1 6   8   0  o 8  413.18  67.14  5516.91   1537.79  5516.91  1537.79  0.00      0.00     413.18  67.14  ?       ?      0.00    67.14  
1 1 1 6   8   1  o 12 559.36  103.78 11522.53  3209.77  11522.53 3209.77  0.00      0.00     559.36  103.78 ?       ?      0.00    103.78 
1 1 1 6   8   2  o 11 113.51  18.31  382.24    115.24   382.24   115.24   0.00      0.00     113.51  18.31  ?       ?      0.00    18.31  
1 1 1 6   8   3  o 15 208.18  31.63  1303.62   366.15   1303.62  366.15   0.00      0.00     208.18  31.63  ?       ?      0.00    31.63  
1 1 1 6   8   4  o 14 263.33  40.44  2118.66   591.79   2118.66  591.79   0.00      0.00     263.33  40.44  ?       ?      0.00    40.44  
1 1 1 6   8   5  o 12 17.10   8.60   -117.35   38.03    -117.35  38.03    0.00      0.00     17.10   8.60   ?       ?      0.00    8.60   
1 1 1 6   8   6  o 11 229.06  34.79  1584.93   443.15   1584.93  443.15   0.00      0.00     229.06  34.79  ?       ?      0.00    34.79  
1 1 1 6   8   7  o 1  408.38  66.64  5412.03   1508.55  5412.03  1508.55  0.00      0.00     408.38  66.64  ?       ?      0.00    66.64  
1 1 1 6   8   8  o 9  471.61  50.52  6842.99   1346.55  6703.06  1904.00  6983.01   1904.61  448.30  76.74  459.27  74.81  -10.96  107.17 
1 1 1 6   8   9  o 15 419.32  44.24  5331.80   1048.79  5185.32  1482.97  5478.38   1483.44  400.46  66.86  413.28  64.64  -12.82  93.00  
1 1 1 6   8   10 o 18 158.40  16.66  732.68    149.20   748.61   210.01   716.45    211.99   158.77  23.77  155.06  24.64  3.71    34.24  
1 1 1 6   8   11 o 17 586.24  65.34  10965.07  2161.69  11028.12 3056.98  10902.01  3057.21  553.73  99.84  549.67  100.59 4.07    141.73 
1 1 1 6   8   12 o 17 464.83  49.93  6652.42   1311.56  6657.07  1854.62  6647.78   1855.03  447.30  74.87  446.91  74.96  0.39    105.94 
1 1 1 6   8   13 o 2  260.05  27.03  2000.96   397.65   2020.35  562.09   1981.53   562.64   257.20  39.32  254.48  39.82  2.72    55.96  
1 1 1 6   8   14 o 3  150.11  16.29  659.99    138.14   670.32   195.03   649.59    195.69   149.74  23.46  147.23  23.98  2.51    33.54  
1 1 1 6   8   15 o 13 506.73  58.11  8409.44   1659.78  8479.41  2347.07  8339.45   2347.50  471.50  89.99  466.21  90.98  5.29    127.97 
1 1 1 6   8   16 o 5  219.42  23.20  1428.91   287.83   1448.17  406.66   1409.57   407.45   217.12  33.72  213.90  34.34  3.22    48.13  
1 1 1 6   8   17 o 5  192.56  30.50  1131.01   325.93   1131.01  325.93   0.00      0.00     192.56  30.50  ?       ?      0.00    30.50  
1 1 1 6   8   18 o 12 408.92  73.73  5969.08   1667.20  0.00     0.00     5969.08   1667.20  ?       ?      408.92  73.73  0.00    73.73  
1 1 1 6   8   19 f 0  238.65  25.47  1699.55   343.52   1751.51  484.77   1647.15   486.86   237.67  36.71  229.62  38.28  8.04    53.04  
1 1 1 6   8   20 o 7  208.72  22.75  1300.00   268.14   1434.35  378.50   1164.64   379.92   215.82  31.48  192.23  35.74  23.59   47.63  
1 1 1 6   8   21 o 3  60.84   17.69  110.93    65.46    56.76    89.55    173.10    95.93    53.33   20.61  75.37   21.26  -22.05  29.61  
1 1 1 6   8   22 o 7  275.55  50.02  2704.98   762.10   0.00     0.00     2704.98   762.10   ?       ?      275.55  50.02  0.00    50.02  
1 1 1 6   8   23 o 14 93.83   23.27  277.09    124.73   0.00     0.00     277.09    124.73   ?       ?      93.83   23.27  0.00    23.27  
1 1 1 6   8   24 o 12 159.34  31.49  840.79    277.82   0.00     0.00     840.79    277.82   ?       ?      159.34  31.49  0.00    31.49  
1 1 1 6   8   25 o 7  105.81  22.52  357.91    132.58   377.23   193.68   340.88    181.87   105.39  30.36  100.64  29.55  4.75    42.37  
1 1 1 6   8   26 o 1  61.26   23.33  94.89     113.66   129.93   175.24   69.45     149.34   72.23   28.56  62.72   25.80  9.50    38.48  
1 1 1 6   8   27 o 9  47.94   21.20  -14.23    115.03   -96.37   181.72   40.68     148.59   53.58   24.83  59.03   25.10  -5.45   35.31  
1 1 1 6   8   28 o 15 58.91   26.46  -14.65    186.32   -14.65   186.32   0.00      0.00     58.91   26.46  ?       ?      0.00    26.46  
1 1 1 6   8   29 o 4  82.25   31.69  245.66    211.34   245.66   211.34   0.00      0.00     82.25   31.69  ?       ?      0.00    31.69  
1 1 1 6   8   30 o 17 67.85   28.89  114.89    197.48   114.89   197.48   0.00      0.00     67.85   28.89  ?       ?      0.00    28.89  
1 1 1 6   9   0  f 0  387.29  40.30  4481.82   882.99   4279.33  1248.47  4684.47   1249.01  369.35  61.01  388.39  57.78  -19.04  84.02  
1 1 1 6   9   1  o 17 450.16  47.39  6131.12   1206.41  5793.21  1705.89  6469.21   1706.34  423.45  72.80  450.98  68.02  -27.53  99.63  
1 1 1 6   9   2  o 14 240.12  36.47  1734.60   487.00   0.00     0.00     1734.60   487.00   ?       ?      240.12  36.47  0.00    36.47  
1 1 1 6   9   3  o 19 642.61  71.94  13230.80  2608.32  13391.34 3688.61  13070.24  3688.83  607.85  109.74 598.40  111.48 9.45    156.44 
1 1 1 6   9   4  o 17 596.08  65.56  11217.31  2206.51  10994.75 3120.31  11439.91  3120.65  557.67  101.19 571.66  98.66  -14.00  141.33 
1 1 1 6   9   5  o 18 501.22  48.75  7636.29   1384.95  1.23     1956.69  15301.53  1960.55  196.71  87.21  711.21  48.31  -514.50 99.69  
1 1 1 6   9   6  o 8  113.95  12.66  378.55    81.43    388.53   111.66   367.21    119.01   114.68  17.52  111.09  19.37  3.59    26.11  
1 1 1 6   9   7  o 17 591.16  65.00  11054.60  2169.51  10563.43 3067.87  11545.95  3068.42  543.58  102.06 574.77  96.41  -31.19  140.39 
1 1 1 6   9   8  o 19 281.52  28.99  2341.11   461.81   2231.44  652.10   2451.45   654.09   270.11  43.53  284.20  41.30  -14.09  60.01  
1 1 1 6   9   9  o 4  352.51  36.56  3714.18   729.18   3478.27  1030.42  3950.83   1032.02  332.49  55.97  356.87  51.89  -24.38  76.33  
1 1 1 6   9   10 f 0  727.85  88.00  18271.74  3602.33  18448.72 5094.31  18094.74  5094.62  654.34  139.86 644.92  141.50 9.41    198.96 
1 1 1 6   9   11 o 19 247.23  25.55  1804.25   357.39   1758.30  504.85   1850.41   506.01   240.19  37.87  246.89  36.83  -6.70   52.82  
1 1 1 6   9   12 o 2  432.02  46.58  5784.85   1137.08  5613.80  1607.72  5956.05   1608.43  406.50  71.50  421.19  68.90  -14.69  99.30  
1 1 1 6   9   13 o 10 247.43  25.80  1818.13   361.02   1793.92  510.04   1842.43   511.10   241.19  38.10  244.71  37.58  -3.52   53.52  
1 1 1 6   9   14 o 2  324.61  34.41  3202.65   631.43   3116.75  892.48   3288.74   893.47   309.71  52.04  319.41  50.40  -9.70   72.44  
1 1 1 6   9   15 o 18 202.10  21.38  1208.17   244.26   1195.63  344.28   1220.88   346.60   197.79  31.37  199.96  31.21  -2.18   44.25  
1 1 1 6   9   16 o 8  210.20  22.37  1308.58   265.79   1332.39  374.75   1284.48   377.02   208.78  32.31  204.56  33.25  4.22    46.36  
1 1 1 6   9   17 x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   9   18 o 14 202.17  21.96  1212.07   250.73   1243.65  354.99   1180.63   354.19   201.47  31.74  195.85  32.65  5.62    45.54  
1 1 1 6   9   19 o 5  333.26  36.75  3463.41   691.46   3605.50  977.51   3321.11   978.22   326.00  54.13  310.06  57.06  15.94   78.65  
1 1 1 6   9   20 o 5  165.20  18.83  813.02    175.42   871.91   249.22   755.19    246.96   168.25  26.69  155.54  28.72  12.71   39.21  
1 1 1 6   9   21 o 16 109.45  23.01  372.23    139.98   0.00     0.00     372.23    139.98   ?       ?      109.45  23.01  0.00    23.01  
1 1 1 6   9   22 o 8  185.73  32.12  1117.91   330.08   0.00     0.00     1117.91   330.08   ?       ?      185.73  32.12  0.00    32.12  
1 1 1 6   9   23 o 18 120.49  24.64  461.82    164.66   0.00     0.00     461.82    164.66   ?       ?      120.49  24.64  0.00    24.64  
1 1 1 6   9   24 o 17 104.94  19.61  343.76    113.81   241.87   150.09   481.58    174.56   86.46   27.15  121.62  25.80  -35.15  37.46  
1 1 1 6   9   25 o 18 233.20  27.82  1795.93   365.13   1669.82  510.98   1927.49   521.92   204.98  44.69  224.41  42.06  -19.44  61.37  
1 1 1 6   9   26 o 3  114.60  20.19  418.48    128.00   415.60   170.59   422.18    193.65   110.09  27.16  109.18  29.98  0.90    40.46  
1 1 1 6   9   27 f 0  151.16  32.27  840.20    271.53   840.20   271.53   0.00      0.00     151.16  32.27  ?       ?      0.00    32.27  
1 1 1 6   9   28 o 16 177.78  43.94  1456.56   445.88   1456.56  445.88   0.00      0.00     177.78  43.94  ?       ?      0.00    43.94  
1 1 1 6   9   29 o 14 85.77   32.20  293.67    214.74   293.67   214.74   0.00      0.00     85.77   32.20  ?       ?      0.00    32.20  
1 1 1 6   10  0  o 6  246.09  25.31  1779.88   352.51   1538.33  497.77   2022.90   499.30   224.62  40.07  260.16  34.26  -35.54  52.72  
1 1 1 6   10  1  f 0  325.02  33.63  3135.13   618.45   2950.33  874.29   3320.21   874.95   308.76  51.11  329.40  47.65  -20.63  69.88  
1 1 1 6   10  2  o 7  697.11  80.00  15966.45  3143.44  15781.76 4445.39  16151.15  4445.59  638.54  125.75 648.65  123.90 -10.11  176.54 
1 1 1 6   10  3  o 13 235.09  24.28  1622.87   322.94   1613.57  455.70   1632.25   457.71   231.56  35.40  232.94  35.34  -1.38   50.02  
1 1 1 6   10  4  o 11 506.52  50.64  7844.39   1452.74  930.35   2052.72  14782.19  2056.25  223.06  93.98  695.65  51.86  -472.59 107.34 
1 1 1 6   10  5  o 5  142.01  14.86  588.02    119.36   45.87    163.84   1201.04   174.22   66.13   27.09  203.49  15.02  -137.36 30.97  
1 1 1 6   10  6  o 16 142.63  15.34  593.85    123.64   542.21   173.43   647.22    176.32   134.72  23.26  147.88  21.39  -13.16  31.60  
1 1 1 6   10  7  o 3  501.78  54.59  7844.12   1547.28  7912.19  2188.02  7776.02   2188.36  481.78  82.05  476.71  82.98  5.07    116.69 
1 1 1 6   10  8  o 6  347.61  36.41  3630.30   715.73   3559.95  1011.72  3700.78   1012.67  335.41  54.41  342.78  53.19  -7.37   76.08  
1 1 1 6   10  9  o 11 334.95  34.93  3372.61   661.83   3117.74  935.04   3628.49   936.90   312.49  54.08  340.30  49.40  -27.81  73.25  
1 1 1 6   10  10 o 19 304.53  48.54  2926.27   820.09   0.00     0.00     2926.27   820.09   ?       ?      304.53  48.54  0.00    48.54  
1 1 1 6   10  11 o 16 327.92  34.37  3252.61   637.48   2977.10  900.15   3529.82   902.91   302.96  53.72  333.77  48.55  -30.81  72.41  
1 1 1 6   10  12 o 11 359.80  38.30  3971.89   778.89   3727.39  1100.98  4216.88   1102.06  334.04  59.60  359.14  55.22  -25.10  81.25  
1 1 1 6   10  13 o 2  232.31  24.44  1603.86   321.04   1607.74  452.94   1599.96   455.10   228.35  35.72  227.66  36.02  0.69    50.73  
1 1 1 6   10  14 o 10 247.64  25.96  1827.10   363.60   1766.51  512.98   1888.27   515.45   238.28  38.84  247.12  37.51  -8.85   54.00  
1 1 1 6   10  15 o 17 333.97  35.79  3399.85   675.43   3468.40  954.50   3331.10   955.91   326.93  52.65  319.29  54.08  7.63    75.47  
1 1 1 6   10  16 o 6  447.19  85.81  7609.57   2122.84  7609.57  2122.84  0.00      0.00     447.19  85.81  ?       ?      0.00    85.81  
1 1 1 6   10  17 o 19 184.63  29.95  1043.29   306.55   0.00     0.00     1043.29   306.55   ?       ?      184.63  29.95  0.00    29.95  
1 1 1 6   10  18 o 11 178.16  29.25  979.25    288.82   0.00     0.00     979.25    288.82   ?       ?      178.16  29.25  0.00    29.25  
1 1 1 6   10  19 o 16 140.44  25.07  608.60    194.69   0.00     0.00     608.60    194.69   ?       ?      140.44  25.07  0.00    25.07  
1 1 1 6   10  20 o 14 122.04  23.85  463.19    161.09   0.00     0.00     463.19    161.09   ?       ?      122.04  23.85  0.00    23.85  
1 1 1 6   10  21 o 4  228.47  40.26  1782.40   508.80   0.00     0.00     1782.40   508.80   ?       ?      228.47  40.26  0.00    40.26  
1 1 1 6   10  22 o 8  173.70  20.16  920.72    197.25   949.62   278.37   891.58    279.54   171.07  29.41  164.84  30.67  6.23    42.49  
1 1 1 6   10  23 o 11 144.47  19.49  643.21    157.55   588.95   216.44   704.36    229.78   132.81  29.19  146.08  28.42  -13.27  40.74  
1 1 1 6   10  24 o 8  76.92   22.54  190.44    105.94   212.46   142.62   163.32    158.25   81.03   26.57  74.88   27.74  6.15    38.41  
1 1 1 6   10  25 o 8  131.49  20.47  549.10    149.47   492.77   205.58   612.27    217.71   118.04  30.21  132.69  29.36  -14.65  42.13  
1 1 1 6   10  26 o 2  63.29   24.65  104.61    128.88   104.61   128.88   0.00      0.00     63.29   24.65  ?       ?      0.00    24.65  
1 1 1 6   10  27 o 4  167.11  36.82  1130.39   343.71   1130.39  343.71   0.00      0.00     167.11  36.82  ?       ?      0.00    36.82  
1 1 1 6   10  28 o 15 58.66   24.42  74.51     136.17   74.51    136.17   0.00      0.00     58.66   24.42  ?       ?      0.00    24.42  
1 1 1 6   11  0  o 8  180.78  19.21  958.51    196.28   1003.19  277.63   913.87    277.52   183.10  27.24  174.20  28.75  8.90    39.61  
1 1 1 6   11  1  o 15 344.05  36.21  3562.53   704.52   3617.12  996.11   3507.88   996.56   338.21  53.05  332.39  54.08  5.82    75.76  
1 1 1 6   11  2  o 7  140.51  15.51  577.46    123.01   595.14   172.54   559.19    175.42   141.39  21.97  136.70  23.18  4.70    31.94  
1 1 1 6   11  3  o 12 382.87  40.66  4457.23   880.10   4477.14  1244.41  4437.31   1244.88  371.94  60.35  370.01  60.71  1.93    85.60  
1 1 1 6   11  4  o 2  435.65  43.74  5813.92   1079.19  2.54     1523.41  11668.04  1529.00  171.91  76.54  618.75  43.32  -446.85 87.94  
1 1 1 6   11  5  o 9  441.01  47.69  6037.69   1188.28  5869.99  1679.94  6205.60   1681.02  415.00  73.19  429.11  70.70  -14.10  101.76 
1 1 1 6   11  6  o 7  255.23  26.44  1932.01   381.81   1763.94  538.48   2101.94   541.45   238.60  40.78  262.53  36.95  -23.93  55.03  
1 1 1 6   11  7  o 10 572.91  67.14  10974.30  2166.16  11149.95 3063.20  10798.61  3063.63  528.57  104.66 516.77  106.80 11.80   149.53 
1 1 1 6   11  8  o 1  316.93  33.39  3029.08   598.30   2971.36  845.82   3086.89   846.42   305.19  50.01  311.83  48.89  -6.65   69.94  
1 1 1 6   11  9  o 14 133.91  15.50  526.15    116.98   523.20   163.15   529.28    167.81   132.05  22.32  132.71  22.85  -0.65   31.94  
1 1 1 6   11  10 o 16 326.10  34.67  3225.47   639.02   3238.81  902.94   3212.08   904.49   317.19  51.34  315.62  51.71  1.57    72.87  
1 1 1 6   11  11 o 14 339.02  35.92  3496.72   688.44   3304.52  971.97   3690.21   975.24   317.87  55.27  338.65  51.81  -20.79  75.76  
1 1 1 6   11  12 o 4  144.71  16.88  615.54    137.57   583.65   187.15   653.04    202.92   139.14  24.32  147.21  24.90  -8.08   34.80  
1 1 1 6   11  13 o 15 136.80  16.87  551.06    129.68   489.22   174.66   627.02    193.57   126.97  24.85  144.33  24.22  -17.36  34.70  
1 1 1 6   11  14 o 8  160.98  27.00  784.89    240.66   0.00     0.00     784.89    240.66   ?       ?      160.98  27.00  0.00    27.00  
1 1 1 6   11  15 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   11  16 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   11  17 o 8  234.31  38.89  1771.20   504.76   0.00     0.00     1771.20   504.76   ?       ?      234.31  38.89  0.00    38.89  
1 1 1 6   11  18 o 2  52.14   20.56  48.64     90.61    0.00     0.00     48.64     90.61    ?       ?      52.14   20.56  0.00    20.56  
1 1 1 6   11  19 f 0  171.62  29.66  936.06    281.61   0.00     0.00     936.06    281.61   ?       ?      171.62  29.66  0.00    29.66  
1 1 1 6   11  20 o 2  39.27   16.36  11.95     61.14    7.40     80.62    18.10     93.80    43.72   18.53  48.22   20.19  -4.50   27.41  
1 1 1 6   11  21 o 19 71.26   17.76  157.55    72.40    139.65   96.98    180.09    108.83   68.01   21.88  75.98   22.99  -7.98   31.74  
1 1 1 6   11  22 o 12 126.45  16.86  486.73    119.32   506.65   164.63   464.69    173.19   125.82  23.66  119.14  26.05  6.68    35.19  
1 1 1 6   11  23 o 16 74.23   22.18  176.41    101.79   188.09   134.22   160.60    156.16   76.97   25.79  74.31   27.55  2.66    37.74  
1 1 1 6   11  24 f 0  149.94  31.26  794.97    260.32   794.97   260.32   0.00      0.00     149.94  31.26  ?       ?      0.00    31.26  
1 1 1 6   11  25 o 13 117.38  29.38  494.37    197.48   494.37   197.48   0.00      0.00     117.38  29.38  ?       ?      0.00    29.38  
1 1 1 6   11  26 o 6  82.40   28.15  242.29    159.93   242.29   159.93   0.00      0.00     82.40   28.15  ?       ?      0.00    28.15  
1 1 1 6   11  27 o 7  185.96  58.85  2451.70   703.94   2451.70  703.94   0.00      0.00     185.96  58.85  ?       ?      0.00    58.85  
1 1 1 6   12  0  o 19 258.25  40.31  2040.95   578.12   0.00     0.00     2040.95   578.12   ?       ?      258.25  40.31  0.00    40.31  
1 1 1 6   12  1  o 17 472.54  83.01  7778.03   2169.69  0.00     0.00     7778.03   2169.69  ?       ?      472.54  83.01  0.00    83.01  
1 1 1 6   12  2  o 18 406.63  68.09  5487.77   1533.23  0.00     0.00     5487.77   1533.23  ?       ?      406.63  68.09  0.00    68.09  
1 1 1 6   12  3  o 10 290.54  45.89  2629.90   740.01   0.00     0.00     2629.90   740.01   ?       ?      290.54  45.89  0.00    45.89  
1 1 1 6   12  4  o 1  413.46  70.29  5760.75   1608.63  0.00     0.00     5760.75   1608.63  ?       ?      413.46  70.29  0.00    70.29  
1 1 1 6   12  5  o 2  350.84  57.23  3976.05   1112.94  0.00     0.00     3976.05   1112.94  ?       ?      350.84  57.23  0.00    57.23  
1 1 1 6   12  6  f 0  326.18  52.59  3392.39   951.33   0.00     0.00     3392.39   951.33   ?       ?      326.18  52.59  0.00    52.59  
1 1 1 6   12  7  o 1  424.86  73.81  6210.94   1734.81  0.00     0.00     6210.94   1734.81  ?       ?      424.86  73.81  0.00    73.81  
1 1 1 6   12  8  o 10 508.12  98.87  9968.57   2780.15  0.00     0.00     9968.57   2780.15  ?       ?      508.12  98.87  0.00    98.87  
1 1 1 6   12  9  o 13 191.27  30.76  1109.07   326.26   0.00     0.00     1109.07   326.26   ?       ?      191.27  30.76  0.00    30.76  
1 1 1 6   12  10 o 12 420.77  74.08  6172.71   1724.03  0.00     0.00     6172.71   1724.03  ?       ?      420.77  74.08  0.00    74.08  
1 1 1 6   12  11 o 7  324.42  53.16  3405.48   955.75   0.00     0.00     3405.48   955.75   ?       ?      324.42  53.16  0.00    53.16  
1 1 1 6   12  12 o 16 273.54  44.15  2366.45   669.69   0.00     0.00     2366.45   669.69   ?       ?      273.54  44.15  0.00    44.15  
1 1 1 6   12  13 o 1  410.95  77.72  6322.06   1766.38  0.00     0.00     6322.06   1766.38  ?       ?      410.95  77.72  0.00    77.72  
1 1 1 6   12  14 o 11 224.02  36.85  1582.57   457.41   0.00     0.00     1582.57   457.41   ?       ?      224.02  36.85  0.00    36.85  
1 1 1 6   12  15 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   12  16 o 1  140.45  24.84  609.09    192.94   0.00     0.00     609.09    192.94   ?       ?      140.45  24.84  0.00    24.84  
1 1 1 6   12  17 o 15 94.67   15.18  268.78    79.70    232.44   104.90   318.40    122.59   86.57   21.26  101.40  21.71  -14.83  30.39  
1 1 1 6   12  18 o 2  163.33  18.55  801.75    170.81   816.11   238.08   786.52    245.20   161.15  26.67  157.38  28.17  3.77    38.79  
1 1 1 6   12  19 o 14 235.63  26.18  1739.92   348.13   1665.82  489.53   1815.73   495.18   218.59  40.50  229.94  38.90  -11.35  56.16  
1 1 1 6   12  20 o 17 189.48  21.59  1109.49   230.62   1125.06  321.93   1093.08   330.52   183.78  31.66  179.86  33.23  3.92    45.90  
1 1 1 6   12  21 o 19 78.93   17.42  194.44    76.80    218.29   100.96   161.69    118.30   82.63   21.19  72.45   24.21  10.18   32.17  
1 1 1 6   12  22 o 9  72.03   26.38  152.09    142.54   152.09   142.54   0.00      0.00     72.03   26.38  ?       ?      0.00    26.38  
1 1 1 6   12  23 o 2  63.45   25.03  97.13     134.44   97.13    134.44   0.00      0.00     63.45   25.03  ?       ?      0.00    25.03  
1 1 1 6   12  24 o 2  90.81   27.94  291.88    159.83   291.88   159.83   0.00      0.00     90.81   27.94  ?       ?      0.00    27.94  
1 1 1 6   12  25 o 16 147.86  33.79  854.16    280.51   854.16   280.51   0.00      0.00     147.86  33.79  ?       ?      0.00    33.79  
1 1 1 6   12  26 o 18 97.10   23.96  334.44    132.71   317.44   173.98   358.09    205.25   90.40   29.32  93.68   31.89  -3.28   43.33  
1 1 1 6   13  0  o 2  372.81  39.68  4230.85   836.13   4178.37  1181.62  4283.49   1183.33  358.42  59.51  363.54  58.70  -5.12   83.59  
1 1 1 6   13  1  o 19 114.57  16.19  387.20    103.53   370.72   140.84   406.58    152.71   110.77  22.91  115.96  23.74  -5.20   32.99  
1 1 1 6   13  2  o 7  389.04  41.50  4623.51   912.65   4544.66  1289.98  4702.53   1291.39  372.21  62.59  379.64  61.35  -7.42   87.64  
1 1 1 6   13  3  o 15 291.97  46.36  2665.11   751.15   0.00     0.00     2665.11   751.15   ?       ?      291.97  46.36  0.00    46.36  
1 1 1 6   13  4  o 16 146.39  17.35  629.59    142.97   570.04   200.34   691.39    204.09   137.19  26.40  151.98  24.20  -14.79  35.81  
1 1 1 6   13  5  o 2  76.05   18.37  174.56    79.31    152.23   109.71   199.00    114.78   72.84   23.26  81.52   23.34  -8.68   32.95  
1 1 1 6   13  6  o 16 236.26  24.95  1654.44   333.36   1569.16  469.12   1741.42   473.79   225.68  37.53  238.74  35.66  -13.06  51.77  
1 1 1 6   13  7  o 10 341.64  36.21  3547.22   699.37   3354.05  987.67   3741.49   990.47   320.61  55.68  341.35  52.20  -20.73  76.32  
1 1 1 6   13  8  o 19 111.85  16.31  370.27    101.62   289.87   135.97   471.99    152.94   97.46   24.37  125.26  22.07  -27.81  32.88  
1 1 1 6   13  9  o 3  134.27  16.81  531.84    126.74   503.16   172.43   565.55    186.92   128.77  24.21  136.56  24.75  -7.80   34.63  
1 1 1 6   13  10 o 6  305.84  32.68  2853.27   564.88   2770.26  797.53   2936.85   800.20   290.82  49.55  300.72  47.96  -9.90   68.96  
1 1 1 6   13  11 o 3  297.24  31.85  2704.45   534.98   2587.20  755.63   2822.28   757.52   279.56  48.86  294.06  46.41  -14.49  67.39  
1 1 1 6   13  12 o 12 219.97  23.69  1453.02   294.49   1418.26  415.12   1488.23   417.82   211.82  35.39  217.49  34.62  -5.67   49.51  
1 1 1 6   13  13 o 8  353.54  39.94  4031.97   796.35   3950.53  1125.25  4113.69   1127.18  326.07  62.39  334.66  60.92  -8.58   87.19  
1 1 1 6   13  14 o 4  312.96  34.87  3114.23   615.82   2997.59  868.87   3231.97   872.94   288.26  54.50  302.01  52.24  -13.76  75.49  
1 1 1 6   13  15 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   13  16 o 5  95.70   16.32  276.78    86.42    274.95   109.40   279.81    140.94   94.15   20.80  94.08   25.48  0.07    32.89  
1 1 1 6   13  17 o 10 230.80  41.02  1850.61   523.53   1850.61  523.53   0.00      0.00     230.80  41.02  ?       ?      0.00    41.02  
1 1 1 6   13  18 o 11 220.85  39.99  1721.83   488.36   1721.83  488.36   0.00      0.00     220.85  39.99  ?       ?      0.00    39.99  
1 1 1 6   13  19 o 18 220.68  41.69  1794.87   508.79   1794.87  508.79   0.00      0.00     220.68  41.69  ?       ?      0.00    41.69  
1 1 1 6   13  20 o 9  104.10  22.39  349.11    129.80   349.11   129.80   0.00      0.00     104.10  22.39  ?       ?      0.00    22.39  
1 1 1 6   13  21 o 11 102.52  22.07  341.12    126.07   341.12   126.07   0.00      0.00     102.52  22.07  ?       ?      0.00    22.07  
1 1 1 6   13  22 o 13 52.07   23.11  -13.79    137.73   -13.79   137.73   0.00      0.00     52.07   23.11  ?       ?      0.00    23.11  
1 1 1 6   13  23 o 14 57.56   22.74  79.22     111.03   61.22    152.01   99.80     162.56   60.67   25.57  65.80   26.97  -5.13   37.17  
1 1 1 6   13  24 o 2  99.72   24.46  348.47    138.97   419.67   186.47   259.53    208.42   105.30  29.62  83.81   31.67  21.49   43.36  
1 1 1 6   13  25 o 11 55.68   23.01  66.69     119.66   26.85    161.63   115.00    178.00   56.98   25.17  66.37   27.80  -9.40   37.50  
1 1 1 6   14  0  o 13 232.50  33.53  1666.31   434.61   1929.63  527.74   1111.40   766.11   248.06  38.29  180.45  61.62  67.61   72.55  
1 1 1 6   14  1  o 17 134.68  22.15  546.19    165.31   532.62   173.10   686.83    557.39   132.56  23.61  148.78  52.46  -16.22  57.53  
1 1 1 6   14  2  o 4  177.56  27.95  959.83    275.47   959.83   275.47   0.00      0.00     177.56  27.95  ?       ?      0.00    27.95  
1 1 1 6   14  3  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   14  4  f 0  386.54  71.48  5471.95   1527.73  5471.95  1527.73  0.00      0.00     386.54  71.48  ?       ?      0.00    71.48  
1 1 1 6   14  5  o 9  278.12  45.78  2509.37   705.54   2509.37  705.54   0.00      0.00     278.12  45.78  ?       ?      0.00    45.78  
1 1 1 6   14  6  o 18 106.25  21.68  343.79    127.74   343.79   127.74   0.00      0.00     106.25  21.68  ?       ?      0.00    21.68  
1 1 1 6   14  7  o 7  278.31  46.43  2545.38   715.62   2545.38  715.62   0.00      0.00     278.31  46.43  ?       ?      0.00    46.43  
1 1 1 6   14  8  o 4  225.40  36.78  1611.93   459.50   1611.93  459.50   0.00      0.00     225.40  36.78  ?       ?      0.00    36.78  
1 1 1 6   14  9  o 5  135.94  23.86  564.99    179.41   564.99   179.41   0.00      0.00     135.94  23.86  ?       ?      0.00    23.86  
1 1 1 6   14  10 o 2  196.15  32.15  1210.48   349.55   1210.48  349.55   0.00      0.00     196.15  32.15  ?       ?      0.00    32.15  
1 1 1 6   14  11 o 7  325.27  61.87  3977.90   1113.11  3977.90  1113.11  0.00      0.00     325.27  61.87  ?       ?      0.00    61.87  
1 1 1 6   14  12 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   14  13 o 17 113.69  22.97  401.40    144.75   401.40   144.75   0.00      0.00     113.69  22.97  ?       ?      0.00    22.97  
1 1 1 6   14  14 o 16 51.94   20.58  48.01     91.22    48.01    91.22    0.00      0.00     51.94   20.58  ?       ?      0.00    20.58  
1 1 1 6   14  15 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   14  16 f 0  58.24   21.41  86.83     94.00    86.83    94.00    0.00      0.00     58.24   21.41  ?       ?      0.00    21.41  
1 1 1 6   14  17 o 9  56.18   21.31  75.14     94.63    75.14    94.63    0.00      0.00     56.18   21.31  ?       ?      0.00    21.31  
1 1 1 6   14  18 o 4  117.60  16.75  422.89    109.90   501.92   151.81   335.88    159.30   125.85  21.80  100.27  27.05  25.58   34.75  
1 1 1 6   14  19 o 15 125.24  16.66  480.83    116.84   431.51   156.64   542.70    175.44   114.50  24.57  128.73  24.64  -14.23  34.79  
1 1 1 6   14  20 o 14 90.58   16.91  256.56    84.69    314.10   110.42   174.33    131.99   98.95   20.12  74.06   25.57  24.89   32.54  
1 1 1 6   14  21 o 8  71.60   23.79  166.52    114.23   152.57   141.69   192.43    193.05   70.78   26.24  78.52   30.28  -7.74   40.07  
1 1 1 6   14  22 f 0  78.75   23.90  212.27    117.51   252.08   141.54   123.96    210.79   84.54   26.34  71.78   30.17  12.76   40.05  
1 1 1 6   14  23 o 7  72.44   24.69  180.84    122.96   186.65   148.06   167.92    220.76   73.64   26.90  74.60   31.08  -0.97   41.11  
1 1 1 6   14  24 o 8  55.88   23.42  62.48     126.35   35.40    159.59   107.94    206.80   57.28   25.17  67.61   29.19  -10.33  38.54  
1 1 1 6   15  0  o 10 101.12  15.46  304.59    86.88    345.48   115.95   252.24    131.19   106.80  19.64  90.45   24.61  16.35   31.49  
1 1 1 6   15  1  o 18 203.15  27.19  1260.22   309.16   1266.61  435.03   1253.70   439.44   197.38  39.77  196.00  40.40  1.38    56.69  
1 1 1 6   15  2  f 0  210.73  34.74  1402.89   405.64   0.00     0.00     1402.89   405.64   ?       ?      210.73  34.74  0.00    34.74  
1 1 1 6   15  3  o 1  80.75   16.56  197.30    74.20    197.53   94.59    196.92    119.64   80.32   20.46  80.63   24.04  -0.31   31.57  
1 1 1 6   15  4  o 4  269.64  29.84  2235.77   454.20   2482.13  640.80   1987.04   643.89   276.05  41.74  241.90  48.06  34.14   63.66  
1 1 1 6   15  5  o 10 59.85   18.17  106.03    67.88    35.64    87.75    210.93    107.12   49.73   20.02  82.85   22.11  -33.12  29.83  
1 1 1 6   15  6  o 6  315.50  35.05  3143.09   624.10   3142.70  881.14   3143.47   884.08   298.96  53.30  298.78  53.51  0.18    75.52  
1 1 1 6   15  7  o 12 242.31  26.30  1792.79   359.95   1743.17  506.00   1843.63   512.14   230.61  39.65  237.86  38.85  -7.25   55.51  
1 1 1 6   15  8  o 19 62.15   18.64  115.49    71.77    83.14    90.61    169.97    117.58   57.78   21.06  75.53   24.07  -17.75  31.98  
1 1 1 6   15  9  o 19 262.24  29.32  2143.19   433.89   2273.59  610.94   2010.49   616.30   259.73  42.44  240.65  46.29  19.09   62.80  
1 1 1 6   15  10 o 12 359.48  42.84  4384.51   866.62   4330.45  1224.00  4438.86   1227.19  321.93  68.35  327.37  67.54  -5.45   96.09  
1 1 1 6   15  11 o 10 183.60  20.95  1022.72   216.89   1054.85  300.77   987.91    313.05   181.73  29.87  174.18  32.50  7.55    44.14  
1 1 1 6   15  12 o 2  304.94  34.66  3056.69   595.99   2712.54  840.05   3405.47   845.69   259.59  57.85  302.32  50.51  -42.73  76.80  
1 1 1 6   15  13 o 1  120.46  16.66  438.26    112.13   464.63   151.98   406.75    166.12   121.76  22.58  112.26  26.25  9.49    34.62  
1 1 1 6   15  14 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   15  15 o 5  92.01   17.50  261.76    89.08    282.16   120.05   236.78    132.87   93.82   22.57  85.59   25.29  8.23    33.89  
1 1 1 6   15  16 o 19 94.24   18.40  277.32    95.96    311.66   124.50   227.06    150.62   98.36   22.53  83.78   27.29  14.57   35.39  
1 1 1 6   15  17 o 13 165.31  20.08  852.74    186.66   776.09   256.42   939.15    272.25   149.90  30.83  166.35  29.59  -16.45  42.73  
1 1 1 6   15  18 o 2  124.26  18.64  483.23    128.85   442.88   168.62   539.87    199.77   114.47  26.22  125.12  28.46  -10.65  38.70  
1 1 1 6   15  19 o 19 113.79  18.51  409.09    116.79   401.93   154.15   418.76    178.94   108.80  25.18  108.96  28.34  -0.17   37.91  
1 1 1 6   15  20 o 13 185.91  23.61  1148.86   246.34   1224.17  346.22   1071.65   350.57   178.46  35.05  162.28  38.26  16.17   51.88  
1 1 1 6   15  21 o 6  102.43  24.02  364.67    138.79   316.45   172.78   452.37    233.01   91.80   29.17  105.17  33.92  -13.37  44.74  
1 1 1 6   15  22 o 18 63.39   23.68  125.62    115.84   158.87   136.58   40.41     218.68   69.15   25.74  64.28   28.78  4.87    38.61  
1 1 1 6   16  0  o 12 119.68  15.70  426.73    105.29   481.94   143.45   362.27    155.03   125.79  20.58  107.28  25.54  18.51   32.80  
1 1 1 6   16  1  f 0  93.85   14.31  262.94    74.64    418.77   93.82    -5.83     123.21   118.97  14.00  52.01   22.49  66.97   26.50  
1 1 1 6   16  2  o 3  186.78  22.51  1060.04   236.48   0.00     0.00     1060.04   236.48   ?       ?      186.78  22.51  0.00    22.51  
1 1 1 6   16  3  o 11 103.49  15.71  321.01    90.39    268.38   118.92   393.02    139.10   92.77   22.55  112.70  22.29  -19.93  31.71  
1 1 1 6   16  4  o 12 65.12   18.03  129.32    69.69    92.99    88.82    187.51    112.42   59.12   20.93  78.14   23.31  -19.02  31.33  
1 1 1 6   16  5  o 12 133.49  16.96  533.55    127.07   573.15   173.02   487.18    187.23   136.26  22.93  123.81  27.10  12.45   35.50  
1 1 1 6   16  6  o 3  443.91  62.34  7890.42   1544.91  7580.88  2183.45  8200.73   2186.21  340.29  102.98 365.45  100.90 -25.16  144.17 
1 1 1 6   16  7  o 19 277.31  31.62  2464.23   494.34   2513.37  697.07   2414.52   701.14   263.80  47.79  256.68  49.38  7.12    68.72  
1 1 1 6   16  8  f 0  134.73  17.13  545.97    129.47   567.07   176.08   521.14    191.04   134.75  23.62  127.61  26.93  7.14    35.82  
1 1 1 6   16  9  o 15 42.02   17.33  18.62     67.62    14.75    84.69    25.42     112.34   45.63   19.15  52.86   22.11  -7.23   29.25  
1 1 1 6   16  10 o 12 176.65  20.28  952.93    201.93   876.55   279.45   1036.39   292.12   163.16  30.97  178.74  29.50  -15.58  42.77  
1 1 1 6   16  11 o 7  205.98  23.51  1322.46   273.02   1318.20  380.59   1326.97   391.87   196.85  34.96  196.56  36.06  0.29    50.22  
1 1 1 6   16  12 o 6  73.20   18.79  167.70    79.33    194.98   97.52    114.32    136.40   78.50   21.16  67.35   25.58  11.15   33.20  
1 1 1 6   16  13 o 7  130.02  25.07  546.94    180.34   546.94   180.34   0.00      0.00     130.02  25.07  ?       ?      0.00    25.07  
1 1 1 6   16  14 f 0  143.88  28.85  695.51    230.02   0.00     0.00     695.51    230.02   ?       ?      143.88  28.85  0.00    28.85  
1 1 1 6   16  15 o 16 55.74   19.12  90.07     73.78    32.71    92.80    188.59    121.62   49.15   20.29  76.57   24.49  -27.42  31.80  
1 1 1 6   16  16 o 9  133.95  17.91  557.12    134.26   488.07   179.44   644.93    202.37   119.92  26.75  138.62  26.39  -18.70  37.58  
1 1 1 6   16  17 o 11 240.22  30.12  2019.10   406.25   1944.24  569.80   2096.49   579.36   207.17  48.73  217.53  47.71  -10.36  68.20  
1 1 1 6   16  18 o 15 134.30  18.93  574.38    141.93   525.64   187.55   639.70    217.13   122.03  27.44  133.42  29.16  -11.39  40.04  
1 1 1 6   16  19 o 14 130.61  19.75  553.89    143.44   513.43   187.82   610.50    222.19   118.90  27.98  127.17  30.77  -8.26   41.59  
1 1 1 6   16  20 f 0  45.72   20.46  -16.05    110.35   -46.92   132.79   52.87     198.41   47.24   21.65  63.66   28.02  -16.42  35.41  
1 1 1 6   17  0  o 10 47.29   17.29  54.84     61.20    62.05    74.30    39.63     107.91   51.08   18.99  53.90   22.02  -2.82   29.08  
1 1 1 6   17  1  o 1  22.38   10.86  -73.48    43.66    -40.49   43.82    -4541.61  509.91   25.82   12.04  ?       ?      0.00    12.04  
1 1 1 6   17  2  o 19 287.16  44.96  2930.64   716.80   0.00     0.00     2930.64   716.80   ?       ?      287.16  44.96  0.00    44.96  
1 1 1 6   17  3  o 14 132.17  16.81  525.23    124.69   567.20   169.84   476.16    183.65   135.08  22.71  121.72  26.99  13.36   35.27  
1 1 1 6   17  4  o 9  243.52  25.53  1849.18   351.56   1902.08  526.44   1806.60   472.31   233.78  40.70  231.40  36.79  2.38    54.86  
1 1 1 6   17  5  o 15 174.52  29.87  988.37    288.52   0.00     0.00     988.37    288.52   ?       ?      174.52  29.87  0.00    29.87  
1 1 1 6   17  6  o 14 87.02   17.41  233.02    83.94    215.95   105.27   262.82    139.09   82.74   21.84  90.53   25.62  -7.78   33.67  
1 1 1 6   17  7  o 5  142.26  17.83  613.77    142.39   590.46   191.04   642.90    213.58   135.94  25.41  140.90  27.39  -4.96   37.37  
1 1 1 6   17  8  o 10 103.97  16.99  330.18    97.90    318.45   129.41   345.88    149.69   99.86   23.04  103.26  25.43  -3.39   34.31  
1 1 1 6   17  9  o 19 57.24   19.06  95.61     73.31    73.44    88.85    142.91    129.76   55.05   20.70  70.65   25.27  -15.60  32.67  
1 1 1 6   17  10 o 18 53.57   18.74  79.60     71.00    85.40    87.15    68.16     122.44   56.76   20.66  59.28   23.73  -2.52   31.46  
1 1 1 6   17  11 o 17 43.45   17.93  22.40     72.43    -11.40   87.28    97.14     129.78   42.56   18.66  63.81   24.77  -21.25  31.01  
1 1 1 6   17  12 o 9  48.81   19.06  49.91     77.30    57.51    94.19    34.25     135.25   52.99   20.94  56.94   24.06  -3.95   31.90  
1 1 1 6   17  13 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   17  14 o 5  136.10  18.88  581.68    143.53   576.89   190.50   587.96    218.28   130.54  26.33  128.87  30.06  1.67    39.96  
1 1 1 6   17  15 o 17 62.14   20.04  121.51    81.30    148.95   103.33   76.91     131.73   68.19   22.63  60.16   24.42  8.04    33.29  
1 1 1 6   17  16 o 14 46.57   18.69  41.85     76.18    39.21    94.11    46.86     129.74   49.47   20.43  56.08   23.63  -6.61   31.23  
1 1 1 6   17  17 o 14 74.39   19.78  183.10    85.91    148.72   107.87   242.71    142.05   67.53   23.12  82.75   26.47  -15.22  35.14  
1 1 1 6   18  0  o 11 112.18  16.00  380.82    100.09   524.12   127.90   154.38    160.78   131.36  17.39  75.10   27.93  56.26   32.90  
1 1 1 6   18  1  o 13 ?       ?      -260.13   68.49    -401.99  80.61    107.81    129.83   ?       ?      65.79   24.96  0.00    24.96  
1 1 1 6   18  2  o 4  80.76   25.32  206.59    130.62   0.00     0.00     206.59    130.62   ?       ?      80.76   25.32  0.00    25.32  
1 1 1 6   18  3  o 11 50.74   21.89  3.35      116.07   0.00     0.00     3.35      116.07   ?       ?      50.74   21.89  0.00    21.89  
1 1 1 6   18  4  o 18 53.74   22.65  25.60     119.32   0.00     0.00     25.60     119.32   ?       ?      53.74   22.65  0.00    22.65  
1 1 1 6   18  5  o 19 62.36   24.11  91.36     122.61   0.00     0.00     91.36     122.61   ?       ?      62.36   24.11  0.00    24.11  
1 1 1 6   18  6  o 18 58.17   23.56  60.30     122.34   0.00     0.00     60.30     122.34   ?       ?      58.17   23.56  0.00    23.56  
1 1 1 6   18  7  o 12 47.53   21.77  -69.77    134.12   0.00     0.00     -69.77    134.12   ?       ?      47.53   21.77  0.00    21.77  
1 1 1 6   18  8  o 4  61.75   24.32  86.08     126.65   0.00     0.00     86.08     126.65   ?       ?      61.75   24.32  0.00    24.32  
1 1 1 6   18  9  o 15 60.80   24.20  80.29     126.67   0.00     0.00     80.29     126.67   ?       ?      60.80   24.20  0.00    24.20  
1 1 1 6   18  10 o 9  78.24   27.26  196.66    150.23   0.00     0.00     196.66    150.23   ?       ?      78.24   27.26  0.00    27.26  
1 1 1 6   18  11 o 10 72.63   26.84  159.28    148.01   0.00     0.00     159.28    148.01   ?       ?      72.63   26.84  0.00    26.84  
1 1 1 6   18  12 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 6   18  13 o 10 98.72   29.24  351.76    177.48   0.00     0.00     351.76    177.48   ?       ?      98.72   29.24  0.00    29.24  
1 1 1 7   -17 0  o 18 48.12   20.98  -5.37     109.07   -54.37   117.31   307.08    296.23   45.27   20.60  97.37   37.52  -52.10  42.80  
1 1 1 7   -17 1  o 14 90.80   22.99  267.22    119.96   288.18   130.12   148.53    309.67   93.94   24.03  85.81   36.35  8.13    43.57  
1 1 1 7   -17 2  o 8  53.89   22.04  45.30     108.16   63.11    115.30   -85.22    312.17   57.38   23.01  72.34   33.17  -14.97  40.37  
1 1 1 7   -17 3  o 14 88.48   23.70  254.68    122.76   251.58   131.13   276.66    349.19   87.69   24.89  97.27   39.66  -9.58   46.83  
1 1 1 7   -17 4  o 14 72.23   24.05  161.18    116.69   141.02   124.84   300.67    328.33   69.55   24.80  98.21   39.01  -28.66  46.22  
1 1 1 7   -17 5  o 1  57.39   22.65  69.11     110.04   61.76    117.38   122.46    316.21   57.54   23.16  84.68   36.32  -27.13  43.08  
1 1 1 7   -17 6  o 16 133.52  43.30  703.08    379.35   0.00     0.00     703.08    379.35   ?       ?      133.52  43.30  0.00    43.30  
1 1 1 7   -16 0  o 12 100.68  24.96  326.73    143.56   326.73   143.56   0.00      0.00     100.68  24.96  ?       ?      0.00    24.96  
1 1 1 7   -16 1  o 10 176.38  23.41  970.55    231.15   861.05   288.08   1168.48   387.30   160.36  32.41  182.76  38.15  -22.39  50.06  
1 1 1 7   -16 2  o 6  97.92   22.66  304.23    124.85   284.29   137.76   395.89    295.41   94.01   25.07  108.62  38.20  -14.61  45.69  
1 1 1 7   -16 3  o 17 167.86  22.99  877.16    215.76   764.29   267.53   1087.15   364.93   151.35  31.80  177.15  37.08  -25.80  48.85  
1 1 1 7   -16 4  o 10 131.00  21.38  532.98    155.22   547.25   180.29   492.09    305.16   131.13  24.86  118.52  38.86  12.61   46.13  
1 1 1 7   -16 5  o 10 270.59  32.55  2416.42   495.41   2341.21  680.29   2501.34   722.89   246.33  49.82  252.39  51.64  -6.06   71.75  
1 1 1 7   -16 6  o 12 175.02  32.10  1020.98   310.68   1020.98  310.68   0.00      0.00     175.02  32.10  ?       ?      0.00    32.10  
1 1 1 7   -16 7  o 18 101.09  36.94  329.32    279.21   0.00     0.00     329.32    279.21   ?       ?      101.09  36.94  0.00    36.94  
1 1 1 7   -16 8  o 4  65.36   30.20  -132.76   265.79   0.00     0.00     -132.76   265.79   ?       ?      65.36   30.20  0.00    30.20  
1 1 1 7   -16 9  o 1  147.93  40.64  811.07    355.71   0.00     0.00     811.07    355.71   ?       ?      147.93  40.64  0.00    40.64  
1 1 1 7   -16 10 o 3  65.68   30.10  -100.37   256.43   0.00     0.00     -100.37   256.43   ?       ?      65.68   30.10  0.00    30.10  
1 1 1 7   -15 0  o 16 155.23  21.27  736.13    184.57   787.82   230.98   644.83    306.99   158.28  26.35  137.30  37.77  20.98   46.05  
1 1 1 7   -15 1  o 17 99.57   23.45  312.05    131.83   312.05   131.83   0.00      0.00     99.57   23.45  ?       ?      0.00    23.45  
1 1 1 7   -15 2  o 11 143.41  26.33  649.17    208.77   649.17   208.77   0.00      0.00     143.41  26.33  ?       ?      0.00    26.33  
1 1 1 7   -15 3  o 10 166.92  29.15  889.89    269.18   889.89   269.18   0.00      0.00     166.92  29.15  ?       ?      0.00    29.15  
1 1 1 7   -15 4  o 17 201.52  23.71  1248.79   269.09   1024.33  360.70   1530.50   404.08   174.13  37.21  216.66  33.57  -42.53  50.12  
1 1 1 7   -15 5  f 0  302.69  65.29  3863.72   1101.17  0.00     0.00     3863.72   1101.17  ?       ?      302.69  65.29  0.00    65.29  
1 1 1 7   -15 6  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   -15 7  o 18 79.23   25.14  192.52    128.40   192.52   128.40   0.00      0.00     79.23   25.14  ?       ?      0.00    25.14  
1 1 1 7   -15 8  o 1  72.92   22.68  162.35    104.97   144.80   120.26   218.47    215.08   70.90   24.41  87.81   32.37  -16.91  40.54  
1 1 1 7   -15 9  o 5  175.71  22.19  949.34    218.84   803.43   289.47   1143.99   334.33   155.13  33.49  186.70  32.37  -31.57  46.57  
1 1 1 7   -15 10 o 7  57.22   21.97  72.72     101.38   82.72    115.40   38.93     212.17   60.79   23.42  69.93   29.87  -9.13   37.95  
1 1 1 7   -15 11 o 18 83.21   32.27  178.07    220.16   0.00     0.00     178.07    220.16   ?       ?      83.21   32.27  0.00    32.27  
1 1 1 7   -15 12 o 14 84.40   32.69  188.71    225.69   0.00     0.00     188.71    225.69   ?       ?      84.40   32.69  0.00    32.69  
1 1 1 7   -15 13 o 5  283.35  34.10  2701.31   543.59   2391.78  756.31   3032.10   781.84   237.76  56.29  277.49  50.96  -39.73  75.93  
1 1 1 7   -14 0  o 17 179.97  35.07  1043.91   349.32   0.00     0.00     1043.91   349.32   ?       ?      179.97  35.07  0.00    35.07  
1 1 1 7   -14 1  o 8  184.81  35.42  1101.15   362.08   0.00     0.00     1101.15   362.08   ?       ?      184.81  35.42  0.00    35.42  
1 1 1 7   -14 2  o 11 165.34  20.80  822.11    193.10   729.06   252.89   952.25    299.07   151.95  30.06  173.67  31.14  -21.72  43.28  
1 1 1 7   -14 3  o 15 205.28  23.69  1276.73   274.07   1272.00  372.79   1282.28   404.33   199.81  33.70  198.83  36.78  0.98    49.88  
1 1 1 7   -14 4  o 7  258.83  44.77  2263.97   641.20   2263.97  641.20   0.00      0.00     258.83  44.77  ?       ?      0.00    44.77  
1 1 1 7   -14 5  x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   -14 6  o 13 223.60  40.58  1667.67   501.66   0.00     0.00     1667.67   501.66   ?       ?      223.60  40.58  0.00    40.58  
1 1 1 7   -14 7  o 15 225.06  25.63  1555.37   325.29   1395.97  446.20   1736.18   475.22   204.42  39.45  230.18  37.23  -25.76  54.25  
1 1 1 7   -14 8  o 5  98.08   20.47  296.65    111.54   248.55   137.04   391.07    192.01   89.13   25.50  110.31  29.68  -21.18  39.12  
1 1 1 7   -14 9  o 18 73.52   21.59  165.50    97.10    177.40   115.79   137.31    178.24   76.43   23.82  76.11   29.16  0.33    37.65  
1 1 1 7   -14 10 o 3  215.33  24.62  1426.35   298.91   1414.43  414.81   1439.23   431.10   206.83  36.26  207.72  37.53  -0.89   52.19  
1 1 1 7   -14 11 o 10 55.68   20.42  77.15     85.39    99.13    103.72   30.90     150.45   61.96   22.54  60.54   25.47  1.42    34.01  
1 1 1 7   -14 12 o 2  152.57  19.27  704.99    165.03   644.57   223.85   776.94    244.27   141.62  28.52  155.93  28.33  -14.31  40.20  
1 1 1 7   -14 13 o 10 212.19  39.53  1554.41   463.84   0.00     0.00     1554.41   463.84   ?       ?      212.19  39.53  0.00    39.53  
1 1 1 7   -14 14 o 9  104.61  29.81  360.53    187.64   0.00     0.00     360.53    187.64   ?       ?      104.61  29.81  0.00    29.81  
1 1 1 7   -14 15 o 13 195.47  23.04  1187.51   253.62   1141.69  351.12   1237.50   366.73   183.36  34.63  190.98  34.73  -7.62   49.04  
1 1 1 7   -13 0  o 4  157.37  19.60  737.10    173.23   685.29   227.97   807.89    266.49   149.14  27.65  161.42  29.86  -12.28  40.69  
1 1 1 7   -13 1  o 5  262.02  28.49  2083.94   421.63   2006.85  588.74   2165.12   604.11   249.07  42.71  259.35  42.01  -10.27  59.91  
1 1 1 7   -13 2  o 17 132.18  30.34  547.83    225.37   0.00     0.00     547.83    225.37   ?       ?      132.18  30.34  0.00    30.34  
1 1 1 7   -13 3  o 15 325.36  58.09  3703.84   1045.27  0.00     0.00     3703.84   1045.27  ?       ?      325.36  58.09  0.00    58.09  
1 1 1 7   -13 4  o 8  192.14  21.45  1101.68   232.52   1078.29  323.28   1126.75   334.69   186.20  31.36  190.24  31.77  -4.04   44.64  
1 1 1 7   -13 5  x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   -13 6  o 7  252.66  42.16  2075.66   590.03   2075.66  590.03   0.00      0.00     252.66  42.16  ?       ?      0.00    42.16  
1 1 1 7   -13 7  o 5  138.71  25.58  592.28    196.19   592.28   196.19   0.00      0.00     138.71  25.58  ?       ?      0.00    25.58  
1 1 1 7   -13 8  o 12 197.26  22.01  1167.72   244.98   1014.59  340.48   1332.08   352.75   178.24  34.52  206.91  30.62  -28.66  46.15  
1 1 1 7   -13 9  o 16 140.57  17.89  589.43    141.09   562.36   188.09   624.27    213.36   134.86  25.22  141.50  27.25  -6.64   37.13  
1 1 1 7   -13 10 o 4  62.09   19.93  112.20    80.48    104.06   99.51    127.59    136.85   62.60   22.16  70.68   25.86  -8.07   34.05  
1 1 1 7   -13 11 o 2  365.22  43.11  4479.40   886.53   4246.55  1250.96  4714.35   1256.55  320.12  70.02  344.12  66.01  -24.00  96.23  
1 1 1 7   -13 12 o 12 111.86  27.70  398.54    176.96   0.00     0.00     398.54    176.96   ?       ?      111.86  27.70  0.00    27.70  
1 1 1 7   -13 13 o 11 43.02   18.20  7.34      77.47    -13.20   93.23    53.17     139.26   44.41   19.38  61.23   25.01  -16.82  31.64  
1 1 1 7   -13 14 o 13 154.03  19.33  716.93    167.19   621.38   224.95   834.86    249.91   139.02  29.12  162.41  27.80  -23.38  40.26  
1 1 1 7   -13 15 o 15 278.19  55.48  3008.55   854.95   0.00     0.00     3008.55   854.95   ?       ?      278.19  55.48  0.00    55.48  
1 1 1 7   -13 16 f 0  114.73  29.19  431.73    192.65   0.00     0.00     431.73    192.65   ?       ?      114.73  29.19  0.00    29.19  
1 1 1 7   -13 17 o 11 19.98   8.79   -5.23     19.50    -4.22    19.66    -65.07    151.57   20.31   8.88   51.86   23.52  -31.55  25.14  
1 1 1 7   -12 0  o 13 255.32  27.16  1942.49   391.96   1957.32  551.33   1927.33   557.35   251.40  39.50  249.04  40.37  2.36    56.48  
1 1 1 7   -12 1  o 2  130.65  17.18  503.54    125.75   394.41   171.59   630.15    184.83   113.51  26.77  145.08  22.96  -31.57  35.26  
1 1 1 7   -12 2  o 3  415.58  45.28  5391.81   1062.81  5030.74  1501.82  5754.05   1504.25  379.97  71.47  412.31  65.76  -32.34  97.12  
1 1 1 7   -12 3  o 11 171.01  19.27  862.10    185.88   734.14   257.64   1001.01   268.43   154.75  30.09  182.51  26.39  -27.76  40.02  
1 1 1 7   -12 4  x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   -12 5  f 0  253.02  41.18  2015.47   577.58   0.00     0.00     2015.47   577.58   ?       ?      253.02  41.18  0.00    41.18  
1 1 1 7   -12 6  o 6  261.26  27.87  2052.75   411.59   1862.11  578.95   2247.57   585.26   241.19  43.41  267.87  39.22  -26.68  58.50  
1 1 1 7   -12 7  o 10 328.95  35.71  3341.84   663.50   3159.12  935.68   3526.65   941.00   305.53  55.39  325.94  52.04  -20.42  76.00  
1 1 1 7   -12 8  f 0  214.15  34.60  1431.57   410.86   1431.57  410.86   0.00      0.00     214.15  34.60  ?       ?      0.00    34.60  
1 1 1 7   -12 9  o 18 245.84  40.13  1931.14   546.87   1931.14  546.87   0.00      0.00     245.84  40.13  ?       ?      0.00    40.13  
1 1 1 7   -12 10 o 1  75.58   18.41  173.91    79.12    213.91   101.61   112.30    126.11   83.59   21.16  67.61   24.81  15.98   32.61  
1 1 1 7   -12 11 o 3  431.61  119.38 10960.29  3057.51  0.00     0.00     10960.29  3057.51  ?       ?      431.61  119.38 0.00    119.38 
1 1 1 7   -12 12 o 19 326.32  36.55  3385.74   673.00   3151.81  949.97   3621.46   953.58   294.19  58.31  320.97  53.64  -26.78  79.23  
1 1 1 7   -12 13 o 11 220.22  24.27  1473.28   301.74   1478.21  423.10   1468.17   430.44   214.15  35.67  212.85  36.54  1.30    51.07  
1 1 1 7   -12 14 f 0  173.02  19.98  899.75    194.80   838.05   269.51   967.25    281.89   162.54  29.99  175.39  29.01  -12.85  41.72  
1 1 1 7   -12 15 o 8  189.93  21.35  1091.32   228.80   1192.92  318.39   982.82    329.02   194.47  29.44  173.49  34.25  20.98   45.17  
1 1 1 7   -12 16 o 8  147.69  17.61  653.88    146.36   670.55   194.13   631.93    222.78   147.14  23.79  140.60  28.58  6.53    37.19  
1 1 1 7   -12 17 o 16 138.33  27.42  610.92    210.08   0.00     0.00     610.92    210.08   ?       ?      138.33  27.42  0.00    27.42  
1 1 1 7   -12 18 o 3  195.56  35.59  1289.30   384.87   0.00     0.00     1289.30   384.87   ?       ?      195.56  35.59  0.00    35.59  
1 1 1 7   -12 19 o 2  214.96  24.86  1449.38   301.19   1297.63  420.58   1609.13   431.53   191.56  39.56  217.45  35.82  -25.89  53.36  
1 1 1 7   -11 0  f 0  361.31  38.49  3976.94   786.04   3744.79  1109.98  4210.47   1113.27  337.74  59.42  361.33  55.44  -23.59  81.26  
1 1 1 7   -11 1  o 5  550.25  62.99  9926.19   1953.80  9173.74  2762.15  10679.66  2764.02  482.25  102.91 534.30  93.52  -52.05  139.06 
1 1 1 7   -11 2  o 16 145.90  17.31  625.35    142.16   597.25   193.24   658.49    209.89   140.89  24.80  147.89  25.65  -7.00   35.68  
1 1 1 7   -11 3  o 8  471.27  84.85  7927.39   2211.18  7927.39  2211.18  0.00      0.00     471.27  84.85  ?       ?      0.00    84.85  
1 1 1 7   -11 4  x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   -11 5  o 6  179.22  19.87  944.27    201.04   868.71   278.94   1025.94   290.00   169.34  29.78  184.82  28.23  -15.47  41.03  
1 1 1 7   -11 6  o 5  197.14  32.07  1178.78   350.45   0.00     0.00     1178.78   350.45   ?       ?      197.14  32.07  0.00    32.07  
1 1 1 7   -11 7  o 16 324.88  52.70  3378.38   949.24   0.00     0.00     3378.38   949.24   ?       ?      324.88  52.70  0.00    52.70  
1 1 1 7   -11 8  o 1  197.05  21.28  1146.44   236.91   1128.70  331.64   1164.92   338.53   192.58  31.05  195.67  31.18  -3.08   44.01  
1 1 1 7   -11 9  o 14 206.02  22.23  1257.90   258.71   1145.52  362.81   1374.16   369.00   192.50  34.08  212.38  31.19  -19.88  46.20  
1 1 1 7   -11 10 o 2  149.10  25.08  673.84    207.02   673.84   207.02   0.00      0.00     149.10  25.08  ?       ?      0.00    25.08  
1 1 1 7   -11 11 o 3  96.60   20.29  283.51    108.96   283.51   108.96   0.00      0.00     96.60   20.29  ?       ?      0.00    20.29  
1 1 1 7   -11 12 o 3  297.83  32.22  2722.77   542.11   2694.04  765.46   2751.67   767.85   285.28  48.47  288.72  48.01  -3.44   68.23  
1 1 1 7   -11 13 o 2  201.06  21.93  1208.15   249.03   1194.29  348.82   1222.56   355.65   195.64  32.18  197.87  32.43  -2.23   45.69  
1 1 1 7   -11 14 o 14 171.50  19.41  876.69    187.77   754.49   261.47   1006.80   269.81   154.87  30.50  181.14  26.75  -26.27  40.56  
1 1 1 7   -11 15 o 3  52.30   17.99  74.00     65.35    58.64    80.51    103.66    111.88   51.88   19.66  64.15   23.39  -12.27  30.56  
1 1 1 7   -11 16 o 15 144.13  19.78  626.75    159.35   6.06     212.14   1430.46   241.39   68.42   29.55  218.91  19.41  -150.48 35.36  
1 1 1 7   -11 17 o 1  187.23  21.21  1060.33   223.99   927.54   313.73   1198.41   319.91   168.78  33.56  194.84  29.53  -26.06  44.70  
1 1 1 7   -11 18 o 13 105.52  16.62  335.89    97.33    295.71   130.52   386.21    146.07   96.92   23.67  110.98  23.65  -14.06  33.46  
1 1 1 7   -11 19 o 18 259.08  49.19  2481.33   704.81   0.00     0.00     2481.33   704.81   ?       ?      259.08  49.19  0.00    49.19  
1 1 1 7   -11 20 o 6  247.99  47.90  2305.69   657.24   0.00     0.00     2305.69   657.24   ?       ?      247.99  47.90  0.00    47.90  
1 1 1 7   -11 21 o 18 81.95   25.99  211.65    137.20   0.00     0.00     211.65    137.20   ?       ?      81.95   25.99  0.00    25.99  
1 1 1 7   -10 0  o 6  481.84  91.13  8712.83   2428.53  8712.83  2428.53  0.00      0.00     481.84  91.13  ?       ?      0.00    91.13  
1 1 1 7   -10 1  o 14 260.34  40.92  2100.37   591.45   0.00     0.00     2100.37   591.45   ?       ?      260.34  40.92  0.00    40.92  
1 1 1 7   -10 2  o 7  309.63  49.67  3044.09   853.02   0.00     0.00     3044.09   853.02   ?       ?      309.63  49.67  0.00    49.67  
1 1 1 7   -10 3  x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   -10 4  o 2  507.41  98.55  9927.37   2767.13  9927.37  2767.13  0.00      0.00     507.41  98.55  ?       ?      0.00    98.55  
1 1 1 7   -10 5  o 7  85.24   15.39  216.51    72.56    159.79   95.90    292.47    110.97   73.36   21.43  98.52   20.30  -25.16  29.52  
1 1 1 7   -10 6  o 1  262.71  27.66  2048.63   410.86   1863.52  579.11   2236.24   583.00   244.96  42.74  270.59  38.63  -25.63  57.60  
1 1 1 7   -10 7  f 0  638.24  75.44  13760.69  2710.71  13874.69 3833.34  13646.66  3833.72  581.59  118.83 574.69  120.08 6.90    168.94 
1 1 1 7   -10 8  o 7  254.08  40.01  1979.70   564.26   0.00     0.00     1979.70   564.26   ?       ?      254.08  40.01  0.00    40.01  
1 1 1 7   -10 9  o 17 318.31  50.85  3193.31   897.90   0.00     0.00     3193.31   897.90   ?       ?      318.31  50.85  0.00    50.85  
1 1 1 7   -10 10 o 7  403.13  43.62  5005.78   993.34   4645.50  1404.08  5366.79   1405.51  370.81  68.48  403.88  62.65  -33.07  92.82  
1 1 1 7   -10 11 o 16 305.25  32.51  2811.68   560.96   2634.82  792.54   2989.23   794.09   286.29  50.04  307.49  46.43  -21.20  68.27  
1 1 1 7   -10 12 o 9  94.31   20.44  269.80    107.47   269.80   107.47   0.00      0.00     94.31   20.44  ?       ?      0.00    20.44  
1 1 1 7   -10 13 o 5  117.16  22.10  416.25    143.18   416.25   143.18   0.00      0.00     117.16  22.10  ?       ?      0.00    22.10  
1 1 1 7   -10 14 o 10 131.34  16.26  509.80    120.00   426.56   164.67   604.04    175.22   117.75  25.13  141.53  22.30  -23.78  33.60  
1 1 1 7   -10 15 o 5  245.70  26.68  1827.91   370.23   1629.93  519.58   2032.11   527.69   223.64  42.01  253.22  37.43  -29.58  56.27  
1 1 1 7   -10 16 o 13 ?       ?      -169.68   45.25    -283.25  50.87    260.17    98.97    ?       ?      92.36   19.29  0.00    19.29  
1 1 1 7   -10 17 o 2  271.10  29.75  2281.71   455.36   2337.56  643.16   2225.57   644.79   263.35  44.10  255.56  45.63  7.80    63.45  
1 1 1 7   -10 18 o 11 143.33  17.59  614.21    141.70   607.88   195.90   621.15    205.23   139.73  25.36  140.88  26.34  -1.15   36.56  
1 1 1 7   -10 19 o 18 219.71  24.71  1483.63   306.29   1349.38  431.16   1620.41   435.20   200.18  38.92  222.65  35.22  -22.47  52.49  
1 1 1 7   -10 20 o 6  241.48  27.20  1825.03   370.48   1761.21  523.31   1889.16   524.57   225.11  42.04  234.88  40.36  -9.77   58.28  
1 1 1 7   -10 21 o 9  175.57  31.73  1013.48   308.07   0.00     0.00     1013.48   308.07   ?       ?      175.57  31.73  0.00    31.73  
1 1 1 7   -10 22 o 16 143.81  28.12  674.28    223.81   0.00     0.00     674.28    223.81   ?       ?      143.81  28.12  0.00    28.12  
1 1 1 7   -9  0  o 4  436.67  73.07  6337.57   1766.95  6337.57  1766.95  0.00      0.00     436.67  73.07  ?       ?      0.00    73.07  
1 1 1 7   -9  1  o 2  165.51  25.43  817.16    233.90   817.16   233.90   0.00      0.00     165.51  25.43  ?       ?      0.00    25.43  
1 1 1 7   -9  2  f 0  587.59  117.49 13727.38  3824.40  13727.38 3824.40  0.00      0.00     587.59  117.49 ?       ?      0.00    117.49 
1 1 1 7   -9  3  x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   -9  4  o 18 592.28  68.12  11519.14  2274.08  10867.70 3215.79  12170.77  3216.27  525.78  110.08 567.71  102.46 -41.93  150.38 
1 1 1 7   -9  5  o 4  433.43  46.81  5805.85   1146.23  5677.69  1620.72  5934.10   1621.31  410.47  71.37  421.42  69.43  -10.95  99.57  
1 1 1 7   -9  6  o 10 232.24  24.29  1593.37   319.10   1506.16  449.81   1681.73   452.76   221.82  36.60  235.41  34.53  -13.59  50.32  
1 1 1 7   -9  7  o 13 124.18  14.99  452.20    104.71   416.07   143.83   492.93    152.72   117.63  22.11  128.43  21.47  -10.80  30.82  
1 1 1 7   -9  8  o 11 614.43  72.79  12754.85  2517.57  12155.65 3560.12  13354.24  3560.65  537.59  118.55 575.08  111.88 -37.49  163.01 
1 1 1 7   -9  9  o 18 608.82  70.90  12330.62  2431.82  12106.50 3438.89  12554.80  3439.34  550.33  112.65 564.41  110.10 -14.08  157.52 
1 1 1 7   -9  10 o 12 401.22  66.58  5291.21   1479.69  0.00     0.00     5291.21   1479.69  ?       ?      401.22  66.58  0.00    66.58  
1 1 1 7   -9  11 o 9  612.16  134.98 16563.93  4615.76  0.00     0.00     16563.93  4615.76  ?       ?      612.16  134.98 0.00    134.98 
1 1 1 7   -9  12 o 8  198.31  21.18  1157.17   237.40   1182.31  333.19   1131.26   338.34   198.04  30.27  193.23  31.59  4.81    43.75  
1 1 1 7   -9  13 o 8  232.18  24.62  1599.22   323.12   1528.29  454.97   1671.41   458.97   222.57  36.90  233.61  35.33  -11.04  51.08  
1 1 1 7   -9  14 o 19 82.92   19.82  208.76    93.08    208.76   93.08    0.00      0.00     82.92   19.82  ?       ?      0.00    19.82  
1 1 1 7   -9  15 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   -9  16 o 9  470.45  56.58  7573.11   1497.33  7389.76  2117.15  7756.60   2117.93  414.79  91.38  429.76  88.79  -14.97  127.41 
1 1 1 7   -9  17 o 13 331.58  60.58  3962.75   1110.67  0.00     0.00     3962.75   1110.67  ?       ?      331.58  60.58  0.00    60.58  
1 1 1 7   -9  18 o 13 224.95  24.58  1534.47   312.26   1476.11  439.98   1593.70   443.23   213.59  37.24  222.99  35.84  -9.40   51.68  
1 1 1 7   -9  19 o 11 127.06  16.19  481.02    115.40   518.63   159.43   439.63    167.25   130.09  22.14  118.47  25.36  11.61   33.66  
1 1 1 7   -9  20 o 3  177.27  20.52  949.30    205.02   841.58   286.53   1062.31   293.47   161.24  32.08  183.52  28.80  -22.28  43.12  
1 1 1 7   -9  21 o 5  213.97  24.01  1409.04   289.86   1355.64  408.41   1463.23   411.46   201.34  36.69  210.39  35.32  -9.05   50.92  
1 1 1 7   -9  22 o 18 149.99  27.63  721.48    229.11   0.00     0.00     721.48    229.11   ?       ?      149.99  27.63  0.00    27.63  
1 1 1 7   -9  23 o 15 265.45  55.84  2915.57   823.90   0.00     0.00     2915.57   823.90   ?       ?      265.45  55.84  0.00    55.84  
1 1 1 7   -8  0  o 11 382.96  40.09  4403.34   868.25   4562.32  1227.91  4244.36   1227.88  381.25  57.92  366.09  60.54  15.16   83.79  
1 1 1 7   -8  1  o 17 500.58  85.17  8468.70   2359.98  8468.70  2359.98  0.00      0.00     500.58  85.17  ?       ?      0.00    85.17  
1 1 1 7   -8  2  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   -8  3  o 19 227.40  34.55  1554.43   436.87   1554.43  436.87   0.00      0.00     227.40  34.55  ?       ?      0.00    34.55  
1 1 1 7   -8  4  o 5  667.25  76.02  14516.15  2860.05  14344.52 4044.64  14687.79  4044.79  614.28  118.99 624.07  117.20 -9.78   167.02 
1 1 1 7   -8  5  o 17 507.98  54.87  7984.84   1574.71  7736.41  2226.82  8233.33   2227.13  478.01  84.23  496.16  80.98  -18.15  116.84 
1 1 1 7   -8  6  o 15 625.18  70.93  12691.33  2500.61  12639.05 3536.35  12743.60  3536.43  580.14  110.21 583.31  109.63 -3.17   155.46 
1 1 1 7   -8  7  o 19 620.65  71.29  12658.53  2493.99  12665.93 3527.01  12651.13  3527.05  573.18  111.20 572.72  111.29 0.46    157.32 
1 1 1 7   -8  8  o 15 609.49  70.42  12283.74  2418.55  12601.57 3420.37  11965.92  3420.32  570.20  108.45 550.25  112.09 19.95   155.97 
1 1 1 7   -8  9  o 14 204.15  21.38  1226.02   246.80   1196.47  348.49   1255.74   349.57   198.88  31.58  204.08  30.80  -5.21   44.11  
1 1 1 7   -8  10 o 5  333.59  35.15  3351.75   662.96   3390.66  937.35   3312.80   937.79   327.11  51.63  322.83  52.40  4.29    73.56  
1 1 1 7   -8  11 o 14 465.01  82.00  7560.86   2108.97  0.00     0.00     7560.86   2108.97  ?       ?      465.01  82.00  0.00    82.00  
1 1 1 7   -8  12 o 5  642.09  153.65 20056.86  5587.75  0.00     0.00     20056.86  5587.75  ?       ?      642.09  153.65 0.00    153.65 
1 1 1 7   -8  13 o 5  508.85  93.22  9405.13   2622.82  0.00     0.00     9405.13   2622.82  ?       ?      508.85  93.22  0.00    93.22  
1 1 1 7   -8  14 o 14 385.97  41.28  4556.22   900.52   4546.96  1272.83  4565.50   1274.22  372.31  61.71  373.14  61.64  -0.83   87.22  
1 1 1 7   -8  15 o 12 27.53   13.88  -322.38   101.50   -322.38  101.50   0.00      0.00     27.53   13.88  ?       ?      0.00    13.88  
1 1 1 7   -8  16 o 13 362.91  63.97  4593.48   1284.11  4593.48  1284.11  0.00      0.00     362.91  63.97  ?       ?      0.00    63.97  
1 1 1 7   -8  17 o 14 176.95  28.67  960.12    281.26   960.12   281.26   0.00      0.00     176.95  28.67  ?       ?      0.00    28.67  
1 1 1 7   -8  18 f 0  452.32  54.75  7020.67   1392.67  6661.99  1969.36  7379.48   1969.71  389.83  89.85  420.35  84.56  -30.52  123.38 
1 1 1 7   -8  19 o 2  179.06  19.88  957.51    200.94   934.04   282.62   981.50    285.75   172.96  29.52  177.62  29.03  -4.66   41.40  
1 1 1 7   -8  20 o 19 67.13   22.43  129.13    101.48   0.00     0.00     129.13    101.48   ?       ?      67.13   22.43  0.00    22.43  
1 1 1 7   -8  21 o 19 118.76  15.96  421.51    106.03   469.49   148.23   371.24    151.73   123.55  21.69  108.57  24.88  14.98   33.01  
1 1 1 7   -8  22 o 7  237.17  26.55  1753.19   355.24   1704.54  502.56   1801.77   502.22   222.63  40.83  230.29  39.40  -7.66   56.74  
1 1 1 7   -8  23 o 1  136.43  16.91  560.26    129.63   617.14   184.61   504.94    182.07   140.35  23.76  125.62  26.10  14.73   35.30  
1 1 1 7   -8  24 o 1  122.45  25.35  482.74    172.31   0.00     0.00     482.74    172.31   ?       ?      122.45  25.35  0.00    25.35  
1 1 1 7   -8  25 f 0  200.41  37.19  1416.24   412.15   0.00     0.00     1416.24   412.15   ?       ?      200.41  37.19  0.00    37.19  
1 1 1 7   -7  0  o 1  121.47  19.20  437.46    129.46   0.00     0.00     437.46    129.46   ?       ?      121.47  19.20  0.00    19.20  
1 1 1 7   -7  1  x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   -7  2  o 8  306.34  47.41  2888.73   806.86   0.00     0.00     2888.73   806.86   ?       ?      306.34  47.41  0.00    47.41  
1 1 1 7   -7  3  o 17 694.34  80.25  15938.38  3139.82  15832.19 4440.33  16044.57  4440.42  635.44  126.18 641.29  125.11 -5.85   177.69 
1 1 1 7   -7  4  o 2  504.83  85.66  8589.73   2393.76  8589.73  2393.76  0.00      0.00     504.83  85.66  ?       ?      0.00    85.66  
1 1 1 7   -7  5  o 8  272.43  41.60  2251.26   629.96   2251.26  629.96   0.00      0.00     272.43  41.60  ?       ?      0.00    41.60  
1 1 1 7   -7  6  o 7  204.15  21.08  1219.79   243.53   1261.64  343.84   1177.65   344.98   205.71  30.00  198.28  31.35  7.43    43.39  
1 1 1 7   -7  7  f 0  330.13  34.24  3236.93   639.53   3263.42  904.28   3210.43   904.59   325.59  49.97  322.67  50.49  2.92    71.04  
1 1 1 7   -7  8  o 10 419.65  44.22  5324.89   1049.37  5470.31  1484.03  5179.46   1484.03  414.23  64.51  401.52  66.72  12.71   92.81  
1 1 1 7   -7  9  f 0  233.94  24.22  1610.14   320.53   1610.52  452.99   1609.77   453.62   230.91  35.29  230.83  35.36  0.07    49.96  
1 1 1 7   -7  10 o 10 305.80  48.02  2912.37   815.32   0.00     0.00     2912.37   815.32   ?       ?      305.80  48.02  0.00    48.02  
1 1 1 7   -7  11 o 3  275.91  28.87  2263.70   450.46   2146.77  636.69   2380.89   637.42   262.91  43.72  278.30  41.14  -15.39  60.03  
1 1 1 7   -7  12 o 12 455.92  49.76  6491.41   1281.28  6427.11  1811.92  6555.73   1812.10  432.19  75.79  437.45  74.85  -5.25   106.52 
1 1 1 7   -7  13 o 1  293.76  46.23  2683.91   753.79   0.00     0.00     2683.91   753.79   ?       ?      293.76  46.23  0.00    46.23  
1 1 1 7   -7  14 o 4  377.18  61.59  4602.85   1287.60  0.00     0.00     4602.85   1287.60  ?       ?      377.18  61.59  0.00    61.59  
1 1 1 7   -7  15 o 5  145.18  16.18  617.16    132.52   743.49   182.52   476.28    192.74   158.66  20.52  125.03  27.59  33.63   34.39  
1 1 1 7   -7  16 o 3  201.53  21.41  1198.21   243.90   1235.60  343.67   1160.27   346.19   201.95  30.60  195.11  32.02  6.85    44.29  
1 1 1 7   -7  17 o 4  430.52  83.01  7084.93   1977.30  7084.93  1977.30  0.00      0.00     430.52  83.01  ?       ?      0.00    83.01  
1 1 1 7   -7  18 o 17 226.03  36.41  1603.47   456.35   1603.47  456.35   0.00      0.00     226.03  36.41  ?       ?      0.00    36.41  
1 1 1 7   -7  19 o 11 72.28   16.51  158.40    66.99    228.52   91.66    77.99     98.14    86.65   18.95  58.35   21.80  28.30   28.89  
1 1 1 7   -7  20 o 16 324.36  36.35  3338.43   665.30   3200.98  940.88   3475.87   940.87   298.27  57.03  314.19  54.12  -15.92  78.62  
1 1 1 7   -7  21 o 11 228.06  24.92  1588.12   320.95   1587.37  454.30   1588.86   453.47   220.35  37.24  220.53  37.14  -0.18   52.59  
1 1 1 7   -7  22 o 17 171.79  29.49  938.24    280.39   0.00     0.00     938.24    280.39   ?       ?      171.79  29.49  0.00    29.49  
1 1 1 7   -7  23 o 16 304.71  65.19  3943.76   1105.85  0.00     0.00     3943.76   1105.85  ?       ?      304.71  65.19  0.00    65.19  
1 1 1 7   -7  24 o 13 127.49  16.77  490.28    119.75   564.45   171.25   419.30    167.53   134.30  23.04  114.09  26.14  20.21   34.85  
1 1 1 7   -7  25 o 6  300.05  36.72  3110.97   619.27   3125.55  876.24   3096.42   875.33   268.38  58.53  266.64  58.77  1.74    82.94  
1 1 1 7   -7  26 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   -6  0  o 6  174.37  18.05  890.77    178.12   927.65   251.80   853.83    252.00   176.25  25.64  168.62  26.94  7.63    37.19  
1 1 1 7   -6  1  x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   -6  2  o 14 190.36  28.96  1087.73   306.47   0.00     0.00     1087.73   306.47   ?       ?      190.36  28.96  0.00    28.96  
1 1 1 7   -6  3  o 6  212.46  21.92  1326.05   263.48   1350.41  372.51   1301.66   372.72   211.91  31.59  207.76  32.30  4.15    45.18  
1 1 1 7   -6  4  o 3  490.71  85.23  8303.56   2313.97  0.00     0.00     8303.56   2313.97  ?       ?      490.71  85.23  0.00    85.23  
1 1 1 7   -6  5  o 5  214.78  32.60  1385.37   389.34   1385.37  389.34   0.00      0.00     214.78  32.60  ?       ?      0.00    32.60  
1 1 1 7   -6  6  f 0  582.30  106.45 12302.36  3427.40  12302.36 3427.40  0.00      0.00     582.30  106.45 ?       ?      0.00    106.45 
1 1 1 7   -6  7  o 9  387.44  40.51  4499.02   887.60   4483.40  1255.13  4514.64   1255.37  377.75  59.87  379.21  59.63  -1.46   84.51  
1 1 1 7   -6  8  f 0  260.23  26.80  1992.01   394.66   2063.07  557.93   1920.84   558.33   261.73  38.26  251.85  39.95  9.88    55.32  
1 1 1 7   -6  9  o 16 553.20  60.01  9520.24   1875.23  9760.40  2651.99  9280.08   2651.96  536.87  89.18  520.70  92.09  16.17   128.19 
1 1 1 7   -6  10 o 7  477.04  79.86  7567.86   2109.72  7567.86  2109.72  0.00      0.00     477.04  79.86  ?       ?      0.00    79.86  
1 1 1 7   -6  11 o 1  389.09  41.14  4577.06   904.92   4289.22  1279.52  4865.11   1279.99  364.44  63.46  391.56  58.75  -27.12  86.48  
1 1 1 7   -6  12 o 19 537.06  60.09  9227.64   1820.87  8886.66  2574.97  9568.68   2575.22  492.47  94.52  516.42  90.14  -23.96  130.61 
1 1 1 7   -6  13 o 14 494.22  54.74  7744.23   1526.98  7724.10  2159.17  7764.36   2159.78  466.21  83.75  467.71  83.50  -1.50   118.27 
1 1 1 7   -6  14 o 19 148.87  24.67  664.34    203.49   0.00     0.00     664.34    203.49   ?       ?      148.87  24.67  0.00    24.67  
1 1 1 7   -6  15 o 10 381.56  62.54  4731.44   1322.46  0.00     0.00     4731.44   1322.46  ?       ?      381.56  62.54  0.00    62.54  
1 1 1 7   -6  16 o 13 165.47  18.27  803.10    170.68   779.81   239.79   827.01    242.99   161.07  26.88  166.11  26.36  -5.04   37.65  
1 1 1 7   -6  17 o 4  475.97  53.14  7222.28   1427.24  7050.11  2018.35  7394.47   2018.48  441.32  82.71  454.94  80.22  -13.62  115.22 
1 1 1 7   -6  18 o 4  396.25  71.79  5631.53   1572.92  5631.53  1572.92  0.00      0.00     396.25  71.79  ?       ?      0.00    71.79  
1 1 1 7   -6  19 o 4  281.52  46.77  2592.93   729.31   2592.93  729.31   0.00      0.00     281.52  46.77  ?       ?      0.00    46.77  
1 1 1 7   -6  20 o 10 271.47  45.54  2430.76   684.62   2430.76  684.62   0.00      0.00     271.47  45.54  ?       ?      0.00    45.54  
1 1 1 7   -6  21 o 14 75.66   17.15  174.34    72.78    141.08   102.18   208.59    103.69   69.54   22.47  82.33   21.65  -12.80  31.20  
1 1 1 7   -6  22 o 1  191.42  21.26  1105.70   229.68   1028.57  324.94   1182.70   324.69   178.78  32.87  193.53  30.21  -14.75  44.65  
1 1 1 7   -6  23 o 3  343.30  41.26  3995.92   796.86   3807.87  1127.11  4183.85   1126.74  299.59  67.19  320.67  63.45  -21.08  92.42  
1 1 1 7   -6  24 o 5  169.52  29.37  925.09    275.43   0.00     0.00     925.09    275.43   ?       ?      169.52  29.37  0.00    29.37  
1 1 1 7   -6  25 o 14 76.55   23.43  182.80    112.61   182.80   112.61   0.00      0.00     76.55   23.43  ?       ?      0.00    23.43  
1 1 1 7   -6  26 o 1  89.15   23.38  256.29    121.14   0.00     0.00     256.29    121.14   ?       ?      89.15   23.38  0.00    23.38  
1 1 1 7   -5  0  o 18 115.99  17.98  399.69    115.84   399.69   115.84   0.00      0.00     115.99  17.98  ?       ?      0.00    17.98  
1 1 1 7   -5  1  o 18 228.74  35.29  1601.80   448.52   0.00     0.00     1601.80   448.52   ?       ?      228.74  35.29  0.00    35.29  
1 1 1 7   -5  2  o 14 537.96  114.22 12271.16  3418.30  0.00     0.00     12271.16  3418.30  ?       ?      537.96  114.22 0.00    114.22 
1 1 1 7   -5  3  o 13 398.61  67.64  5353.44   1492.43  0.00     0.00     5353.44   1492.43  ?       ?      398.61  67.64  0.00    67.64  
1 1 1 7   -5  4  o 14 243.53  25.23  1754.59   347.63   1826.47  491.56   1682.68   491.70   244.89  36.04  234.19  37.86  10.70   52.28  
1 1 1 7   -5  5  o 9  235.48  24.32  1636.05   323.99   1482.89  457.62   1789.97   458.75   219.98  37.59  243.55  33.72  -23.56  50.49  
1 1 1 7   -5  6  o 17 366.79  58.97  4300.56   1199.57  4300.56  1199.57  0.00      0.00     366.79  58.97  ?       ?      0.00    58.97  
1 1 1 7   -5  7  o 6  573.10  107.04 12175.50  3391.97  12175.50 3391.97  0.00      0.00     573.10  107.04 ?       ?      0.00    107.04 
1 1 1 7   -5  8  o 5  640.99  126.22 16080.07  4479.21  16080.07 4479.21  0.00      0.00     640.99  126.22 ?       ?      0.00    126.22 
1 1 1 7   -5  9  o 5  316.11  32.72  2960.79   585.16   2907.63  827.30   3014.00   827.76   307.71  48.43  313.80  47.43  -6.09   67.79  
1 1 1 7   -5  10 o 13 881.23  111.86 28084.39  5531.63  27751.39 7822.88  28417.41  7822.94  751.92  182.99 766.50  180.74 -14.59  257.20 
1 1 1 7   -5  11 o 9  256.45  26.45  1934.92   383.75   2013.37  542.25   1856.20   543.16   258.56  37.64  247.47  39.57  11.09   54.61  
1 1 1 7   -5  12 o 7  152.24  16.14  676.72    138.94   734.97   195.10   616.77    197.92   157.61  22.18  143.55  24.92  14.06   33.36  
1 1 1 7   -5  13 o 10 450.10  50.17  6285.93   1274.26  -23.15   1799.56  12630.28  1804.59  184.75  82.66  640.10  49.49  -455.34 96.34  
1 1 1 7   -5  14 o 8  211.43  21.94  1316.02   262.42   1511.64  369.61   1117.17   372.64   224.69  29.36  190.81  35.32  33.87   45.93  
1 1 1 7   -5  15 o 17 207.56  21.95  1269.07   257.63   1139.60  362.68   1400.93   366.02   193.17  33.94  215.83  30.38  -22.65  45.55  
1 1 1 7   -5  16 o 2  421.63  71.34  5964.86   1665.19  0.00     0.00     5964.86   1665.19  ?       ?      421.63  71.34  0.00    71.34  
1 1 1 7   -5  17 o 8  124.31  23.13  464.61    159.02   0.00     0.00     464.61    159.02   ?       ?      124.31  23.13  0.00    23.13  
1 1 1 7   -5  18 o 14 209.91  22.26  1301.13   264.13   1300.15  373.01   1302.13   374.06   206.68  32.51  206.81  32.58  -0.13   46.03  
1 1 1 7   -5  19 o 16 270.30  28.74  2199.64   439.06   2188.82  621.06   2210.45   620.80   262.65  42.65  264.12  42.38  -1.48   60.12  
1 1 1 7   -5  20 o 11 195.02  31.42  1177.22   339.85   1177.22  339.85   0.00      0.00     195.02  31.42  ?       ?      0.00    31.42  
1 1 1 7   -5  21 o 9  283.03  48.43  2695.05   758.61   2695.05  758.61   0.00      0.00     283.03  48.43  ?       ?      0.00    48.43  
1 1 1 7   -5  22 o 1  238.71  26.08  1739.83   351.53   1665.84  497.65   1813.51   496.63   224.93  40.01  236.39  37.88  -11.46  55.09  
1 1 1 7   -5  23 o 10 216.78  24.06  1437.00   294.38   1328.06  416.75   1545.48   415.89   199.88  37.70  218.43  34.30  -18.55  50.97  
1 1 1 7   -5  24 o 19 110.13  16.19  364.88    99.33    308.96   139.33   422.67    141.64   98.70   24.66  116.70  21.95  -18.00  33.01  
1 1 1 7   -5  25 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   -5  26 o 1  85.69   17.41  226.97    82.70    232.76   123.06   222.20    111.67   85.23   24.09  83.51   22.70  1.73    33.10  
1 1 1 7   -5  27 o 4  214.12  25.27  1469.76   304.69   1371.65  432.04   1566.84   429.78   192.10  40.46  209.49  37.09  -17.40  54.89  
1 1 1 7   -4  0  x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   -4  1  o 2  145.45  22.12  632.61    178.89   632.61   178.89   0.00      0.00     145.45  22.12  ?       ?      0.00    22.12  
1 1 1 7   -4  2  o 12 468.07  52.69  7049.95   1391.20  7363.14  1967.54  6736.81   1967.37  450.62  78.93  425.31  83.56  25.31   114.95 
1 1 1 7   -4  3  o 1  184.22  28.14  1024.91   288.18   0.00     0.00     1024.91   288.18   ?       ?      184.22  28.14  0.00    28.14  
1 1 1 7   -4  4  f 0  177.89  27.15  952.87    268.45   0.00     0.00     952.87    268.45   ?       ?      177.89  27.15  0.00    27.15  
1 1 1 7   -4  5  o 13 284.49  29.76  2419.86   478.81   2536.56  677.54   2303.43   676.75   285.64  42.62  270.74  45.13  14.90   62.07  
1 1 1 7   -4  6  o 9  583.69  68.05  11360.89  2237.62  11277.14 3164.43  11444.65  3164.52  530.74  107.55 536.24  106.55 -5.50   151.40 
1 1 1 7   -4  7  o 18 584.44  123.63 14424.77  4018.20  14424.77 4018.20  0.00      0.00     584.44  123.63 ?       ?      0.00    123.63 
1 1 1 7   -4  8  o 12 439.35  73.83  6442.73   1796.20  6442.73  1796.20  0.00      0.00     439.35  73.83  ?       ?      0.00    73.83  
1 1 1 7   -4  9  o 17 517.32  90.29  9272.22   2583.85  9272.22  2583.85  0.00      0.00     517.32  90.29  ?       ?      0.00    90.29  
1 1 1 7   -4  10 o 2  193.64  20.13  1097.01   220.51   1219.55  312.57   975.59    311.13   202.72  27.57  180.06  31.23  22.66   41.66  
1 1 1 7   -4  11 o 1  554.39  60.14  9557.94   1883.24  9896.68  2663.35  9219.21   2663.27  541.34  88.78  518.60  92.87  22.75   128.48 
1 1 1 7   -4  12 o 12 147.31  15.60  632.96    129.91   701.67   182.14   561.82    185.34   154.24  21.13  137.06  24.45  17.18   32.31  
1 1 1 7   -4  13 o 9  282.59  30.03  2365.18   479.73   -124.55  675.45   4899.54   681.48   116.69  51.51  408.08  29.28  -291.39 59.25  
1 1 1 7   -4  14 o 14 643.19  152.39 19886.52  5539.70  19886.52 5539.70  0.00      0.00     643.19  152.39 ?       ?      0.00    152.39 
1 1 1 7   -4  15 o 11 157.19  17.07  724.08    151.56   697.87   214.53   750.19    214.14   152.43  25.41  158.44  24.32  -6.01   35.17  
1 1 1 7   -4  16 o 13 304.89  32.07  2785.47   552.95   2772.94  782.46   2797.98   781.51   297.12  47.47  298.65  47.15  -1.53   66.90  
1 1 1 7   -4  17 o 13 222.64  34.75  1505.99   429.68   0.00     0.00     1505.99   429.68   ?       ?      222.64  34.75  0.00    34.75  
1 1 1 7   -4  18 o 11 430.52  74.21  6332.25   1767.97  0.00     0.00     6332.25   1767.97  ?       ?      430.52  74.21  0.00    74.21  
1 1 1 7   -4  19 o 9  326.69  34.88  3239.27   643.98   3142.44  911.33   3335.84   910.12   311.36  52.88  322.28  50.88  -10.93  73.38  
1 1 1 7   -4  20 f 0  212.08  22.73  1338.43   272.41   1457.46  387.24   1221.83   383.28   217.88  31.91  197.85  35.03  20.02   47.38  
1 1 1 7   -4  21 o 1  249.69  41.44  2012.32   573.20   2012.32  573.20   0.00      0.00     249.69  41.44  ?       ?      0.00    41.44  
1 1 1 7   -4  22 o 12 232.91  38.99  1755.87   502.93   1755.87  502.93   0.00      0.00     232.91  38.99  ?       ?      0.00    38.99  
1 1 1 7   -4  23 o 11 159.26  18.70  759.11    167.68   833.62   242.78   691.15    231.86   163.72  26.76  148.11  28.30  15.61   38.95  
1 1 1 7   -4  24 o 13 114.05  26.29  413.90    168.63   413.90   168.63   0.00      0.00     114.05  26.29  ?       ?      0.00    26.29  
1 1 1 7   -4  25 o 16 259.59  49.50  2516.53   710.73   0.00     0.00     2516.53   710.73   ?       ?      259.59  49.50  0.00    49.50  
1 1 1 7   -4  26 o 5  67.64   19.35  141.65    78.93    75.54    135.02   175.97    97.28    62.48   24.95  74.95   21.50  -12.47  32.93  
1 1 1 7   -4  27 o 2  112.87  17.52  391.02    109.85   398.72   168.98   385.38    144.57   109.70  27.01  109.33  23.72  0.37    35.95  
1 1 1 7   -4  28 o 8  107.30  18.34  358.60    108.89   316.46   175.25   385.10    138.98   96.36   29.18  109.08  22.92  -12.72  37.11  
1 1 1 7   -3  0  o 10 135.70  20.76  550.12    156.61   0.00     0.00     550.12    156.61   ?       ?      135.70  20.76  0.00    20.76  
1 1 1 7   -3  1  o 8  326.14  34.68  3242.45   639.28   3184.05  903.88   3300.91   904.28   312.24  52.27  318.82  51.14  -6.58   73.13  
1 1 1 7   -3  2  o 10 412.69  45.39  5367.70   1057.63  5283.11  1495.58  5452.33   1495.85  387.53  69.79  395.20  68.41  -7.67   97.73  
1 1 1 7   -3  3  o 4  124.08  13.11  449.95    91.94    445.85   129.48   454.13    130.58   122.31  19.06  123.47  19.03  -1.16   26.94  
1 1 1 7   -3  4  o 16 86.42   14.94  222.35    71.43    0.00     0.00     222.35    71.43    ?       ?      86.42   14.94  0.00    14.94  
1 1 1 7   -3  5  o 18 216.18  33.32  1428.22   400.27   0.00     0.00     1428.22   400.27   ?       ?      216.18  33.32  0.00    33.32  
1 1 1 7   -3  6  o 8  611.63  74.94  13078.71  2576.26  13147.41 3643.34  13010.01  3643.41  542.69  120.12 538.34  120.86 4.35    170.40 
1 1 1 7   -3  7  o 15 502.52  56.44  8122.76   1600.11  7906.65  2262.76  8338.93   2263.02  462.27  88.49  478.53  85.52  -16.26  123.06 
1 1 1 7   -3  8  o 9  218.19  33.38  1443.60   404.85   1443.60  404.85   0.00      0.00     218.19  33.38  ?       ?      0.00    33.38  
1 1 1 7   -3  9  o 3  506.02  91.49  9187.50   2559.97  9187.50  2559.97  0.00      0.00     506.02  91.49  ?       ?      0.00    91.49  
1 1 1 7   -3  10 o 1  513.37  90.05  9176.12   2556.98  9176.12  2556.98  0.00      0.00     513.37  90.05  ?       ?      0.00    90.05  
1 1 1 7   -3  11 o 16 293.32  30.33  2544.32   503.31   2641.21  711.81   2447.45   711.75   294.58  43.39  282.62  45.41  11.96   62.81  
1 1 1 7   -3  12 o 18 486.32  51.74  7230.96   1422.27  -43.44   2009.25  14536.43  2013.54  198.37  88.13  691.59  51.08  -493.22 101.86 
1 1 1 7   -3  13 o 9  363.53  37.90  3947.70   779.43   4186.65  1102.22  3708.70   1102.33  367.56  53.83  343.61  57.94  23.95   79.09  
1 1 1 7   -3  14 o 10 379.53  39.87  4334.68   855.75   4404.50  1210.45  4264.92   1209.98  373.25  58.41  366.54  59.55  6.71    83.41  
1 1 1 7   -3  15 o 12 353.88  57.06  4007.16   1119.80  4007.16  1119.80  0.00      0.00     353.88  57.06  ?       ?      0.00    57.06  
1 1 1 7   -3  16 o 16 133.52  15.35  522.41    115.55   455.66   164.72   587.06    162.12   122.75  24.24  140.57  20.71  -17.82  31.88  
1 1 1 7   -3  17 o 10 222.23  34.67  1504.69   427.92   0.00     0.00     1504.69   427.92   ?       ?      222.23  34.67  0.00    34.67  
1 1 1 7   -3  18 o 6  479.49  86.77  8246.87   2300.42  0.00     0.00     8246.87   2300.42  ?       ?      479.49  86.77  0.00    86.77  
1 1 1 7   -3  19 o 8  134.97  23.79  547.69    177.59   0.00     0.00     547.69    177.59   ?       ?      134.97  23.79  0.00    23.79  
1 1 1 7   -3  20 o 14 369.67  40.23  4235.08   839.93   4100.98  1188.68  4368.81   1187.01  347.37  61.88  360.91  59.35  -13.55  85.74  
1 1 1 7   -3  21 o 3  284.15  47.56  2653.60   748.43   2653.60  748.43   0.00      0.00     284.15  47.56  ?       ?      0.00    47.56  
1 1 1 7   -3  22 o 3  279.49  47.96  2623.45   741.72   2623.45  741.72   0.00      0.00     279.49  47.96  ?       ?      0.00    47.96  
1 1 1 7   -3  23 o 10 284.46  50.89  2833.71   800.52   2833.71  800.52   0.00      0.00     284.46  50.89  ?       ?      0.00    50.89  
1 1 1 7   -3  24 x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   -3  25 o 5  181.89  20.91  1007.62   214.39   999.00   309.79   1015.55   297.01   174.74  32.06  177.37  30.25  -2.63   44.08  
1 1 1 7   -3  26 f 0  219.63  24.90  1510.24   308.37   1579.20  441.32   1444.44   431.06   214.45  37.20  204.00  38.21  10.45   53.33  
1 1 1 7   -3  27 o 2  106.46  18.29  349.85    107.75   287.86   166.80   394.24    141.16   93.48   28.50  111.19  22.88  -17.71  36.55  
1 1 1 7   -3  28 o 15 177.86  21.64  994.72    216.37   993.46   314.24   995.86    298.37   167.96  33.76  170.00  31.74  -2.04   46.34  
1 1 1 7   -2  0  o 9  308.54  32.59  2885.09   568.60   2853.82  804.00   2916.38   804.25   297.66  48.74  301.37  48.10  -3.71   68.48  
1 1 1 7   -2  1  o 2  633.40  83.05  14980.03  2947.12  14657.48 4167.77  15302.60  4167.93  522.59  137.20 542.06  134.57 -19.47  192.18 
1 1 1 7   -2  2  o 4  200.66  20.72  1188.77   235.28   1177.26  332.48   1200.32   333.00   196.61  30.44  198.67  30.14  -2.06   42.84  
1 1 1 7   -2  3  o 12 268.63  28.08  2162.30   426.60   2089.24  603.38   2235.32   603.23   257.45  42.29  267.37  40.57  -9.93   58.61  
1 1 1 7   -2  4  o 3  430.01  47.72  5874.12   1158.15  6038.47  1637.91  5709.79   1637.83  412.93  71.69  398.55  74.32  14.38   103.26 
1 1 1 7   -2  5  o 15 188.55  28.87  1077.78   302.60   0.00     0.00     1077.78   302.60   ?       ?      188.55  28.87  0.00    28.87  
1 1 1 7   -2  6  f 0  414.54  74.20  6102.62   1700.80  0.00     0.00     6102.62   1700.80  ?       ?      414.54  74.20  0.00    74.20  
1 1 1 7   -2  7  o 17 592.87  71.86  12161.17  2395.87  12676.16 3388.33  11646.20  3388.22  544.60  112.12 511.04  117.89 33.56   162.69 
1 1 1 7   -2  8  o 15 153.75  23.54  706.87    201.21   706.87   201.21   0.00      0.00     153.75  23.54  ?       ?      0.00    23.54  
1 1 1 7   -2  9  o 2  379.09  62.71  4723.06   1317.03  4723.06  1317.03  0.00      0.00     379.09  62.71  ?       ?      0.00    62.71  
1 1 1 7   -2  10 o 17 177.91  27.07  946.97    267.75   946.97   267.75   0.00      0.00     177.91  27.07  ?       ?      0.00    27.07  
1 1 1 7   -2  11 o 9  467.65  78.97  7336.27   2044.58  7336.27  2044.58  0.00      0.00     467.65  78.97  ?       ?      0.00    78.97  
1 1 1 7   -2  12 o 7  195.32  20.92  1117.80   230.96   -63.63   323.40   2347.61   329.95   81.96   35.93  283.98  20.37  -202.02 41.30  
1 1 1 7   -2  13 o 9  527.96  90.92  9531.30   2656.08  9531.30  2656.08  0.00      0.00     527.96  90.92  ?       ?      0.00    90.92  
1 1 1 7   -2  14 o 15 574.25  63.22  10397.29  2049.72  10181.49 2898.66  10613.10  2898.81  537.37  97.56  551.45  95.00  -14.08  136.17 
1 1 1 7   -2  15 o 5  115.77  13.39  391.59    87.37    353.04   121.97   432.24    125.23   108.61  20.31  120.79  18.66  -12.18  27.58  
1 1 1 7   -2  16 o 16 222.61  23.23  1461.63   292.47   1440.66  412.85   1482.76   414.39   217.71  34.16  221.08  33.72  -3.37   47.99  
1 1 1 7   -2  17 o 10 82.47   18.69  205.33    86.41    205.33   86.41    0.00      0.00     82.47   18.69  ?       ?      0.00    18.69  
1 1 1 7   -2  18 o 11 256.25  26.88  1949.35   389.59   1925.08  550.22   1973.76   551.72   249.95  39.67  253.35  39.20  -3.40   55.77  
1 1 1 7   -2  19 o 14 611.35  156.93 19867.43  5535.28  0.00     0.00     19867.43  5535.28  ?       ?      611.35  156.93 0.00    156.93 
1 1 1 7   -2  20 o 14 234.04  36.96  1687.28   480.13   0.00     0.00     1687.28   480.13   ?       ?      234.04  36.96  0.00    36.96  
1 1 1 7   -2  21 o 10 238.04  38.22  1779.85   504.57   1779.85  504.57   0.00      0.00     238.04  38.22  ?       ?      0.00    38.22  
1 1 1 7   -2  22 o 7  243.77  26.18  1797.60   360.63   1828.28  510.28   1766.99   509.75   239.17  38.47  234.59  39.24  4.58    54.95  
1 1 1 7   -2  23 o 5  61.18   21.38  100.40    92.46    100.40   92.46    0.00      0.00     61.18   21.38  ?       ?      0.00    21.38  
1 1 1 7   -2  24 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   -2  25 o 11 253.97  29.15  2043.11   417.24   1744.65  589.60   2342.50   590.53   217.40  48.48  261.35  40.68  -43.95  63.29  
1 1 1 7   -2  26 o 16 110.13  23.60  384.78    144.73   384.78   144.73   0.00      0.00     110.13  23.60  ?       ?      0.00    23.60  
1 1 1 7   -2  27 o 14 123.21  17.01  461.58    117.13   490.95   167.37   433.38    163.98   123.75  24.43  115.63  25.40  8.12    35.24  
1 1 1 7   -2  28 o 3  66.75   19.14  139.76    77.17    143.63   109.46   135.93    108.79   68.78   23.29  67.43   23.21  1.35    32.89  
1 1 1 7   -2  29 o 16 58.43   19.80  101.50    79.09    117.91   117.00   87.70     107.33   64.76   23.87  59.18   22.64  5.58    32.90  
1 1 1 7   -1  0  o 6  284.51  29.92  2436.61   481.39   2512.10  680.72   2361.08   680.85   282.06  43.43  272.35  45.13  9.71    62.63  
1 1 1 7   -1  1  o 2  274.86  28.90  2268.57   449.13   2416.20  635.15   2120.93   635.18   277.86  41.05  258.24  44.45  19.62   60.51  
1 1 1 7   -1  2  o 7  471.38  53.42  7219.21   1420.12  7044.72  2008.27  7393.74   2008.45  431.37  84.12  445.43  81.55  -14.06  117.16 
1 1 1 7   -1  3  o 10 581.41  71.81  11912.64  2345.91  11879.21 3317.57  11946.06  3317.67  509.67  116.00 511.89  115.64 -2.22   163.80 
1 1 1 7   -1  4  o 4  478.10  54.49  7450.69   1468.95  7546.31  2077.40  7355.07   2077.41  447.54  83.94  439.93  85.34  7.61    119.70 
1 1 1 7   -1  5  o 5  139.96  21.39  585.55    166.39   0.00     0.00     585.55    166.39   ?       ?      139.96  21.39  0.00    21.39  
1 1 1 7   -1  6  o 9  369.32  63.35  4644.56   1294.84  0.00     0.00     4644.56   1294.84  ?       ?      369.32  63.35  0.00    63.35  
1 1 1 7   -1  7  o 5  128.93  13.65  485.95    99.52    508.24   141.43   464.08    140.06   130.72  19.44  124.60  20.28  6.12    28.09  
1 1 1 7   -1  8  o 15 669.89  87.83  16728.65  3296.29  17131.67 4661.71  16325.65  4661.61  575.28  142.02 552.27  145.16 23.01   203.08 
1 1 1 7   -1  9  o 10 200.13  20.74  1178.94   234.78   1184.20  331.87   1173.66   332.20   197.94  30.16  196.98  30.35  0.96    42.79  
1 1 1 7   -1  10 o 6  613.26  148.23 18526.04  5160.08  18526.04 5160.08  0.00      0.00     613.26  148.23 ?       ?      0.00    148.23 
1 1 1 7   -1  11 o 12 12.55   6.17   -33.15    15.62    -33.15   15.62    0.00      0.00     12.55   6.17   ?       ?      0.00    6.17   
1 1 1 7   -1  12 o 5  806.42  101.17 23255.65  4580.58  22826.16 6477.83  23685.17  6478.01  690.41  165.58 710.99  162.30 -20.58  231.86 
1 1 1 7   -1  13 o 18 410.62  43.19  5083.91   1002.81  5062.30  1418.11  5105.52   1418.27  398.82  64.11  400.74  63.79  -1.92   90.44  
1 1 1 7   -1  14 o 6  290.26  30.00  2490.61   492.75   2525.85  696.66   2455.34   697.05   287.91  43.51  283.51  44.28  4.41    62.07  
1 1 1 7   -1  15 o 6  242.21  25.15  1727.26   344.61   1557.16  486.94   1897.95   487.76   225.92  38.95  251.32  34.74  -25.41  52.19  
1 1 1 7   -1  16 o 13 207.66  21.66  1267.97   254.42   1267.23  359.19   1268.72   360.43   204.94  31.54  205.04  31.64  -0.09   44.67  
1 1 1 7   -1  17 o 1  378.99  40.61  4400.91   869.77   4337.09  1229.97  4464.75   1230.11  362.46  61.30  368.67  60.20  -6.21   85.91  
1 1 1 7   -1  18 o 13 281.24  44.58  2476.76   695.70   2476.76  695.70   0.00      0.00     281.24  44.58  ?       ?      0.00    44.58  
1 1 1 7   -1  19 o 7  555.45  63.94  10137.74  2001.76  9893.68  2830.82  10381.84  2831.02  504.37  101.29 521.13  98.23  -16.76  141.10 
1 1 1 7   -1  20 o 6  373.25  62.70  4632.40   1295.89  0.00     0.00     4632.40   1295.89  ?       ?      373.25  62.70  0.00    62.70  
1 1 1 7   -1  21 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   -1  22 o 15 173.03  28.24  920.43    270.85   920.43   270.85   0.00      0.00     173.03  28.24  ?       ?      0.00    28.24  
1 1 1 7   -1  23 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   -1  24 o 13 134.37  24.75  560.39    183.91   560.39   183.91   0.00      0.00     134.37  24.75  ?       ?      0.00    24.75  
1 1 1 7   -1  25 o 10 228.81  40.47  1792.18   512.12   1792.18  512.12   0.00      0.00     228.81  40.47  ?       ?      0.00    40.47  
1 1 1 7   -1  26 o 4  135.91  25.95  589.88    195.09   589.88   195.09   0.00      0.00     135.91  25.95  ?       ?      0.00    25.95  
1 1 1 7   -1  27 o 17 196.64  22.93  1207.14   254.00   1084.50  360.96   1327.43   357.47   175.59  36.98  198.87  32.43  -23.28  49.19  
1 1 1 7   -1  28 o 2  139.02  18.17  594.01    141.54   503.96   203.74   678.01    196.78   121.68  29.48  145.02  24.51  -23.33  38.34  
1 1 1 7   -1  29 o 3  79.12   19.58  200.74    88.42    167.96   128.69   230.06    121.70   73.17   25.24  83.39   24.08  -10.22  34.89  
1 1 1 7   0   0  o 12 226.89  23.50  1527.52   301.62   1523.06  426.45   1531.99   426.66   222.53  34.50  223.24  34.40  -0.71   48.72  
1 1 1 7   0   1  o 2  18.91   7.76   3.25      13.47    -2.68    17.88    11.04     20.48    19.75   8.55   25.19   9.82   -5.44   13.02  
1 1 1 7   0   2  o 3  235.55  24.46  1649.42   325.89   1662.95  460.79   1635.87   460.96   232.19  35.71  230.09  36.08  2.09    50.77  
1 1 1 7   0   3  o 12 115.73  12.13  391.03    79.38    422.67   112.15   359.27    112.36   119.50  16.81  109.63  18.51  9.86    25.01  
1 1 1 7   0   4  o 14 227.88  23.69  1541.48   305.37   1601.15  432.08   1481.93   431.64   228.50  33.97  219.03  35.55  9.48    49.17  
1 1 1 7   0   5  o 19 458.02  89.76  8167.73   2275.57  0.00     0.00     8167.73   2275.57  ?       ?      458.02  89.76  0.00    89.76  
1 1 1 7   0   6  o 3  214.29  33.07  1407.02   393.74   0.00     0.00     1407.02   393.74   ?       ?      214.29  33.07  0.00    33.07  
1 1 1 7   0   7  o 14 203.00  31.18  1255.26   351.78   0.00     0.00     1255.26   351.78   ?       ?      203.00  31.18  0.00    31.18  
1 1 1 7   0   8  o 14 663.99  87.60  16538.24  3257.69  16584.66 4607.06  16491.81  4607.09  557.40  143.22 554.73  143.57 2.67    202.79 
1 1 1 7   0   9  o 6  125.19  13.43  457.98    95.05    462.47   133.44   453.35    135.42   124.68  19.26  123.31  19.80  1.38    27.62  
1 1 1 7   0   10 o 1  476.08  87.35  8251.97   2299.27  8251.97  2299.27  0.00      0.00     476.08  87.35  ?       ?      0.00    87.35  
1 1 1 7   0   11 o 9  14.35   7.07   -44.27    20.60    -44.27   20.60    0.00      0.00     14.35   7.07   ?       ?      0.00    7.07   
1 1 1 7   0   12 o 6  367.26  58.58  4278.81   1193.58  4278.81  1193.58  0.00      0.00     367.26  58.58  ?       ?      0.00    58.58  
1 1 1 7   0   13 o 15 101.89  12.21  303.24    70.01    319.08   97.32    286.25    100.78   103.79  16.92  97.89   18.61  5.90    25.15  
1 1 1 7   0   14 o 16 692.58  79.88  15827.54  3117.72  15763.97 4409.11  15891.10  4409.15  635.84  125.25 639.34  124.61 -3.51   176.68 
1 1 1 7   0   15 o 2  527.35  57.45  8681.49   1711.06  8802.17  2419.86  8560.82   2419.76  507.30  86.17  498.77  87.71  8.53    122.96 
1 1 1 7   0   16 o 4  454.60  78.47  7078.73   1973.91  0.00     0.00     7078.73   1973.91  ?       ?      454.60  78.47  0.00    78.47  
1 1 1 7   0   17 o 17 324.96  34.29  3184.06   630.12   3203.56  891.19   3164.57   891.07   317.47  50.60  315.28  50.97  2.19    71.82  
1 1 1 7   0   18 o 8  270.86  28.42  2190.55   435.40   2298.54  615.97   2082.73   615.53   272.31  40.65  257.82  43.11  14.49   59.25  
1 1 1 7   0   19 o 4  241.93  25.47  1735.48   348.47   1728.81  492.33   1742.17   493.29   237.27  37.38  238.24  37.29  -0.97   52.80  
1 1 1 7   0   20 o 3  282.87  45.08  2509.30   707.53   0.00     0.00     2509.30   707.53   ?       ?      282.87  45.08  0.00    45.08  
1 1 1 7   0   21 o 16 188.55  30.15  1084.21   315.31   0.00     0.00     1084.21   315.31   ?       ?      188.55  30.15  0.00    30.15  
1 1 1 7   0   22 f 0  373.98  70.92  5247.20   1466.79  5247.20  1466.79  0.00      0.00     373.98  70.92  ?       ?      0.00    70.92  
1 1 1 7   0   23 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   0   24 f 0  177.36  29.94  992.14    294.00   992.14   294.00   0.00      0.00     177.36  29.94  ?       ?      0.00    29.94  
1 1 1 7   0   25 o 6  123.41  24.22  477.48    165.42   477.48   165.42   0.00      0.00     123.41  24.22  ?       ?      0.00    24.22  
1 1 1 7   0   26 o 3  110.49  24.26  388.96    149.64   388.96   149.64   0.00      0.00     110.49  24.26  ?       ?      0.00    24.26  
1 1 1 7   0   27 o 15 259.23  31.02  2218.69   452.50   1948.81  640.16   2488.18   639.71   218.36  51.85  257.87  44.84  -39.51  68.55  
1 1 1 7   0   28 o 6  115.67  17.38  411.29    111.82   261.60   159.39   556.37    156.92   88.93   27.99  132.88  21.29  -43.95  35.16  
1 1 1 7   0   29 o 1  38.83   17.17  -15.50    75.44    -7.70    108.06   -22.92    105.37   47.31   20.75  45.20   20.13  2.11    28.91  
1 1 1 7   0   30 o 16 174.68  39.26  1208.93   384.12   1208.93  384.12   0.00      0.00     174.68  39.26  ?       ?      0.00    39.26  
1 1 1 7   1   0  o 6  467.32  52.66  7062.22   1388.24  6824.60  1963.17  7299.88   1963.36  426.27  83.21  445.56  79.69  -19.28  115.21 
1 1 1 7   1   1  o 15 255.11  26.55  1942.77   383.10   1914.72  541.67   1970.86   541.90   247.77  39.40  251.76  38.73  -4.00   55.25  
1 1 1 7   1   2  o 11 264.28  27.61  2090.06   412.78   2116.30  583.66   2063.81   583.84   260.20  40.38  256.57  41.02  3.63    57.56  
1 1 1 7   1   3  o 9  81.81   9.53   195.43    43.92    211.65   64.07    181.06    60.31    84.48   13.68  77.94   13.99  6.54    19.57  
1 1 1 7   1   4  o 3  258.03  27.01  1989.74   394.14   2097.01  557.61   1882.62   557.20   259.93  38.53  244.81  41.10  15.12   56.34  
1 1 1 7   1   5  o 4  123.01  18.84  450.57    128.79   0.00     0.00     450.57    128.79   ?       ?      123.01  18.84  0.00    18.84  
1 1 1 7   1   6  o 3  386.77  67.90  5211.39   1452.52  0.00     0.00     5211.39   1452.52  ?       ?      386.77  67.90  0.00    67.90  
1 1 1 7   1   7  o 6  528.18  62.14  9366.18   1848.17  9742.09  2613.77  8990.31   2613.64  494.05  95.61  466.72  100.52 27.33   138.73 
1 1 1 7   1   8  o 16 450.49  50.19  6465.07   1275.85  6703.59  1804.41  6226.60   1804.25  434.24  75.10  414.30  78.74  19.94   108.81 
1 1 1 7   1   9  o 13 586.75  70.20  11783.51  2317.76  11337.35 3277.66  12229.75  3277.94  511.78  114.44 541.12  109.29 -29.34  158.24 
1 1 1 7   1   10 o 8  14.91   7.43   -66.26    25.44    -66.26   25.44    0.00      0.00     14.91   7.43   ?       ?      0.00    7.43   
1 1 1 7   1   11 o 9  187.21  28.40  1051.85   295.63   1051.85  295.63   0.00      0.00     187.21  28.40  ?       ?      0.00    28.40  
1 1 1 7   1   12 o 19 639.64  138.03 17661.87  4919.63  17661.87 4919.63  0.00      0.00     639.64  138.03 ?       ?      0.00    138.03 
1 1 1 7   1   13 o 15 374.85  39.22  4217.85   831.48   4081.85  1175.73  4353.93   1176.05  359.19  59.07  372.43  56.80  -13.24  81.95  
1 1 1 7   1   14 o 10 281.05  29.04  2333.16   461.79   2284.04  652.95   2382.31   653.19   273.59  42.99  279.91  41.94  -6.32   60.06  
1 1 1 7   1   15 o 2  66.29   13.05  131.05    47.89    124.71   65.56    138.31    70.13    64.59   17.33  67.93   17.78  -3.34   24.83  
1 1 1 7   1   16 o 18 442.56  75.43  6624.85   1847.70  0.00     0.00     6624.85   1847.70  ?       ?      442.56  75.43  0.00    75.43  
1 1 1 7   1   17 o 4  161.57  17.37  765.56    158.60   753.02   223.70   778.22    224.89   158.35  25.47  161.12  25.13  -2.77   35.79  
1 1 1 7   1   18 o 3  273.87  28.81  2243.19   446.16   2172.57  630.96   2313.82   630.97   263.12  43.27  272.52  41.65  -9.40   60.06  
1 1 1 7   1   19 o 7  245.50  25.85  1789.81   358.79   1824.69  507.14   1754.87   507.68   243.63  37.46  238.45  38.39  5.18    53.64  
1 1 1 7   1   20 o 17 313.87  33.29  2969.65   590.63   2966.09  835.47   2973.21   835.08   305.40  49.33  305.83  49.24  -0.43   69.70  
1 1 1 7   1   21 o 16 185.76  29.95  1051.36   308.51   0.00     0.00     1051.36   308.51   ?       ?      185.76  29.95  0.00    29.95  
1 1 1 7   1   22 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   1   23 o 15 310.95  56.47  3460.96   970.85   0.00     0.00     3460.96   970.85   ?       ?      310.95  56.47  0.00    56.47  
1 1 1 7   1   24 f 0  90.11   16.80  245.85    83.70    241.93   122.12   249.33    114.93   88.17   23.64  89.59   22.41  -1.42   32.57  
1 1 1 7   1   25 o 18 169.02  29.82  916.00    278.73   916.00   278.73   0.00      0.00     169.02  29.82  ?       ?      0.00    29.82  
1 1 1 7   1   26 o 7  223.45  41.20  1770.12   509.02   1770.12  509.02   0.00      0.00     223.45  41.20  ?       ?      0.00    41.20  
1 1 1 7   1   27 o 7  156.60  19.08  751.13    168.00   700.56   239.78   799.89    235.46   144.97  29.81  156.97  27.11  -12.00  40.29  
1 1 1 7   1   28 o 17 166.72  20.18  863.88    189.17   936.10   272.57   796.76    262.75   166.87  29.53  152.48  31.07  14.39   42.87  
1 1 1 7   1   29 o 15 159.84  34.67  935.52    308.93   935.52   308.93   0.00      0.00     159.84  34.67  ?       ?      0.00    34.67  
1 1 1 7   1   30 o 10 80.86   22.06  216.99    105.24   159.81   177.89   247.78    130.54   74.10   28.93  85.26   25.03  -11.16  38.26  
1 1 1 7   2   0  o 9  161.69  16.60  766.73    151.87   746.29   214.56   787.26    214.98   157.56  24.52  162.11  23.81  -4.55   34.18  
1 1 1 7   2   1  o 17 537.89  135.28 14980.79  4172.42  0.00     0.00     14980.79  4172.42  ?       ?      537.89  135.28 0.00    135.28 
1 1 1 7   2   2  o 3  333.13  35.58  3386.22   669.99   3560.58  947.69   3211.99   947.33   331.62  51.45  312.35  54.83  19.26   75.19  
1 1 1 7   2   3  o 16 65.66   8.86   126.36    32.53    139.19   49.46    116.58    43.19    68.26   13.10  62.44   12.49  5.83    18.10  
1 1 1 7   2   4  o 16 94.92   15.01  267.32    79.08    0.00     0.00     267.32    79.08    ?       ?      94.92   15.01  0.00    15.01  
1 1 1 7   2   5  o 5  284.85  45.59  2581.39   720.35   0.00     0.00     2581.39   720.35   ?       ?      284.85  45.59  0.00    45.59  
1 1 1 7   2   6  o 16 74.32   12.80  164.10    52.63    0.00     0.00     164.10    52.63    ?       ?      74.32   12.80  0.00    12.80  
1 1 1 7   2   7  o 10 443.86  49.57  6278.77   1241.59  6651.79  1755.96  5905.83   1755.79  433.60  73.14  401.95  78.91  31.65   107.60 
1 1 1 7   2   8  o 19 188.02  19.48  1040.37   207.24   1032.65  292.66   1048.14   293.51   184.79  28.50  186.25  28.34  -1.46   40.20  
1 1 1 7   2   9  o 14 133.80  14.18  523.36    107.24   578.05   149.57   465.50    153.84   139.72  19.15  124.41  22.36  15.31   29.44  
1 1 1 7   2   10 o 14 12.19   5.77   -12.91    10.73    -12.91   10.73    0.00      0.00     12.19   5.77   ?       ?      0.00    5.77   
1 1 1 7   2   11 o 6  493.01  89.23  8729.53   2432.41  8729.53  2432.41  0.00      0.00     493.01  89.23  ?       ?      0.00    89.23  
1 1 1 7   2   12 o 3  341.07  53.89  3655.01   1020.13  3655.01  1020.13  0.00      0.00     341.07  53.89  ?       ?      0.00    53.89  
1 1 1 7   2   13 o 13 121.59  13.46  431.33    92.40    421.10   129.95   441.80    131.40   119.05  19.70  122.06  19.40  -3.01   27.65  
1 1 1 7   2   14 o 5  141.34  15.19  582.98    121.33   543.76   171.20   622.57    171.99   135.03  22.90  145.03  21.29  -10.00  31.27  
1 1 1 7   2   15 f 0  564.95  62.52  10118.75  1993.83  10088.60 2819.63  10148.90  2819.77  532.80  95.70  534.80  95.34  -2.00   135.09 
1 1 1 7   2   16 o 15 260.61  27.12  2011.14   399.74   2060.11  565.26   1962.16   565.37   259.66  39.14  252.85  40.30  6.81    56.18  
1 1 1 7   2   17 f 0  47.55   15.10  64.22     46.33    48.87    65.44    79.65     65.59    47.45   17.78  53.94   18.03  -6.48   25.33  
1 1 1 7   2   18 o 8  292.85  30.91  2578.94   511.87   2471.00  724.06   2686.79   723.74   278.73  46.91  292.22  44.55  -13.48  64.70  
1 1 1 7   2   19 o 14 96.34   14.85  274.74    79.52    309.37   112.95   240.70    111.97   101.34  20.13  89.04   22.03  12.30   29.84  
1 1 1 7   2   20 o 3  254.01  26.90  1921.35   386.36   1849.12  546.11   1993.72   546.67   243.83  40.43  254.16  38.69  -10.33  55.96  
1 1 1 7   2   21 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   2   22 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   2   23 o 14 182.13  20.15  991.76    207.20   1016.28  293.45   967.38    292.61   180.58  29.31  175.74  30.09  4.84    42.00  
1 1 1 7   2   24 o 6  92.28   16.35  257.07    83.43    250.85   118.32   263.22    117.66   89.75   22.89  91.98   22.48  -2.23   32.08  
1 1 1 7   2   25 o 19 237.96  42.84  1974.89   563.64   1974.89  563.64   0.00      0.00     237.96  42.84  ?       ?      0.00    42.84  
1 1 1 7   2   26 f 0  161.85  29.81  858.20    266.74   858.20   266.74   0.00      0.00     161.85  29.81  ?       ?      0.00    29.81  
1 1 1 7   2   27 o 14 174.47  32.46  1034.01   313.17   1034.01  313.17   0.00      0.00     174.47  32.46  ?       ?      0.00    32.46  
1 1 1 7   2   28 o 18 112.45  20.09  398.52    124.93   335.71   167.55   477.15    187.47   99.52   28.10  118.86  27.95  -19.35  39.63  
1 1 1 7   2   29 o 6  269.35  36.37  2683.76   548.06   2459.02  775.90   2907.54   774.25   212.71  60.61  244.36  56.35  -31.64  82.76  
1 1 1 7   2   30 o 3  83.91   24.54  240.14    125.65   242.02   190.24   238.68    167.36   83.77   30.51  83.06   28.78  0.71    41.95  
1 1 1 7   3   0  o 10 419.91  46.16  5551.78   1094.37  5574.74  1547.70  5528.83   1547.63  399.48  70.04  397.44  70.41  2.04    99.31  
1 1 1 7   3   1  o 6  351.36  37.72  3787.34   749.00   3922.06  1059.31  3652.65   1059.19  345.69  55.24  331.52  57.75  14.16   79.92  
1 1 1 7   3   2  o 3  138.94  21.11  576.43    163.05   0.00     0.00     576.43    163.05   ?       ?      138.94  21.11  0.00    21.11  
1 1 1 7   3   3  o 8  175.21  26.69  926.11    259.98   0.00     0.00     926.11    259.98   ?       ?      175.21  26.69  0.00    26.69  
1 1 1 7   3   4  o 17 42.18   11.24  53.13     27.72    0.00     0.00     53.13     27.72    ?       ?      42.18   11.24  0.00    11.24  
1 1 1 7   3   5  o 17 416.53  75.44  6235.00   1737.47  0.00     0.00     6235.00   1737.47  ?       ?      416.53  75.44  0.00    75.44  
1 1 1 7   3   6  o 8  412.56  45.41  5342.86   1057.63  5686.96  1495.87  4998.91   1495.55  407.55  66.21  376.38  71.84  31.17   97.69  
1 1 1 7   3   7  o 18 427.59  47.11  5757.86   1137.18  5941.55  1608.27  5574.19   1608.16  413.68  70.23  397.59  73.15  16.09   101.41 
1 1 1 7   3   8  o 7  462.25  51.29  6799.15   1338.12  6663.19  1892.24  6935.14   1892.54  430.21  79.55  441.27  77.54  -11.06  111.09 
1 1 1 7   3   9  o 1  14.82   7.36   -60.71    24.35    -60.71   24.35    0.00      0.00     14.82   7.36   ?       ?      0.00    7.36   
1 1 1 7   3   10 o 5  162.51  24.62  789.03    222.53   789.03   222.53   0.00      0.00     162.51  24.62  ?       ?      0.00    24.62  
1 1 1 7   3   11 o 19 306.16  47.94  2918.05   814.97   2918.05  814.97   0.00      0.00     306.16  47.94  ?       ?      0.00    47.94  
1 1 1 7   3   12 o 2  567.40  62.91  10236.81  2014.86  10013.50 2849.31  10460.16  2849.56  527.67  97.66  542.48  94.96  -14.81  136.21 
1 1 1 7   3   13 o 11 575.50  63.56  10491.53  2064.84  10222.75 2919.96  10760.37  2920.29  535.22  98.67  552.76  95.48  -17.54  137.30 
1 1 1 7   3   14 o 1  118.39  13.63  409.35    90.96    468.53   127.60   348.20    129.70   126.01  18.16  107.66  21.73  18.35   28.32  
1 1 1 7   3   15 o 12 324.45  33.80  3140.22   620.27   3068.51  876.83   3212.06   877.56   313.76  50.39  321.78  49.06  -8.03   70.32  
1 1 1 7   3   16 o 15 344.05  36.26  3570.51   705.47   3550.49  997.49   3590.56   997.89   333.83  53.88  335.95  53.54  -2.12   75.96  
1 1 1 7   3   17 o 10 126.43  14.69  468.55    104.66   520.77   148.36   416.82    147.67   132.26  20.18  117.49  22.72  14.77   30.38  
1 1 1 7   3   18 o 11 196.94  20.88  1144.78   232.46   1021.64  327.49   1269.84   330.02   182.41  32.46  205.13  28.82  -22.72  43.41  
1 1 1 7   3   19 o 1  436.95  48.09  6013.19   1186.26  5859.77  1677.43  6166.68   1677.82  407.96  74.37  421.09  71.99  -13.14  103.50 
1 1 1 7   3   20 o 16 386.74  41.88  4625.87   914.95   4575.58  1293.90  4676.16   1293.98  368.58  63.44  373.40  62.58  -4.82   89.11  
1 1 1 7   3   21 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   3   22 f 0  249.71  41.28  2014.06   571.11   0.00     0.00     2014.06   571.11   ?       ?      249.71  41.28  0.00    41.28  
1 1 1 7   3   23 o 15 285.11  31.46  2536.80   506.43   2446.02  716.09   2627.63   716.30   266.05  48.68  277.91  46.54  -11.86  67.35  
1 1 1 7   3   24 o 7  127.25  16.72  484.18    119.19   525.79   171.11   444.97    166.11   130.25  23.76  119.13  25.08  11.12   34.55  
1 1 1 7   3   25 o 17 69.90   19.02  150.86    78.32    224.51   114.79   86.70     107.13   84.49   23.04  60.33   22.72  24.16   32.36  
1 1 1 7   3   26 o 10 286.59  68.19  3933.95   1105.48  3933.95  1105.48  0.00      0.00     286.59  68.19  ?       ?      0.00    68.19  
1 1 1 7   3   27 f 0  122.32  26.77  493.38    182.76   493.38   182.76   0.00      0.00     122.32  26.77  ?       ?      0.00    26.77  
1 1 1 7   3   28 o 4  69.21   23.27  147.77    109.28   109.66   155.81   184.67    153.31   67.95   26.91  77.22   27.48  -9.27   38.46  
1 1 1 7   3   29 o 12 173.41  23.04  976.78    223.73   995.45   318.61   958.62    314.24   163.39  35.02  160.07  35.16  3.31    49.63  
1 1 1 7   3   30 o 9  110.95  24.28  419.31    150.37   326.14   218.18   503.60    207.52   93.12   32.82  116.59  30.62  -23.47  44.89  
1 1 1 7   4   0  o 9  454.07  84.24  7591.47   2115.02  0.00     0.00     7591.47   2115.02  ?       ?      454.07  84.24  0.00    84.24  
1 1 1 7   4   1  o 2  182.11  27.70  1000.23   280.42   0.00     0.00     1000.23   280.42   ?       ?      182.11  27.70  0.00    27.70  
1 1 1 7   4   2  o 16 436.30  79.72  6901.79   1923.07  0.00     0.00     6901.79   1923.07  ?       ?      436.30  79.72  0.00    79.72  
1 1 1 7   4   3  o 4  202.47  30.98  1245.68   348.69   0.00     0.00     1245.68   348.69   ?       ?      202.47  30.98  0.00    30.98  
1 1 1 7   4   4  o 12 290.98  30.70  2544.96   505.06   2693.11  714.44   2396.95   714.10   292.95  43.83  274.36  47.03  18.59   64.29  
1 1 1 7   4   5  f 0  152.87  16.06  684.70    138.85   765.70   197.18   605.03    195.56   160.42  21.99  141.53  24.98  18.89   33.28  
1 1 1 7   4   6  o 1  120.28  12.84  422.51    87.29    388.49   122.52   457.58    124.38   114.00  19.42  124.27  17.96  -10.27  26.45  
1 1 1 7   4   7  o 11 530.65  60.80  9246.73   1818.74  9062.42  2572.00  9431.07   2572.18  483.45  96.06  496.69  93.64  -13.25  134.15 
1 1 1 7   4   8  o 3  395.14  66.96  5254.44   1464.64  5254.44  1464.64  0.00      0.00     395.14  66.96  ?       ?      0.00    66.96  
1 1 1 7   4   9  o 15 13.30   5.76   -1.28     8.12     -1.28    8.12     0.00      0.00     13.30   5.76   ?       ?      0.00    5.76   
1 1 1 7   4   10 o 12 378.75  61.71  4645.91   1295.53  4645.91  1295.53  0.00      0.00     378.75  61.71  ?       ?      0.00    61.71  
1 1 1 7   4   11 o 4  525.23  94.57  9857.93   2746.73  9857.93  2746.73  0.00      0.00     525.23  94.57  ?       ?      0.00    94.57  
1 1 1 7   4   12 o 8  148.73  15.74  645.68    132.33   607.65   185.82   684.82    188.50   142.76  23.49  152.01  22.26  -9.25   32.36  
1 1 1 7   4   13 o 15 584.91  64.65  10866.64  2134.61  10353.78 3018.57  11379.65  3019.02  535.32  101.95 568.30  95.95  -32.98  140.00 
1 1 1 7   4   14 o 13 261.90  27.18  2024.52   402.65   2102.07  569.45   1946.98   569.43   263.32  38.84  252.61  40.65  10.71   56.22  
1 1 1 7   4   15 o 6  312.25  32.68  2910.10   577.09   3054.98  816.10   2765.19   816.16   314.08  46.68  297.18  49.59  16.90   68.10  
1 1 1 7   4   16 o 1  98.84   13.06  286.83    72.30    241.56   99.32    337.86    105.46   89.43   19.86  106.52  17.88  -17.09  26.73  
1 1 1 7   4   17 o 18 202.52  21.30  1210.81   243.97   1099.75  343.89   1323.34   346.16   189.35  32.83  209.25  29.65  -19.90  44.23  
1 1 1 7   4   18 o 3  95.61   15.01  271.03    79.68    289.77   110.30   250.58    115.23   97.91   20.29  90.75   22.28  7.16    30.14  
1 1 1 7   4   19 o 19 361.39  38.78  4003.13   792.04   3926.74  1119.67  4079.65   1120.56  344.62  58.70  352.40  57.36  -7.77   82.07  
1 1 1 7   4   20 o 11 112.92  22.61  386.24    141.46   386.24   141.46   0.00      0.00     112.92  22.61  ?       ?      0.00    22.61  
1 1 1 7   4   21 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   4   22 o 6  312.84  55.89  3447.08   966.98   0.00     0.00     3447.08   966.98   ?       ?      312.84  55.89  0.00    55.89  
1 1 1 7   4   23 f 0  78.26   17.51  187.05    76.70    218.32   108.59   155.92    108.34   84.00   22.19  72.49   23.11  11.51   32.04  
1 1 1 7   4   24 o 1  205.56  22.82  1288.09   264.80   1285.40  373.94   1290.79   375.02   198.70  34.00  199.11  34.03  -0.41   48.11  
1 1 1 7   4   25 o 4  229.16  25.87  1645.18   334.40   1712.00  473.45   1578.67   472.38   223.49  38.28  212.74  40.15  10.75   55.47  
1 1 1 7   4   26 o 14 184.17  33.78  1156.81   343.97   1156.81  343.97   0.00      0.00     184.17  33.78  ?       ?      0.00    33.78  
1 1 1 7   4   27 o 10 83.78   25.34  228.68    132.24   228.68   132.24   0.00      0.00     83.78   25.34  ?       ?      0.00    25.34  
1 1 1 7   4   28 o 11 54.37   21.10  67.90     94.13    55.24    119.40   88.70     153.01   56.55   23.14  64.99   26.34  -8.44   35.06  
1 1 1 7   4   29 o 1  124.15  20.62  496.48    141.83   474.88   190.07   523.62    213.05   115.65  28.75  119.92  30.79  -4.26   42.13  
1 1 1 7   4   30 o 8  63.64   22.94  124.40    107.14   33.62    138.57   259.33    168.95   55.80   23.99  84.91   28.94  -29.11  37.59  
1 1 1 7   5   0  o 18 525.42  103.91 10852.41  3023.08  0.00     0.00     10852.41  3023.08  ?       ?      525.42  103.91 0.00    103.91 
1 1 1 7   5   1  o 14 226.74  23.53  1518.77   301.87   1634.80  427.25   1403.11   426.57   232.32  32.96  213.85  36.03  18.48   48.83  
1 1 1 7   5   2  o 2  140.34  14.75  575.77    117.06   642.95   166.34   509.85    164.77   147.31  20.20  130.28  22.86  17.02   30.51  
1 1 1 7   5   3  o 11 366.75  60.83  4433.21   1235.92  4433.21  1235.92  0.00      0.00     366.75  60.83  ?       ?      0.00    60.83  
1 1 1 7   5   4  o 19 366.91  38.98  4107.91   808.49   4021.25  1143.28  4194.59   1143.46  350.41  58.92  359.11  57.40  -8.70   82.26  
1 1 1 7   5   5  o 16 367.20  38.98  4111.25   809.09   4025.48  1144.04  4197.06   1144.40  350.90  58.88  359.50  57.38  -8.59   82.21  
1 1 1 7   5   6  o 14 572.34  127.49 14652.58  4081.35  14652.58 4081.35  0.00      0.00     572.34  127.49 ?       ?      0.00    127.49 
1 1 1 7   5   7  o 3  245.18  37.76  1839.73   514.41   1839.73  514.41   0.00      0.00     245.18  37.76  ?       ?      0.00    37.76  
1 1 1 7   5   8  f 0  16.62   8.32   -93.60    33.40    -93.60   33.40    0.00      0.00     16.62   8.32   ?       ?      0.00    8.32   
1 1 1 7   5   9  o 9  154.37  23.36  709.12    200.56   709.12   200.56   0.00      0.00     154.37  23.36  ?       ?      0.00    23.36  
1 1 1 7   5   10 o 7  439.32  46.87  5901.01   1163.74  5921.43  1645.61  5880.58   1645.94  425.18  69.84  423.45  70.16  1.73    99.00  
1 1 1 7   5   11 o 1  544.24  59.75  9307.94   1836.21  9427.66  2596.72  9188.20   2596.88  521.17  90.05  512.93  91.55  8.24    128.42 
1 1 1 7   5   12 o 12 278.15  28.82  2286.24   453.56   2326.43  641.54   2246.08   641.33   276.44  41.72  271.22  42.59  5.22    59.62  
1 1 1 7   5   13 f 0  806.45  102.21 23467.24  4625.61  23678.15 6541.52  23256.31  6541.67  701.06  165.26 690.95  166.83 10.11   234.82 
1 1 1 7   5   14 o 13 467.04  50.36  6743.84   1328.85  6695.98  1879.06  6791.71   1879.49  446.24  76.08  450.02  75.42  -3.79   107.13 
1 1 1 7   5   15 o 1  261.22  27.28  2025.68   403.03   2060.38  569.84   1990.95   570.10   258.95  39.59  254.12  40.43  4.83    56.59  
1 1 1 7   5   16 o 3  153.82  16.68  694.09    144.92   705.88   204.21   682.13    205.69   153.45  23.96  150.62  24.64  2.83    34.37  
1 1 1 7   5   17 o 3  76.75   15.12  176.53    64.26    185.29   89.09    167.03    92.77    78.21   19.82  74.54   20.86  3.67    28.78  
1 1 1 7   5   18 o 1  190.58  20.48  1071.66   220.57   1087.89  310.35   1055.10   313.56   189.38  29.51  186.16  30.39  3.23    42.36  
1 1 1 7   5   19 o 8  272.84  28.94  2229.63   446.41   2217.46  629.66   2241.92   632.99   265.88  42.70  267.38  42.67  -1.50   60.37  
1 1 1 7   5   20 o 5  309.77  51.18  3127.64   878.34   3127.64  878.34   0.00      0.00     309.77  51.18  ?       ?      0.00    51.18  
1 1 1 7   5   21 o 18 300.37  51.36  3033.06   853.76   0.00     0.00     3033.06   853.76   ?       ?      300.37  51.36  0.00    51.36  
1 1 1 7   5   22 o 8  117.49  23.76  426.35    154.77   0.00     0.00     426.35    154.77   ?       ?      117.49  23.76  0.00    23.76  
1 1 1 7   5   23 o 19 86.07   16.77  224.96    79.89    234.23   110.12   214.67    116.07   86.82   22.06  83.21   23.35  3.61    32.12  
1 1 1 7   5   24 o 17 99.94   16.95  302.94    93.78    238.71   131.49   369.42    133.78   87.08   25.00  108.86  22.16  -21.78  33.40  
1 1 1 7   5   25 o 7  325.76  40.56  3730.66   742.12   3902.35  1050.27  3559.46   1048.78  296.78  63.56  276.71  66.79  20.07   92.20  
1 1 1 7   5   26 o 12 84.52   24.34  230.92    124.46   230.92   124.46   0.00      0.00     84.52   24.34  ?       ?      0.00    24.34  
1 1 1 7   5   27 o 17 69.01   26.34  126.67    145.02   126.67   145.02   0.00      0.00     69.01   26.34  ?       ?      0.00    26.34  
1 1 1 7   5   28 o 15 144.68  21.51  670.64    173.23   622.83   241.55   721.26    248.58   131.05  32.31  142.36  31.27  -11.30  44.97  
1 1 1 7   5   29 o 4  73.30   23.42  178.57    111.29   133.06   145.60   242.51    172.58   68.11   26.29  83.31   29.21  -15.20  39.29  
1 1 1 7   5   30 o 5  52.53   21.53  53.13     103.53   30.39    131.11   90.78     168.70   54.10   23.30  64.63   27.07  -10.53  35.72  
1 1 1 7   6   0  o 6  179.56  18.56  943.62    188.60   917.85   265.44   969.89    268.02   175.13  27.29  180.28  26.70  -5.15   38.18  
1 1 1 7   6   1  o 13 368.56  38.76  4100.95   807.84   4021.15  1142.10  4180.85   1142.82  354.60  58.12  362.51  56.78  -7.91   81.25  
1 1 1 7   6   2  o 8  220.98  33.68  1476.51   413.72   1476.51  413.72   0.00      0.00     220.98  33.68  ?       ?      0.00    33.68  
1 1 1 7   6   3  f 0  224.23  34.22  1522.45   426.56   1522.45  426.56   0.00      0.00     224.23  34.22  ?       ?      0.00    34.22  
1 1 1 7   6   4  o 19 620.46  140.12 17493.70  4872.40  17493.70 4872.40  0.00      0.00     620.46  140.12 ?       ?      0.00    140.12 
1 1 1 7   6   5  f 0  392.01  64.31  5011.64   1397.17  5011.64  1397.17  0.00      0.00     392.01  64.31  ?       ?      0.00    64.31  
1 1 1 7   6   6  o 7  530.34  97.88  10302.78  2870.26  10302.78 2870.26  0.00      0.00     530.34  97.88  ?       ?      0.00    97.88  
1 1 1 7   6   7  o 7  653.91  148.32 19529.19  5439.22  19529.19 5439.22  0.00      0.00     653.91  148.32 ?       ?      0.00    148.32 
1 1 1 7   6   8  o 2  279.01  25.54  2288.64   404.55   1.60     569.43   4619.30   574.84   112.43  48.49  397.24  25.34  -284.81 54.71  
1 1 1 7   6   9  o 9  437.36  46.42  5826.95   1147.77  5782.51  1622.90  5871.43   1623.49  421.46  69.50  425.18  68.87  -3.72   97.84  
1 1 1 7   6   10 o 18 460.45  49.22  6486.61   1280.92  6580.75  1811.31  6392.43   1811.68  448.32  72.88  440.76  74.24  7.56    104.03 
1 1 1 7   6   11 o 10 834.57  106.97 25391.70  5007.24  25675.02 7081.17  25108.36  7081.43  721.20  173.22 708.10  175.18 13.10   246.36 
1 1 1 7   6   12 o 17 465.75  49.94  6662.57   1314.41  6704.46  1858.68  6620.67   1859.04  450.31  74.50  446.97  75.11  3.34    105.80 
1 1 1 7   6   13 o 11 107.96  13.15  340.99    79.82    359.57   111.59   321.52    114.23   110.00  18.31  103.59  19.93  6.41    27.07  
1 1 1 7   6   14 o 19 324.77  34.23  3170.72   628.60   3246.09  889.04   3095.38   888.91   320.94  49.87  312.46  51.34  8.48    71.57  
1 1 1 7   6   15 o 2  203.73  21.37  1224.12   246.19   1181.13  347.96   1267.20   348.38   196.95  31.86  204.57  30.60  -7.62   44.18  
1 1 1 7   6   16 o 8  464.90  52.44  6966.47   1375.15  7013.43  1944.74  6919.52   1944.76  436.58  80.56  432.76  81.27  3.83    114.43 
1 1 1 7   6   17 o 17 220.77  23.50  1445.90   293.25   1491.34  415.29   1400.71   414.15   220.58  33.88  213.17  35.06  7.40    48.75  
1 1 1 7   6   18 o 10 316.50  33.64  3033.29   601.79   2979.85  850.74   3086.81   851.38   304.30  50.47  310.47  49.42  -6.17   70.64  
1 1 1 7   6   19 o 4  203.20  32.47  1264.34   365.99   1264.34  365.99   0.00      0.00     203.20  32.47  ?       ?      0.00    32.47  
1 1 1 7   6   20 x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   6   21 o 2  158.95  27.25  779.96    239.68   0.00     0.00     779.96    239.68   ?       ?      158.95  27.25  0.00    27.25  
1 1 1 7   6   22 o 8  130.50  25.40  530.63    183.47   0.00     0.00     530.63    183.47   ?       ?      130.50  25.40  0.00    25.40  
1 1 1 7   6   23 o 11 95.46   16.84  276.15    88.89    248.43   122.89   306.57    128.72   89.00   23.65  98.92   23.09  -9.92   33.05  
1 1 1 7   6   24 o 4  115.92  17.23  407.09    111.16   397.96   152.52   417.43    162.34   111.91  24.43  114.29  25.40  -2.38   35.24  
1 1 1 7   6   25 o 8  205.84  38.06  1496.92   433.15   1496.92  433.15   0.00      0.00     205.84  38.06  ?       ?      0.00    38.06  
1 1 1 7   6   26 o 17 61.36   23.11  96.45     110.78   96.45    110.78   0.00      0.00     61.36   23.11  ?       ?      0.00    23.11  
1 1 1 7   6   27 o 2  116.27  29.08  469.27    193.62   469.27   193.62   0.00      0.00     116.27  29.08  ?       ?      0.00    29.08  
1 1 1 7   6   28 o 17 117.62  20.36  444.77    132.47   437.11   193.47   451.54    181.76   110.16  29.85  113.32  28.08  -3.16   40.99  
1 1 1 7   6   29 o 4  88.18   24.41  270.39    127.76   312.92   173.79   220.37    188.46   92.01   29.26  79.97   30.14  12.04   42.00  
1 1 1 7   7   0  o 1  342.08  53.24  3624.87   1011.44  3624.87  1011.44  0.00      0.00     342.08  53.24  ?       ?      0.00    53.24  
1 1 1 7   7   1  o 2  344.84  53.80  3693.97   1030.33  3693.97  1030.33  0.00      0.00     344.84  53.80  ?       ?      0.00    53.80  
1 1 1 7   7   2  o 11 160.44  24.38  764.82    217.48   764.82   217.48   0.00      0.00     160.44  24.38  ?       ?      0.00    24.38  
1 1 1 7   7   3  o 4  697.07  154.12 21554.71  6003.17  21554.71 6003.17  0.00      0.00     697.07  154.12 ?       ?      0.00    154.12 
1 1 1 7   7   4  o 3  698.19  155.98 21881.13  6094.10  21881.13 6094.10  0.00      0.00     698.19  155.98 ?       ?      0.00    155.98 
1 1 1 7   7   5  o 3  578.28  63.94  10577.97  2087.29  10804.27 2951.77  10351.64  2951.99  554.48  96.22  539.77  98.91  14.70   137.99 
1 1 1 7   7   6  o 6  214.44  22.14  1348.21   268.61   1384.45  379.35   1311.77   380.38   215.06  31.67  208.93  32.79  6.13    45.59  
1 1 1 7   7   7  o 14 304.80  28.26  2736.27   488.89   -74.16   688.95   5586.97   693.87   120.10  52.55  436.57  27.83  -316.47 59.46  
1 1 1 7   7   8  o 13 181.91  18.03  965.83    185.82   536.21   260.34   1412.07   265.32   132.50  34.05  219.70  21.30  -87.20  40.16  
1 1 1 7   7   9  o 14 262.37  27.07  2028.76   401.94   2028.19  568.17   2029.32   568.68   258.66  39.51  258.73  39.54  -0.06   55.90  
1 1 1 7   7   10 o 16 557.87  61.39  9802.09   1933.58  9886.33  2734.35  9717.85   2734.64  532.10  92.89  526.43  93.94  5.67    132.11 
1 1 1 7   7   11 o 8  552.30  61.29  9657.98   1910.61  9943.46  2701.89  9372.45   2702.14  531.93  91.80  512.51  95.35  19.43   132.36 
1 1 1 7   7   12 o 2  275.62  28.67  2253.00   446.96   2259.78  632.02   2246.21   632.18   271.27  41.94  270.37  42.10  0.90    59.42  
1 1 1 7   7   13 o 17 523.15  102.57 10657.29  2970.34  0.00     0.00     10657.29  2970.34  ?       ?      523.15  102.57 0.00    102.57 
1 1 1 7   7   14 o 13 433.58  47.48  5905.50   1162.49  5804.97  1643.60  6006.12   1644.42  407.69  72.90  416.32  71.37  -8.64   102.02 
1 1 1 7   7   15 o 4  221.33  23.45  1452.99   293.44   1533.18  414.50   1372.43   415.49   223.95  33.25  210.74  35.61  13.21   48.72  
1 1 1 7   7   16 o 9  359.86  38.72  3984.35   787.26   3945.38  1112.72  4023.41   1114.00  344.31  58.38  348.26  57.74  -3.95   82.11  
1 1 1 7   7   17 o 9  466.77  52.49  6998.20   1382.08  7044.33  1954.40  6952.06   1954.72  439.29  80.46  435.53  81.17  3.76    114.29 
1 1 1 7   7   18 o 5  130.67  16.57  503.32    121.53   446.22   173.73   558.05    170.08   120.83  25.83  136.31  22.52  -15.48  34.27  
1 1 1 7   7   19 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   7   20 o 6  263.73  44.23  2284.28   646.00   0.00     0.00     2284.28   646.00   ?       ?      263.73  44.23  0.00    44.23  
1 1 1 7   7   21 o 13 106.04  23.28  348.87    137.82   0.00     0.00     348.87    137.82   ?       ?      106.04  23.28  0.00    23.28  
1 1 1 7   7   22 o 13 270.43  30.37  2302.73   463.41   2409.26  656.51   2196.95   654.21   263.81  44.96  249.32  47.44  14.49   65.36  
1 1 1 7   7   23 o 11 231.75  25.91  1673.87   338.84   1622.39  478.95   1725.45   479.42   217.16  39.89  225.40  38.43  -8.23   55.39  
1 1 1 7   7   24 o 10 294.99  35.47  2949.96   588.61   2951.86  830.89   2948.04   833.95   266.95  56.01  266.28  56.32  0.66    79.43  
1 1 1 7   7   25 o 10 156.23  29.06  814.07    251.06   814.07   251.06   0.00      0.00     156.23  29.06  ?       ?      0.00    29.06  
1 1 1 7   7   26 o 7  69.73   26.95  127.47    153.15   127.47   153.15   0.00      0.00     69.73   26.95  ?       ?      0.00    26.95  
1 1 1 7   7   27 o 5  68.07   26.70  120.84    152.18   120.84   152.18   0.00      0.00     68.07   26.70  ?       ?      0.00    26.70  
1 1 1 7   7   28 o 12 128.71  21.06  540.14    150.26   479.45   223.57   590.15    202.93   111.70  32.75  128.81  28.22  -17.11  43.23  
1 1 1 7   7   29 o 14 134.78  22.23  609.94    166.01   592.08   240.08   626.31    229.79   121.37  33.41  127.23  31.60  -5.86   45.99  
1 1 1 7   8   0  o 11 729.04  83.73  17452.31  3440.57  17681.58 4865.60  17223.03  4865.79  679.35  129.49 667.34  131.69 12.01   184.69 
1 1 1 7   8   1  o 8  475.86  50.53  6888.19   1359.27  6996.31  1922.15  6780.05   1922.45  465.12  74.50  456.75  75.99  8.37    106.42 
1 1 1 7   8   2  o 14 363.48  37.91  3938.51   779.44   4086.55  1102.22  3790.44   1102.37  363.47  54.50  348.65  57.05  14.82   78.90  
1 1 1 7   8   3  o 3  253.02  25.98  1881.27   371.99   1823.51  525.34   1939.35   526.80   245.72  38.51  253.95  37.24  -8.22   53.57  
1 1 1 7   8   4  o 15 340.56  35.27  3447.63   679.49   3355.71  960.35   3539.78   961.54   329.30  52.57  339.08  50.97  -9.78   73.22  
1 1 1 7   8   5  o 5  206.92  21.50  1253.79   251.70   1331.62  354.45   1174.62   357.49   211.41  30.05  197.66  32.64  13.75   44.37  
1 1 1 7   8   6  o 14 92.52   11.61  250.25    60.31    255.96   79.44    242.48    92.64    92.98   15.42  89.95   18.56  3.03    24.13  
1 1 1 7   8   7  o 10 53.83   11.32  86.54     33.88    -0.00    39.89    310.44    64.16    30.59   13.00  103.28  10.99  -72.69  17.03  
1 1 1 7   8   8  o 9  169.48  17.80  839.44    170.55   903.11   240.28   774.79    242.13   174.50  24.67  160.82  27.20  13.68   36.72  
1 1 1 7   8   9  o 9  311.93  32.46  2894.33   572.82   2923.22  809.72   2865.39   810.45   307.69  47.36  304.30  47.98  3.39    67.42  
1 1 1 7   8   10 o 8  242.90  25.43  1741.52   349.37   1891.00  493.95   1591.87   494.21   250.18  35.38  227.88  39.19  22.30   52.80  
1 1 1 7   8   11 o 8  304.53  31.96  2774.55   550.36   2829.77  777.76   2719.17   778.91   301.10  46.49  294.44  47.71  6.66    66.62  
1 1 1 7   8   12 f 0  294.88  31.23  2607.53   520.68   2764.18  736.20   2450.77   736.49   297.53  44.47  278.12  47.86  19.41   65.32  
1 1 1 7   8   13 o 13 218.40  23.15  1412.51   285.80   1490.86  404.46   1334.37   403.91   221.16  32.85  208.19  35.04  12.97   48.03  
1 1 1 7   8   14 o 9  521.81  61.48  9102.75   1806.36  9490.33  2554.47  8715.10   2554.69  490.27  94.18  461.78  99.32  28.49   136.88 
1 1 1 7   8   15 o 16 165.04  18.27  801.66    170.22   813.14   241.12   790.25    240.34   164.10  26.50  161.62  26.85  2.48    37.72  
1 1 1 7   8   16 o 16 209.38  22.57  1297.64   267.05   1364.10  377.30   1230.92   378.03   211.64  32.06  200.09  34.13  11.55   46.83  
1 1 1 7   8   17 o 17 271.09  43.60  2320.14   655.48   0.00     0.00     2320.14   655.48   ?       ?      271.09  43.60  0.00    43.60  
1 1 1 7   8   18 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   8   19 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   8   20 o 10 223.42  37.56  1620.83   464.61   0.00     0.00     1620.83   464.61   ?       ?      223.42  37.56  0.00    37.56  
1 1 1 7   8   21 o 17 235.99  25.98  1714.80   346.11   1730.96  488.44   1698.51   490.51   228.33  38.64  225.63  39.30  2.70    55.11  
1 1 1 7   8   22 o 3  212.75  23.98  1394.51   287.83   1453.30  406.64   1335.47   407.47   209.68  35.02  199.37  36.96  10.31   50.92  
1 1 1 7   8   23 o 11 186.37  21.39  1068.38   224.69   1031.13  317.00   1106.00   318.53   175.75  32.62  183.03  31.45  -7.28   45.31  
1 1 1 7   8   24 o 11 129.23  26.35  546.56    188.87   546.56   188.87   0.00      0.00     129.23  26.35  ?       ?      0.00    26.35  
1 1 1 7   8   25 o 15 54.38   22.80  34.16     119.93   34.16    119.93   0.00      0.00     54.38   22.80  ?       ?      0.00    22.80  
1 1 1 7   8   26 o 8  104.12  32.86  396.13    219.54   396.13   219.54   0.00      0.00     104.12  32.86  ?       ?      0.00    32.86  
1 1 1 7   8   27 o 4  77.44   25.25  201.65    128.93   198.52   204.39   203.72    166.17   79.43   31.01  78.46   28.53  0.97    42.13  
1 1 1 7   8   28 o 11 144.80  24.41  718.72    195.67   725.75   294.21   713.14    262.02   130.40  37.38  133.75  34.04  -3.35   50.56  
1 1 1 7   8   29 o 17 170.71  44.72  1442.86   443.42   0.00     0.00     1442.86   443.42   ?       ?      170.71  44.72  0.00    44.72  
1 1 1 7   9   0  o 4  650.42  74.23  13817.18  2722.22  13847.90 3849.65  13786.45  3849.96  603.78  115.27 601.97  115.61 1.81    163.26 
1 1 1 7   9   1  o 19 258.48  26.69  1968.64   390.32   1922.20  551.65   2015.19   552.34   251.63  39.49  258.11  38.45  -6.48   55.11  
1 1 1 7   9   2  o 15 518.00  55.97  8324.70   1637.84  8150.41  2315.99  8499.07   2316.52  489.71  85.49  502.20  83.27  -12.49  119.34 
1 1 1 7   9   3  o 7  87.26   12.25  223.56    59.68    226.40   84.45    220.72    84.35    86.98   17.52  85.83   17.71  1.15    24.91  
1 1 1 7   9   4  o 1  286.47  29.80  2429.01   482.93   2554.53  682.79   2303.36   683.15   289.62  42.32  273.72  45.04  15.90   61.80  
1 1 1 7   9   5  o 1  174.94  18.34  895.14    181.47   934.53   255.12   854.82    258.17   177.23  25.83  168.95  27.57  8.29    37.78  
1 1 1 7   9   6  o 11 197.24  19.38  1138.09   216.66   7.64     301.56   2344.18   311.48   83.39   35.61  283.79  19.23  -200.40 40.47  
1 1 1 7   9   7  f 0  59.30   15.20  105.43    51.97    -101.05  62.66    560.45    93.02    27.27   13.18  138.97  11.77  -111.70 17.67  
1 1 1 7   9   8  o 6  419.09  44.75  5392.94   1059.99  5191.34  1498.35  5594.92   1499.74  394.79  68.60  412.54  65.51  -17.75  94.86  
1 1 1 7   9   9  o 8  173.20  18.38  879.95    179.96   940.58   253.29   818.15    255.73   177.43  25.61  164.61  28.07  12.83   37.99  
1 1 1 7   9   10 f 0  520.57  59.26  8819.95   1739.36  8860.57  2459.54  8779.30   2460.10  485.13  91.67  482.13  92.24  3.00    130.05 
1 1 1 7   9   11 o 9  350.50  37.53  3751.74   743.40   3832.74  1050.93  3670.61   1051.74  343.01  55.25  334.44  56.81  8.56    79.24  
1 1 1 7   9   12 o 6  180.99  19.44  964.94    198.85   989.79   280.07   939.68    282.37   181.01  27.84  175.93  28.97  5.08    40.18  
1 1 1 7   9   13 o 7  456.39  50.74  6643.36   1306.87  6496.47  1847.65  6790.43   1848.74  423.52  78.90  435.60  76.73  -12.08  110.06 
1 1 1 7   9   14 o 15 362.89  38.94  4038.70   798.54   4022.45  1128.43  4055.00   1130.18  349.08  58.37  350.66  58.18  -1.58   82.41  
1 1 1 7   9   15 o 3  279.67  44.98  2470.25   697.71   0.00     0.00     2470.25   697.71   ?       ?      279.67  44.98  0.00    44.98  
1 1 1 7   9   16 o 15 183.22  29.70  1022.69   301.71   0.00     0.00     1022.69   301.71   ?       ?      183.22  29.70  0.00    29.70  
1 1 1 7   9   17 o 5  55.40   21.47  59.07     97.48    0.00     0.00     59.07     97.48    ?       ?      55.40   21.47  0.00    21.47  
1 1 1 7   9   18 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   9   19 o 13 216.17  36.15  1509.14   432.83   0.00     0.00     1509.14   432.83   ?       ?      216.17  36.15  0.00    36.15  
1 1 1 7   9   20 f 0  203.10  22.36  1251.65   256.38   1215.25  361.56   1288.47   363.59   193.78  33.73  200.26  32.76  -6.48   47.02  
1 1 1 7   9   21 o 18 305.12  35.22  3054.97   605.58   2997.01  855.37   3113.21   857.46   278.44  55.46  285.47  54.31  -7.03   77.62  
1 1 1 7   9   22 f 0  122.52  16.82  454.02    115.20   519.45   158.26   380.30    168.00   128.96  22.18  108.05  27.13  20.92   35.04  
1 1 1 7   9   23 o 15 137.10  25.74  609.27    195.13   609.27   195.13   0.00      0.00     137.10  25.74  ?       ?      0.00    25.74  
1 1 1 7   9   24 o 11 66.73   22.46  135.39    101.76   135.39   101.76   0.00      0.00     66.73   22.46  ?       ?      0.00    22.46  
1 1 1 7   9   25 o 15 90.82   27.24  281.64    153.26   281.64   153.26   0.00      0.00     90.82   27.24  ?       ?      0.00    27.24  
1 1 1 7   9   26 o 5  151.32  21.83  742.89    184.19   689.86   249.86   806.00    272.59   136.61  32.36  147.38  33.04  -10.77  46.25  
1 1 1 7   9   27 o 18 147.12  23.59  730.45    192.50   646.81   274.31   811.61    270.21   124.93  36.18  144.94  33.19  -20.01  49.10  
1 1 1 7   9   28 f 0  84.92   26.80  265.73    146.03   201.09   225.09   312.70    191.89   77.32   31.72  89.22   30.82  -11.90  44.23  
1 1 1 7   10  0  o 6  323.33  33.98  3134.91   621.35   3236.45  878.49   3033.25   878.97   321.45  49.17  309.96  51.18  11.49   70.97  
1 1 1 7   10  1  o 3  249.62  26.00  1843.32   367.10   1838.33  518.63   1848.32   519.68   245.26  38.07  245.95  38.03  -0.69   53.81  
1 1 1 7   10  2  o 3  544.68  61.31  9565.20   1883.85  9486.63  2663.94  9643.80   2664.39  506.45  95.12  511.89  94.14  -5.44   133.83 
1 1 1 7   10  3  o 13 216.86  22.65  1385.30   277.84   1358.95  391.35   1412.09   394.52   211.71  33.30  216.04  32.84  -4.33   46.77  
1 1 1 7   10  4  f 0  485.54  53.59  7442.82   1468.80  7518.93  2076.92  7366.67   2077.46  462.93  81.11  457.02  82.21  5.91    115.48 
1 1 1 7   10  5  o 8  193.78  20.40  1103.99   223.52   1133.31  315.63   1074.49   316.58   194.04  29.24  188.53  30.27  5.51    42.09  
1 1 1 7   10  6  o 11 17.20   6.67   5.30      9.40     4.72     9.48     39.31     72.95    16.98   6.66   47.37   18.52  -30.39  19.68  
1 1 1 7   10  7  o 9  374.37  40.03  4288.92   847.03   4277.76  1196.87  4300.11   1198.89  360.90  59.87  361.91  59.79  -1.01   84.61  
1 1 1 7   10  8  o 18 289.75  30.48  2515.76   499.48   2513.02  704.71   2518.53   708.03   282.98  44.88  283.20  45.06  -0.22   63.59  
1 1 1 7   10  9  o 13 561.05  65.86  10570.26  2081.00  10461.09 2942.49  10679.50  2943.47  506.62  104.64 514.04  103.33 -7.42   147.06 
1 1 1 7   10  10 o 13 428.54  47.15  5760.78   1140.84  5923.32  1612.78  5597.99   1613.99  414.67  70.26  400.41  72.90  14.26   101.24 
1 1 1 7   10  11 o 9  98.19   21.39  291.98    117.18   0.00     0.00     291.98    117.18   ?       ?      98.19   21.39  0.00    21.39  
1 1 1 7   10  12 o 13 40.56   18.48  -59.64    94.98    0.00     0.00     -59.64    94.98    ?       ?      40.56   18.48  0.00    18.48  
1 1 1 7   10  13 o 18 290.40  46.68  2670.40   751.87   0.00     0.00     2670.40   751.87   ?       ?      290.40  46.68  0.00    46.68  
1 1 1 7   10  14 o 8  101.72  23.03  315.08    131.31   0.00     0.00     315.08    131.31   ?       ?      101.72  23.03  0.00    23.03  
1 1 1 7   10  15 o 3  174.12  28.66  925.06    276.56   0.00     0.00     925.06    276.56   ?       ?      174.12  28.66  0.00    28.66  
1 1 1 7   10  16 o 8  186.11  30.55  1070.86   315.13   0.00     0.00     1070.86   315.13   ?       ?      186.11  30.55  0.00    30.55  
1 1 1 7   10  17 o 13 177.05  19.89  935.55    198.62   1028.73  278.51   839.12    283.33   182.81  27.38  163.07  31.40  19.74   41.66  
1 1 1 7   10  18 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   10  19 o 13 303.62  34.59  2972.70   592.16   2986.15  836.76   2959.20   838.13   284.71  53.15  282.90  53.57  1.81    75.46  
1 1 1 7   10  20 o 15 188.53  22.13  1087.88   234.91   1271.29  331.88   903.71    332.56   199.20  29.95  163.36  36.39  35.84   47.13  
1 1 1 7   10  21 o 16 202.98  36.34  1411.34   407.93   1411.34  407.93   0.00      0.00     202.98  36.34  ?       ?      0.00    36.34  
1 1 1 7   10  22 o 16 115.81  25.28  436.78    163.35   436.78   163.35   0.00      0.00     115.81  25.28  ?       ?      0.00    25.28  
1 1 1 7   10  23 f 0  47.21   20.79  -14.22    109.56   -14.22   109.56   0.00      0.00     47.21   20.79  ?       ?      0.00    20.79  
1 1 1 7   10  24 o 19 145.14  29.26  727.27    235.37   727.27   235.37   0.00      0.00     145.14  29.26  ?       ?      0.00    29.26  
1 1 1 7   10  25 o 17 184.61  23.77  1121.53   246.03   1068.09  336.57   1182.86   360.55   166.85  36.18  174.73  37.09  -7.88   51.82  
1 1 1 7   10  26 o 14 83.29   23.42  238.16    116.60   194.24   146.19   314.93    193.29   75.70   26.85  91.50   30.95  -15.80  40.98  
1 1 1 7   10  27 o 5  118.66  23.03  484.13    151.20   450.32   197.59   531.90    234.86   107.19  30.60  113.26  33.66  -6.07   45.49  
1 1 1 7   11  0  f 0  159.74  27.01  766.49    238.87   0.00     0.00     766.49    238.87   ?       ?      159.74  27.01  0.00    27.01  
1 1 1 7   11  1  o 7  497.30  89.49  8823.76   2460.97  0.00     0.00     8823.76   2460.97  ?       ?      497.30  89.49  0.00    89.49  
1 1 1 7   11  2  o 18 344.04  55.39  3771.22   1056.75  0.00     0.00     3771.22   1056.75  ?       ?      344.04  55.39  0.00    55.39  
1 1 1 7   11  3  o 8  457.15  80.20  7268.50   2028.00  0.00     0.00     7268.50   2028.00  ?       ?      457.15  80.20  0.00    80.20  
1 1 1 7   11  4  o 6  143.71  25.47  621.71    202.46   0.00     0.00     621.71    202.46   ?       ?      143.71  25.47  0.00    25.47  
1 1 1 7   11  5  o 12 550.16  111.82 12237.62  3411.07  0.00     0.00     12237.62  3411.07  ?       ?      550.16  111.82 0.00    111.82 
1 1 1 7   11  6  f 0  420.39  72.15  6011.55   1678.61  0.00     0.00     6011.55   1678.61  ?       ?      420.39  72.15  0.00    72.15  
1 1 1 7   11  7  o 13 122.00  23.62  449.12    159.45   0.00     0.00     449.12    159.45   ?       ?      122.00  23.62  0.00    23.62  
1 1 1 7   11  8  o 2  69.26   23.18  132.40    108.40   0.00     0.00     132.40    108.40   ?       ?      69.26   23.18  0.00    23.18  
1 1 1 7   11  9  o 12 565.00  125.76 14257.27  3974.04  0.00     0.00     14257.27  3974.04  ?       ?      565.00  125.76 0.00    125.76 
1 1 1 7   11  10 o 8  227.85  36.46  1593.65   460.84   0.00     0.00     1593.65   460.84   ?       ?      227.85  36.46  0.00    36.46  
1 1 1 7   11  11 o 18 176.35  29.93  945.75    292.18   0.00     0.00     945.75    292.18   ?       ?      176.35  29.93  0.00    29.93  
1 1 1 7   11  12 o 1  224.82  35.75  1559.08   445.94   0.00     0.00     1559.08   445.94   ?       ?      224.82  35.75  0.00    35.75  
1 1 1 7   11  13 o 13 175.72  18.96  911.70    188.27   818.40   263.34   1009.25   269.26   163.33  29.16  182.74  26.43  -19.41  39.35  
1 1 1 7   11  14 o 10 272.17  29.22  2251.49   449.39   2262.99  634.09   2239.89   637.00   264.63  43.23  262.92  43.74  1.71    61.50  
1 1 1 7   11  15 f 0  288.95  31.49  2581.22   513.87   2593.09  725.24   2569.26   728.22   278.11  47.10  276.39  47.61  1.72    66.98  
1 1 1 7   11  16 o 13 297.27  32.85  2777.18   551.19   2741.73  778.19   2812.88   780.81   280.29  50.21  284.56  49.60  -4.28   70.58  
1 1 1 7   11  17 o 10 273.64  49.14  2644.15   743.57   2644.15  743.57   0.00      0.00     273.64  49.14  ?       ?      0.00    49.14  
1 1 1 7   11  18 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   11  19 o 2  170.47  29.38  936.85    277.15   936.85   277.15   0.00      0.00     170.47  29.38  ?       ?      0.00    29.38  
1 1 1 7   11  20 o 19 175.11  30.76  1013.54   297.96   1013.54  297.96   0.00      0.00     175.11  30.76  ?       ?      0.00    30.76  
1 1 1 7   11  21 o 17 61.93   21.60  110.14    94.37    110.14   94.37    0.00      0.00     61.93   21.60  ?       ?      0.00    21.60  
1 1 1 7   11  22 o 1  150.26  28.50  760.16    236.85   760.16   236.85   0.00      0.00     150.26  28.50  ?       ?      0.00    28.50  
1 1 1 7   11  23 o 2  84.74   19.79  230.92    94.54    260.69   131.21   198.78    136.34   88.17   24.86  78.03   25.99  10.14   35.97  
1 1 1 7   11  24 o 8  99.18   22.93  328.41    127.95   290.67   168.18   380.27    197.15   90.59   28.78  101.76  30.98  -11.17  42.28  
1 1 1 7   11  25 o 13 111.00  23.16  417.67    142.79   381.23   191.64   463.15    214.11   100.37  30.54  109.39  32.04  -9.02   44.26  
1 1 1 7   11  26 o 10 67.26   24.69  147.66    124.91   139.87   162.78   158.81    194.81   68.38   27.36  72.19   29.55  -3.81   40.27  
1 1 1 7   12  0  o 13 474.74  52.22  7084.61   1399.69  7189.41  1979.16  6979.74   1979.76  455.09  78.60  446.80  80.13  8.29    112.24 
1 1 1 7   12  1  o 4  160.94  18.36  760.64    166.64   786.59   232.48   733.23    238.99   161.99  25.87  155.81  27.74  6.18    37.93  
1 1 1 7   12  2  o 16 253.64  26.87  1907.45   385.30   2011.28  543.30   1802.39   546.50   256.63  38.03  241.59  40.86  15.04   55.82  
1 1 1 7   12  3  o 16 386.75  41.39  4566.61   904.63   4632.99  1278.51  4500.06   1280.17  377.03  61.16  370.62  62.38  6.40    87.37  
1 1 1 7   12  4  o 13 204.40  22.01  1231.20   254.23   1225.29  356.33   1237.31   362.84   201.12  31.93  201.98  32.39  -0.86   45.48  
1 1 1 7   12  5  f 0  281.49  44.84  2472.86   700.34   0.00     0.00     2472.86   700.34   ?       ?      281.49  44.84  0.00    44.84  
1 1 1 7   12  6  f 0  210.82  22.69  1312.55   270.33   1350.28  378.47   1273.25   386.27   210.97  32.27  204.10  34.17  6.87    47.00  
1 1 1 7   12  7  o 15 375.24  40.26  4319.31   853.66   4289.07  1206.76  4349.61   1207.75  360.25  60.49  363.19  60.02  -2.94   85.22  
1 1 1 7   12  8  o 4  148.63  17.48  650.19    146.28   706.44   204.07   590.75    209.80   153.46  23.95  139.22  27.23  14.24   36.26  
1 1 1 7   12  9  o 8  351.93  38.28  3815.56   760.91   4024.95  1075.46  3605.67   1076.73  349.29  55.49  327.17  59.52  22.13   81.37  
1 1 1 7   12  10 o 10 118.98  16.36  418.93    108.81   449.17   150.28   385.61    157.75   121.87  22.30  112.12  25.13  9.75    33.60  
1 1 1 7   12  11 o 13 324.10  35.11  3245.40   642.78   3180.07  906.68   3311.41   911.39   307.48  53.30  314.72  52.28  -7.24   74.66  
1 1 1 7   12  12 o 15 385.20  43.33  4788.34   941.50   4580.55  1329.57  4997.32   1333.40  349.67  68.69  369.88  65.18  -20.21  94.69  
1 1 1 7   12  13 o 6  328.62  36.22  3412.39   672.06   3225.82  948.15   3600.78   952.74   300.51  57.05  321.58  53.49  -21.07  78.20  
1 1 1 7   12  14 o 18 321.50  60.80  3864.86   1080.98  3864.86  1080.98  0.00      0.00     321.50  60.80  ?       ?      0.00    60.80  
1 1 1 7   12  15 o 1  256.83  44.56  2250.39   633.19   2250.39  633.19   0.00      0.00     256.83  44.56  ?       ?      0.00    44.56  
1 1 1 7   12  16 o 12 278.54  51.66  2833.78   795.65   2833.78  795.65   0.00      0.00     278.54  51.66  ?       ?      0.00    51.66  
1 1 1 7   12  17 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   12  18 o 3  266.16  53.49  2806.39   788.84   2806.39  788.84   0.00      0.00     266.16  53.49  ?       ?      0.00    53.49  
1 1 1 7   12  19 o 11 211.83  39.00  1601.00   456.74   1601.00  456.74   0.00      0.00     211.83  39.00  ?       ?      0.00    39.00  
1 1 1 7   12  20 o 15 110.00  17.00  371.50    103.90   424.19   137.04   300.28    159.32   115.66  21.43  94.80   27.61  20.86   34.95  
1 1 1 7   12  21 o 8  136.72  17.93  577.29    137.31   542.59   189.26   615.86    199.52   127.28  26.75  136.00  26.51  -8.71   37.66  
1 1 1 7   12  22 o 11 65.07   19.55  134.32    78.91    171.42   101.74   78.32     124.99   72.72   22.28  59.93   23.98  12.80   32.73  
1 1 1 7   12  23 o 9  54.54   19.71  84.00     79.18    81.92    100.94   87.33     127.66   56.83   21.90  60.83   24.27  -4.00   32.69  
1 1 1 7   12  24 o 3  147.07  22.30  719.91    182.40   682.59   246.05   765.44    271.78   133.00  32.51  139.02  34.27  -6.03   47.24  
1 1 1 7   12  25 o 15 49.07   21.59  6.12      117.76   -83.20   152.57   137.75    185.22   47.95   22.40  69.51   28.67  -21.56  36.38  
1 1 1 7   13  0  o 4  130.37  23.01  513.89    165.95   513.89   165.95   0.00      0.00     130.37  23.01  ?       ?      0.00    23.01  
1 1 1 7   13  1  o 10 289.28  47.33  2702.00   758.90   2702.00  758.90   0.00      0.00     289.28  47.33  ?       ?      0.00    47.33  
1 1 1 7   13  2  o 7  193.87  30.98  1151.68   333.18   1151.68  333.18   0.00      0.00     193.87  30.98  ?       ?      0.00    30.98  
1 1 1 7   13  3  o 18 150.65  25.18  687.42    210.11   687.42   210.11   0.00      0.00     150.65  25.18  ?       ?      0.00    25.18  
1 1 1 7   13  4  o 5  268.11  43.26  2291.01   643.18   2291.01  643.18   0.00      0.00     268.11  43.26  ?       ?      0.00    43.26  
1 1 1 7   13  5  o 8  28.81   14.54  -366.34   113.17   -366.34  113.17   0.00      0.00     28.81   14.54  ?       ?      0.00    14.54  
1 1 1 7   13  6  o 10 277.21  45.56  2488.62   699.89   2488.62  699.89   0.00      0.00     277.21  45.56  ?       ?      0.00    45.56  
1 1 1 7   13  7  o 4  128.31  23.10  500.12    163.91   500.12   163.91   0.00      0.00     128.31  23.10  ?       ?      0.00    23.10  
1 1 1 7   13  8  o 9  208.62  33.72  1359.83   390.04   1359.83  390.04   0.00      0.00     208.62  33.72  ?       ?      0.00    33.72  
1 1 1 7   13  9  o 1  270.40  45.41  2414.83   679.97   2414.83  679.97   0.00      0.00     270.40  45.41  ?       ?      0.00    45.41  
1 1 1 7   13  10 o 2  143.41  24.84  630.80    197.09   630.80   197.09   0.00      0.00     143.41  24.84  ?       ?      0.00    24.84  
1 1 1 7   13  11 o 14 177.15  29.36  978.73    288.18   978.73   288.18   0.00      0.00     177.15  29.36  ?       ?      0.00    29.36  
1 1 1 7   13  12 o 3  225.25  37.83  1652.26   471.82   1652.26  471.82   0.00      0.00     225.25  37.83  ?       ?      0.00    37.83  
1 1 1 7   13  13 o 11 243.75  41.99  2001.02   566.40   2001.02  566.40   0.00      0.00     243.75  41.99  ?       ?      0.00    41.99  
1 1 1 7   13  14 o 19 50.54   19.02  57.86     75.03    57.86    75.03    0.00      0.00     50.54   19.02  ?       ?      0.00    19.02  
1 1 1 7   13  15 o 16 130.60  16.24  510.87    119.16   489.89   163.64   534.56    173.87   125.10  23.65  130.63  24.07  -5.53   33.75  
1 1 1 7   13  16 o 12 99.83   21.43  312.70    119.12   312.70   119.12   0.00      0.00     99.83   21.43  ?       ?      0.00    21.43  
1 1 1 7   13  17 o 15 136.19  26.39  600.28    198.88   0.00     0.00     600.28    198.88   ?       ?      136.19  26.39  0.00    26.39  
1 1 1 7   13  18 o 14 58.80   18.25  105.07    68.01    113.25   86.39    91.73     110.28   61.82   20.69  60.77   23.02  1.05    30.95  
1 1 1 7   13  19 f 0  131.48  17.45  530.82    128.43   502.46   174.08   564.70    190.26   123.63  25.38  130.68  26.27  -7.06   36.53  
1 1 1 7   13  20 o 10 134.77  17.58  561.34    132.80   526.35   180.23   602.90    196.42   125.51  25.87  134.15  26.45  -8.64   37.00  
1 1 1 7   13  21 f 0  64.74   19.73  133.26    79.98    100.22   101.03   188.69    130.89   59.99   22.17  75.91   25.47  -15.92  33.77  
1 1 1 7   13  22 o 14 76.54   19.17  190.97    84.03    178.64   106.54   211.26    136.68   73.27   22.86  78.66   26.02  -5.39   34.63  
1 1 1 7   13  23 o 8  119.91  23.56  492.35    156.37   401.23   207.22   612.84    238.29   100.87  31.93  124.56  32.86  -23.69  45.82  
1 1 1 7   13  24 o 8  102.75  25.23  380.10    147.69   402.65   198.33   352.04    221.28   100.17  31.17  92.27   33.00  7.90    45.40  
1 1 1 7   14  0  o 17 172.16  19.42  880.69    188.55   953.52   262.47   803.02    271.04   176.70  26.71  160.43  30.54  16.27   40.57  
1 1 1 7   14  1  o 2  174.69  19.53  906.75    192.53   921.80   267.80   890.65    276.98   173.24  27.87  169.58  29.52  3.66    40.60  
1 1 1 7   14  2  o 1  147.36  17.40  643.21    144.32   706.25   200.00   574.70    208.48   152.66  23.58  136.12  27.62  16.54   36.32  
1 1 1 7   14  3  o 2  133.09  16.68  524.95    124.66   654.80   171.58   379.77    181.43   147.71  20.81  110.20  28.48  37.51   35.27  
1 1 1 7   14  4  o 16 345.68  64.33  4390.60   1229.63  0.00     0.00     4390.60   1229.63  ?       ?      345.68  64.33  0.00    64.33  
1 1 1 7   14  5  o 16 148.69  17.58  656.04    147.14   676.73   201.66   632.48    215.16   148.90  24.44  142.88  27.22  6.02    36.58  
1 1 1 7   14  6  o 14 118.48  16.55  417.97    109.48   421.33   147.84   413.90    162.92   117.24  22.79  115.49  25.28  1.75    34.03  
1 1 1 7   14  7  o 18 353.87  40.48  4054.36   807.63   4200.73  1140.65  3907.22   1143.67  337.82  61.06  321.85  64.15  15.97   88.57  
1 1 1 7   14  8  o 6  263.50  29.09  2142.55   432.68   2256.80  610.02   2026.88   613.82   261.17  42.12  244.74  45.36  16.42   61.90  
1 1 1 7   14  9  o 10 110.18  16.50  363.49    101.16   370.45   135.62   354.77    151.88   109.59  22.32  106.43  25.24  3.16    33.69  
1 1 1 7   14  10 o 15 183.09  31.19  1066.17   316.06   0.00     0.00     1066.17   316.06   ?       ?      183.09  31.19  0.00    31.19  
1 1 1 7   14  11 o 15 62.75   18.60  118.74    71.81    137.36   93.89    92.51     111.45   67.91   21.49  62.10   23.22  5.82    31.64  
1 1 1 7   14  12 o 19 107.26  16.82  347.49    100.17   387.45   137.53   302.34    146.19   111.56  22.25  97.49   25.74  14.07   34.03  
1 1 1 7   14  13 o 9  209.22  23.67  1352.15   279.36   1365.57  390.27   1338.06   400.06   202.46  34.83  199.20  36.32  3.26    50.33  
1 1 1 7   14  14 o 10 158.99  19.16  769.46    171.32   752.28   234.31   789.18    251.13   152.67  27.76  155.58  29.19  -2.91   40.28  
1 1 1 7   14  15 o 19 133.24  17.86  541.03    133.19   564.78   178.87   511.46    199.55   133.11  24.30  124.31  28.56  8.80    37.50  
1 1 1 7   14  16 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   14  17 o 19 135.57  17.19  562.14    130.81   505.66   178.23   628.09    192.58   123.89  25.90  138.97  25.06  -15.08  36.04  
1 1 1 7   14  18 o 3  115.58  16.85  411.53    108.48   439.40   145.00   376.08    163.51   116.62  22.47  105.33  26.94  11.29   35.08  
1 1 1 7   14  19 o 16 86.64   17.69  237.10    85.03    184.60   109.62   316.40    134.73   75.18   23.14  97.21   24.23  -22.02  33.50  
1 1 1 7   14  20 o 5  80.39   18.86  208.74    85.50    205.70   107.55   213.96    140.95   78.54   22.63  79.50   26.43  -0.97   34.79  
1 1 1 7   14  21 o 11 152.42  19.60  747.35    167.52   695.81   228.77   806.94    245.98   137.80  29.79  148.66  29.86  -10.86  42.18  
1 1 1 7   14  22 o 18 171.94  23.99  1012.53   230.34   950.85   299.72   1101.51   359.98   153.23  34.86  157.63  39.78  -4.41   52.90  
1 1 1 7   15  0  o 16 161.08  18.29  774.42    166.17   842.99   236.85   707.94    233.20   165.21  25.82  150.17  28.08  15.03   38.15  
1 1 1 7   15  1  o 2  93.16   16.09  261.25    82.93    267.92   106.06   250.76    133.02   93.32   20.37  89.75   24.93  3.57    32.19  
1 1 1 7   15  2  o 12 135.94  17.00  551.01    129.79   648.10   177.87   440.45    189.81   145.94  21.91  117.76  28.41  28.18   35.87  
1 1 1 7   15  3  o 10 108.21  14.92  348.52    90.22    454.65   116.11   186.87    143.31   123.32  16.84  79.80   26.65  43.52   31.53  
1 1 1 7   15  4  o 8  ?       ?      -220.30   49.41    -440.12  55.04    691.66    112.12   ?       ?      153.62  12.83  0.00    12.83  
1 1 1 7   15  5  o 6  99.17   24.81  308.97    140.88   0.00     0.00     308.97    140.88   ?       ?      99.17   24.81  0.00    24.81  
1 1 1 7   15  6  o 7  73.83   18.23  167.51    76.82    203.44   96.86    106.60    126.12   81.05   20.74  66.16   24.71  14.89   32.26  
1 1 1 7   15  7  o 14 175.91  19.82  932.68    196.70   865.68   273.32   1004.66   283.30   164.55  30.04  178.33  28.64  -13.78  41.51  
1 1 1 7   15  8  o 16 104.91  17.33  333.52    100.74   355.67   133.18   303.89    154.02   106.77  22.44  97.66   26.71  9.11    34.89  
1 1 1 7   15  9  o 9  251.32  28.75  1997.16   407.35   2147.19  573.27   1844.14   578.93   249.11  41.55  226.01  46.18  23.10   62.12  
1 1 1 7   15  10 o 3  295.15  35.14  2888.69   583.79   3106.95  823.61   2668.30   827.61   284.97  52.27  256.20  57.67  28.77   77.83  
1 1 1 7   15  11 o 18 174.24  20.60  928.98    202.11   1063.14  283.28   789.88    288.43   182.11  27.99  152.90  33.76  29.21   43.86  
1 1 1 7   15  12 o 16 105.64  16.89  340.05    99.00    292.16   131.81   402.00    149.94   95.40   24.07  112.19  24.01  -16.79  34.00  
1 1 1 7   15  13 o 11 128.76  17.47  505.00    125.83   547.89   171.38   454.84    185.35   131.31  23.60  117.26  27.93  14.05   36.57  
1 1 1 7   15  14 o 13 112.31  17.93  388.59    111.70   401.64   148.80   371.75    169.08   111.49  23.96  105.57  27.60  5.92    36.55  
1 1 1 7   15  15 o 17 71.64   23.41  160.05    110.73   160.05   110.73   0.00      0.00     71.64   23.41  ?       ?      0.00    23.41  
1 1 1 7   15  16 o 12 93.11   28.11  294.94    162.81   0.00     0.00     294.94    162.81   ?       ?      93.11   28.11  0.00    28.11  
1 1 1 7   15  17 o 18 85.88   20.38  238.61    98.98    189.67   125.00   320.85    162.05   76.27   24.86  96.30   27.78  -20.02  37.28  
1 1 1 7   15  18 o 15 56.78   19.94  94.62     80.44    61.61    108.87   134.31    119.38   55.18   22.27  66.71   24.19  -11.53  32.88  
1 1 1 7   15  19 o 7  82.11   19.27  220.36    89.29    257.51   117.24   169.07    137.78   86.96   23.10  72.14   26.01  14.82   34.79  
1 1 1 7   15  20 o 7  185.23  23.41  1157.14   243.39   1123.17  337.57   1193.92   351.26   166.00  36.43  170.59  36.94  -4.60   51.88  
1 1 1 7   16  0  o 12 96.92   16.49  284.13    88.45    302.24   116.75   259.73    135.51   98.63   21.25  90.74   25.14  7.89    32.92  
1 1 1 7   16  1  o 17 191.28  20.48  1106.53   221.39   1119.79  318.99   1094.22   307.51   186.78  30.82  185.12  29.96  1.66    42.98  
1 1 1 7   16  2  o 11 109.85  16.20  362.81    99.09    350.20   130.21   380.16    152.75   106.00  22.11  109.62  24.85  -3.62   33.26  
1 1 1 7   16  3  o 11 26.04   11.62  -13.96    35.31    -46.01   36.77    365.63    126.56   22.23   10.57  108.68  21.05  -86.45  23.55  
1 1 1 7   16  4  o 4  94.21   16.40  269.19    85.48    284.94   109.35   244.45    137.04   95.77   20.51  88.00   25.60  7.78    32.80  
1 1 1 7   16  5  o 18 229.44  25.80  1641.00   333.89   1652.18  467.45   1629.36   477.08   220.41  38.34  217.71  39.63  2.70    55.14  
1 1 1 7   16  6  o 18 44.86   17.89  33.20     69.36    49.87    85.72    1.60      118.03   51.02   20.03  51.34   22.11  -0.32   29.83  
1 1 1 7   16  7  o 15 84.55   17.94  220.72    84.37    216.19   108.35   227.70    134.50   82.82   22.30  84.86   25.53  -2.04   33.90  
1 1 1 7   16  8  o 12 176.92  21.14  961.67    210.50   1093.75  290.68   816.03    305.24   184.29  28.39  154.22  35.25  30.07   45.26  
1 1 1 7   16  9  o 14 225.05  26.55  1609.98   336.45   1801.89  470.69   1409.48   481.11   228.36  37.18  194.66  44.08  33.70   57.67  
1 1 1 7   16  10 o 11 75.08   19.39  176.97    84.18    162.40   104.04   204.57    143.23   72.32   22.59  80.81   26.63  -8.49   34.92  
1 1 1 7   16  11 o 12 208.86  24.04  1378.20   283.01   1323.91  394.58   1435.72   406.14   193.52  36.86  202.25  36.31  -8.73   51.75  
1 1 1 7   16  12 o 3  160.48  19.82  797.45    178.74   858.96   246.77   729.57    259.25   161.47  27.61  145.41  31.93  16.06   42.22  
1 1 1 7   16  13 o 11 164.80  20.49  849.04    189.69   945.13   262.51   744.05    274.40   168.31  28.16  144.54  33.69  23.76   43.91  
1 1 1 7   16  14 f 0  58.49   19.73  101.91    78.50    119.74   98.95    71.64     128.94   63.49   22.12  59.95   24.23  3.54    32.81  
1 1 1 7   16  15 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   16  16 o 10 43.83   18.70  11.88     82.96    43.51    99.75    -59.05    149.40   51.27   21.08  50.25   23.01  1.02    31.21  
1 1 1 7   16  17 o 8  102.62  20.03  343.25    113.78   292.15   145.69   423.15    182.17   90.97   26.37  107.80  28.86  -16.82  39.10  
1 1 1 7   16  18 o 8  43.90   19.13  2.00      90.57    -16.66   110.68   39.81     157.57   46.05   20.56  58.74   25.42  -12.69  32.69  
1 1 1 7   17  0  o 18 55.73   22.87  43.18     117.03   0.00     0.00     43.18     117.03   ?       ?      55.73   22.87  0.00    22.87  
1 1 1 7   17  1  o 14 71.32   24.78  147.63    124.10   0.00     0.00     147.63    124.10   ?       ?      71.32   24.78  0.00    24.78  
1 1 1 7   17  2  o 5  63.46   24.66  89.77     128.80   0.00     0.00     89.77     128.80   ?       ?      63.46   24.66  0.00    24.66  
1 1 1 7   17  3  o 10 118.07  26.62  452.60    176.09   0.00     0.00     452.60    176.09   ?       ?      118.07  26.62  0.00    26.62  
1 1 1 7   17  4  o 4  108.28  26.52  382.28    163.50   0.00     0.00     382.28    163.50   ?       ?      108.28  26.52  0.00    26.52  
1 1 1 7   17  5  o 4  86.53   26.03  240.84    139.78   0.00     0.00     240.84    139.78   ?       ?      86.53   26.03  0.00    26.03  
1 1 1 7   17  6  o 1  195.42  36.89  1338.85   398.72   0.00     0.00     1338.85   398.72   ?       ?      195.42  36.89  0.00    36.89  
1 1 1 7   17  7  o 5  140.90  28.75  659.40    224.65   0.00     0.00     659.40    224.65   ?       ?      140.90  28.75  0.00    28.75  
1 1 1 7   17  8  o 4  79.28   26.96  196.66    146.69   0.00     0.00     196.66    146.69   ?       ?      79.28   26.96  0.00    26.96  
1 1 1 7   17  9  o 4  48.80   22.34  -70.30    140.79   0.00     0.00     -70.30    140.79   ?       ?      48.80   22.34  0.00    22.34  
1 1 1 7   17  10 o 2  234.98  53.38  2455.47   703.68   0.00     0.00     2455.47   703.68   ?       ?      234.98  53.38  0.00    53.38  
1 1 1 7   17  11 o 11 180.07  37.18  1207.12   371.56   0.00     0.00     1207.12   371.56   ?       ?      180.07  37.18  0.00    37.18  
1 1 1 7   17  12 o 2  63.05   25.29  88.96     139.32   0.00     0.00     88.96     139.32   ?       ?      63.05   25.29  0.00    25.29  
1 1 1 7   17  13 o 1  95.19   27.88  317.65    162.09   0.00     0.00     317.65    162.09   ?       ?      95.19   27.88  0.00    27.88  
1 1 1 7   17  14 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 7   18  4  o 18 59.25   24.63  48.92     138.17   0.00     0.00     48.92     138.17   ?       ?      59.25   24.63  0.00    24.63  
1 1 1 7   18  5  o 2  127.49  17.94  500.59    127.68   544.82   170.03   443.42    193.33   130.07  23.64  113.90  29.38  16.17   37.71  
1 1 1 7   18  6  o 4  126.07  28.76  540.22    203.53   0.00     0.00     540.22    203.53   ?       ?      126.07  28.76  0.00    28.76  
1 1 1 8   -17 0  o 3  49.54   21.02  20.27     103.89   11.96    110.08   88.04     314.37   49.78   21.39  80.18   35.27  -30.40  41.25  
1 1 1 8   -17 1  o 2  210.79  28.66  1500.45   337.82   1553.19  439.95   1424.69   527.31   201.97  39.36  177.89  49.72  24.08   63.41  
1 1 1 8   -16 0  o 9  69.09   22.32  147.43    100.82   156.08   108.81   94.92     268.15   71.01   23.20  78.73   33.60  -7.72   40.83  
1 1 1 8   -16 1  o 2  56.77   21.50  78.50     96.18    93.05    104.35   -3.73     248.07   60.16   22.48  69.89   31.01  -9.73   38.30  
1 1 1 8   -16 2  o 2  63.32   23.04  109.96    108.48   129.32   120.68   28.45     247.63   67.52   24.34  72.04   31.51  -4.52   39.82  
1 1 1 8   -16 3  o 10 74.53   31.92  69.40     243.59   0.00     0.00     69.40     243.59   ?       ?      74.53   31.92  0.00    31.92  
1 1 1 8   -16 4  o 14 113.31  22.80  411.47    143.18   365.46   169.49   526.13    267.55   104.41  27.79  120.67  35.94  -16.26  45.43  
1 1 1 8   -16 5  o 5  50.59   21.06  29.38     101.14   28.40    111.48   33.94     240.48   52.43   21.98  71.50   31.17  -19.07  38.14  
1 1 1 8   -16 6  f 0  125.95  21.50  501.00    149.87   528.21   181.36   442.42    266.13   127.04  25.75  110.99  36.29  16.05   44.50  
1 1 1 8   -16 7  o 12 103.25  35.60  371.49    255.90   0.00     0.00     371.49    255.90   ?       ?      103.25  35.60  0.00    35.60  
1 1 1 8   -15 0  o 7  141.68  26.29  644.18    205.98   644.18   205.98   0.00      0.00     141.68  26.29  ?       ?      0.00    26.29  
1 1 1 8   -15 1  o 10 154.47  28.00  771.98    239.18   771.98   239.18   0.00      0.00     154.47  28.00  ?       ?      0.00    28.00  
1 1 1 8   -15 2  o 14 111.56  20.53  386.83    126.63   425.80   151.64   297.05    230.17   115.89  23.60  96.60   33.74  19.29   41.17  
1 1 1 8   -15 3  o 9  63.84   22.00  116.43    97.69    128.70   113.58   81.57     191.49   67.41   23.69  70.79   29.17  -3.37   37.58  
1 1 1 8   -15 4  o 7  118.93  20.66  438.78    135.92   454.17   168.50   410.11    229.95   118.96  25.44  110.21  33.44  8.76    42.01  
1 1 1 8   -15 5  o 12 127.13  20.34  499.12    143.44   523.02   179.98   457.51    237.46   127.86  25.42  115.91  33.69  11.94   42.20  
1 1 1 8   -15 6  o 11 63.74   22.02  116.03    97.96    124.97   110.97   84.50     208.46   66.50   23.41  72.98   30.29  -6.49   38.28  
1 1 1 8   -15 7  o 3  63.61   21.91  116.16    96.91    116.16   96.91    0.00      0.00     63.61   21.91  ?       ?      0.00    21.91  
1 1 1 8   -15 8  o 19 161.33  35.06  899.56    315.40   0.00     0.00     899.56    315.40   ?       ?      161.33  35.06  0.00    35.06  
1 1 1 8   -15 9  o 4  79.98   29.44  184.56    177.80   0.00     0.00     184.56    177.80   ?       ?      79.98   29.44  0.00    29.44  
1 1 1 8   -15 10 o 8  154.25  32.83  814.18    281.83   0.00     0.00     814.18    281.83   ?       ?      154.25  32.83  0.00    32.83  
1 1 1 8   -15 11 o 12 167.85  21.06  873.83    198.49   1040.95  269.84   676.78    293.01   179.34  27.05  137.57  36.50  41.77   45.43  
1 1 1 8   -14 0  o 19 142.41  18.63  612.44    148.68   605.35   195.91   622.06    228.31   138.72  25.54  138.77  29.57  -0.05   39.07  
1 1 1 8   -14 1  o 10 119.39  18.34  432.19    121.65   499.20   149.24   299.51    210.01   127.46  21.14  97.55   32.25  29.91   38.56  
1 1 1 8   -14 2  o 10 53.30   20.58  59.20     89.25    59.20    89.25    0.00      0.00     53.30   20.58  ?       ?      0.00    20.58  
1 1 1 8   -14 3  o 8  94.66   22.26  280.64    118.92   280.64   118.92   0.00      0.00     94.66   22.26  ?       ?      0.00    22.26  
1 1 1 8   -14 4  o 6  155.91  27.36  770.02    235.92   770.02   235.92   0.00      0.00     155.91  27.36  ?       ?      0.00    27.36  
1 1 1 8   -14 5  o 18 199.48  22.73  1218.30   255.66   1208.36  354.70   1229.06   368.84   192.14  33.37  192.97  34.56  -0.83   48.04  
1 1 1 8   -14 6  f 0  252.74  28.76  2016.85   409.86   2131.62  574.82   1898.17   584.56   248.25  41.82  230.06  45.87  18.19   62.07  
1 1 1 8   -14 7  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   -14 8  o 15 118.55  17.99  426.62    118.60   374.97   154.12   501.60    185.72   108.46  25.23  125.21  26.66  -16.75  36.70  
1 1 1 8   -14 9  o 10 47.76   18.90  40.81     76.78    52.11    91.82    14.52     139.99   52.52   20.70  56.85   24.27  -4.33   31.90  
1 1 1 8   -14 10 o 16 180.76  21.53  1002.62   219.05   1073.36  301.39   923.41    318.91   182.02  29.88  165.34  34.71  16.68   45.80  
1 1 1 8   -14 11 o 1  79.92   28.02  189.43    158.91   0.00     0.00     189.43    158.91   ?       ?      79.92   28.02  0.00    28.02  
1 1 1 8   -14 12 o 1  107.25  29.17  381.73    184.28   0.00     0.00     381.73    184.28   ?       ?      107.25  29.17  0.00    29.17  
1 1 1 8   -14 13 o 9  109.69  19.12  372.35    116.03   400.05   148.71   329.25    185.51   111.75  23.90  99.51   30.00  12.24   38.36  
1 1 1 8   -13 0  o 17 97.51   25.83  297.35    146.88   0.00     0.00     297.35    146.88   ?       ?      97.51   25.83  0.00    25.83  
1 1 1 8   -13 1  o 15 170.19  30.11  910.78    283.38   0.00     0.00     910.78    283.38   ?       ?      170.19  30.11  0.00    30.11  
1 1 1 8   -13 2  o 9  160.95  18.74  773.26    169.95   795.24   231.04   747.35    250.87   160.56  25.95  154.10  29.43  6.47    39.24  
1 1 1 8   -13 3  o 8  52.23   18.67  69.62     70.85    71.17    85.55    66.22     126.40   54.94   20.38  61.03   24.21  -6.09   31.65  
1 1 1 8   -13 4  o 11 99.43   22.16  305.69    123.23   305.69   123.23   0.00      0.00     99.43   22.16  ?       ?      0.00    22.16  
1 1 1 8   -13 5  o 17 70.89   21.65  151.09    96.19    151.09   96.19    0.00      0.00     70.89   21.65  ?       ?      0.00    21.65  
1 1 1 8   -13 6  o 9  117.78  23.18  429.35    151.13   429.35   151.13   0.00      0.00     117.78  23.18  ?       ?      0.00    23.18  
1 1 1 8   -13 7  o 7  140.25  28.09  622.46    218.24   0.00     0.00     622.46    218.24   ?       ?      140.25  28.09  0.00    28.09  
1 1 1 8   -13 8  o 15 244.85  27.27  1859.43   376.78   2043.09  529.14   1670.54   536.62   248.33  38.35  219.49  44.12  28.84   58.46  
1 1 1 8   -13 9  o 19 201.88  22.73  1242.02   258.85   1258.14  360.99   1224.96   371.36   197.20  33.06  193.44  34.72  3.75    47.94  
1 1 1 8   -13 10 o 13 142.09  18.16  607.58    144.72   642.17   198.76   568.55    211.13   143.35  25.07  133.21  28.47  10.13   37.93  
1 1 1 8   -13 11 o 14 49.17   18.78  51.96     73.81    73.04    91.45    12.55     125.04   55.90   21.01  54.05   23.00  1.85    31.15  
1 1 1 8   -13 12 o 2  190.51  21.57  1107.55   231.78   1264.56  323.71   942.37    332.03   199.12  29.19  167.35  35.65  31.76   46.08  
1 1 1 8   -13 13 o 13 63.49   24.70  87.44     129.37   0.00     0.00     87.44     129.37   ?       ?      63.49   24.70  0.00    24.70  
1 1 1 8   -13 14 o 19 109.50  27.40  390.72    171.76   0.00     0.00     390.72    171.76   ?       ?      109.50  27.40  0.00    27.40  
1 1 1 8   -13 15 o 4  48.07   18.97  43.18     77.22    70.96    95.18    -10.34    132.10   55.77   21.32  52.65   23.02  3.12    31.38  
1 1 1 8   -13 16 o 6  75.98   19.60  181.21    86.04    198.30   107.60   150.89    143.27   79.12   22.58  73.09   26.50  6.03    34.82  
1 1 1 8   -12 0  o 1  155.55  25.59  738.50    220.56   738.50   220.56   0.00      0.00     155.55  25.59  ?       ?      0.00    25.59  
1 1 1 8   -12 1  o 14 167.45  18.93  831.98    178.77   819.75   246.54   845.55    259.60   163.46  27.23  165.66  28.31  -2.20   39.28  
1 1 1 8   -12 2  o 9  57.03   21.99  65.42     101.87   0.00     0.00     65.42     101.87   ?       ?      57.03   21.99  0.00    21.99  
1 1 1 8   -12 3  o 18 83.41   24.09  211.82    121.77   0.00     0.00     211.82    121.77   ?       ?      83.41   24.09  0.00    24.09  
1 1 1 8   -12 4  o 15 205.74  22.35  1266.38   259.76   1240.68  365.27   1292.68   369.49   199.00  33.14  203.40  32.76  -4.40   46.60  
1 1 1 8   -12 5  o 12 75.79   16.99  174.33    72.08    200.47   90.22    128.16    119.87   81.01   19.61  69.22   24.33  11.79   31.25  
1 1 1 8   -12 6  x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   -12 7  o 5  210.72  34.35  1403.97   401.27   1403.97  401.27   0.00      0.00     210.72  34.35  ?       ?      0.00    34.35  
1 1 1 8   -12 8  o 18 215.53  35.39  1481.60   422.72   1481.60  422.72   0.00      0.00     215.53  35.39  ?       ?      0.00    35.39  
1 1 1 8   -12 9  o 1  87.86   16.64  233.36    80.83    221.48   104.56   251.01    127.45   84.74   21.47  89.93   24.17  -5.20   32.33  
1 1 1 8   -12 10 o 7  147.44  17.46  647.99    144.92   727.43   198.37   557.05    212.24   154.33  23.10  132.59  28.72  21.74   36.85  
1 1 1 8   -12 11 o 15 194.55  21.71  1144.28   238.32   1165.79  333.91   1121.95   340.24   191.34  31.49  186.81  32.93  4.53    45.56  
1 1 1 8   -12 12 o 2  100.29  16.41  303.11    91.20    289.55   121.99   320.30    137.31   96.36   22.47  101.02  24.03  -4.66   32.90  
1 1 1 8   -12 13 o 5  114.01  16.15  389.74    102.77   439.14   139.92   331.88    151.44   119.48  21.17  102.26  25.80  17.22   33.38  
1 1 1 8   -12 14 o 16 131.91  17.44  523.61    128.84   539.65   176.49   505.32    188.51   131.30  24.31  125.88  26.90  5.42    36.26  
1 1 1 8   -12 15 o 12 154.21  29.11  766.58    248.22   0.00     0.00     766.58    248.22   ?       ?      154.21  29.11  0.00    29.11  
1 1 1 8   -12 16 o 2  91.45   26.32  268.18    145.61   0.00     0.00     268.18    145.61   ?       ?      91.45   26.32  0.00    26.32  
1 1 1 8   -12 17 o 16 193.28  21.98  1154.41   239.55   1296.38  335.86   1007.40   341.76   198.95  30.37  170.74  36.00  28.21   47.10  
1 1 1 8   -12 18 o 18 44.81   16.05  51.90     52.36    -0.00    56.66    355.37    137.00   35.90   15.39  105.50  23.25  -69.60  27.88  
1 1 1 8   -11 0  o 13 170.76  18.70  858.41    180.30   901.05   251.18   813.08    258.95   173.05  26.09  163.46  28.64  9.59    38.74  
1 1 1 8   -11 1  o 7  120.50  15.00  426.88    101.51   501.36   136.67   335.23    151.60   129.94  18.87  104.67  25.47  25.27   31.70  
1 1 1 8   -11 2  o 1  132.19  16.17  514.34    120.15   475.00   163.24   560.84    177.49   125.28  23.56  136.41  23.51  -11.13  33.29  
1 1 1 8   -11 3  o 13 555.19  66.88  10616.28  2088.61  11125.85 2953.44  10106.50  2954.04  513.58  103.75 478.07  109.93 35.51   151.16 
1 1 1 8   -11 4  x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   -11 5  x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   -11 6  o 15 128.80  23.95  504.62    170.57   0.00     0.00     504.62    170.57   ?       ?      128.80  23.95  0.00    23.95  
1 1 1 8   -11 7  o 2  276.29  29.58  2318.49   461.80   2390.76  651.95   2245.72   654.22   272.70  43.07  262.94  44.96  9.77    62.26  
1 1 1 8   -11 8  o 18 339.81  60.64  4071.96   1139.58  4071.96  1139.58  0.00      0.00     339.81  60.64  ?       ?      0.00    60.64  
1 1 1 8   -11 9  o 11 235.65  38.46  1768.65   502.31   1768.65  502.31   0.00      0.00     235.65  38.46  ?       ?      0.00    38.46  
1 1 1 8   -11 10 o 3  232.56  38.12  1728.80   491.28   1728.80  491.28   0.00      0.00     232.56  38.12  ?       ?      0.00    38.12  
1 1 1 8   -11 11 o 13 399.87  46.80  5330.95   1053.91  5343.94  1489.85  5317.94   1491.07  366.22  73.42  364.86  73.73  1.36    104.05 
1 1 1 8   -11 12 o 11 185.02  20.40  1024.93   213.05   1117.31  298.10   928.48    304.59   189.90  28.20  170.92  32.22  18.98   42.82  
1 1 1 8   -11 13 o 1  129.62  16.17  499.95    117.74   591.89   162.95   399.54    170.30   139.66  20.97  112.53  26.76  27.13   34.00  
1 1 1 8   -11 14 o 18 220.00  24.18  1477.89   300.40   1563.97  422.33   1389.74   427.36   219.91  34.60  204.97  37.71  14.94   51.18  
1 1 1 8   -11 15 o 4  203.04  22.68  1255.56   259.84   1240.95  364.67   1270.63   370.33   195.43  33.72  197.72  33.84  -2.29   47.78  
1 1 1 8   -11 16 o 12 134.87  17.30  546.47    130.89   581.71   180.21   507.12    190.42   136.68  23.83  126.06  27.12  10.62   36.10  
1 1 1 8   -11 17 o 15 129.22  26.51  533.00    190.04   0.00     0.00     533.00    190.04   ?       ?      129.22  26.51  0.00    26.51  
1 1 1 8   -11 18 o 2  213.85  38.99  1588.67   460.98   0.00     0.00     1588.67   460.98   ?       ?      213.85  38.99  0.00    38.99  
1 1 1 8   -11 19 o 1  148.78  18.63  674.70    155.64   677.91   214.69   671.14    225.95   144.90  26.80  143.16  28.50  1.74    39.12  
1 1 1 8   -10 0  o 16 252.07  26.46  1886.59   377.22   1908.98  531.60   1863.89   535.35   249.20  38.39  245.83  39.25  3.37    54.91  
1 1 1 8   -10 1  f 0  101.91  15.00  306.65    85.15    327.91   112.26   277.86    130.67   104.61  19.41  95.63   23.88  8.98    30.77  
1 1 1 8   -10 2  o 3  661.56  81.96  15429.41  3046.00  14864.29 4307.27  15994.74  4308.13  564.51  134.78 597.47  129.36 -32.96  186.82 
1 1 1 8   -10 3  o 18 450.93  49.33  6355.58   1256.23  6194.67  1776.06  6516.68   1777.10  423.15  75.90  436.43  73.54  -13.28  105.69 
1 1 1 8   -10 4  o 5  283.03  44.68  2495.68   701.88   2495.68  701.88   0.00      0.00     283.03  44.68  ?       ?      0.00    44.68  
1 1 1 8   -10 5  x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   -10 6  o 10 259.34  41.06  2084.12   590.99   0.00     0.00     2084.12   590.99   ?       ?      259.34  41.06  0.00    41.06  
1 1 1 8   -10 7  o 5  155.94  26.54  735.15    229.06   0.00     0.00     735.15    229.06   ?       ?      155.94  26.54  0.00    26.54  
1 1 1 8   -10 8  o 4  116.76  15.12  401.49    98.95    442.15   134.82   354.00    145.69   121.57  20.01  107.69  24.16  13.88   31.38  
1 1 1 8   -10 9  o 3  268.14  28.58  2164.91   433.11   2105.44  611.25   2224.86   613.77   257.23  42.90  265.26  41.68  -8.03   59.82  
1 1 1 8   -10 10 o 8  164.30  26.85  822.53    244.47   822.53   244.47   0.00      0.00     164.30  26.85  ?       ?      0.00    26.85  
1 1 1 8   -10 11 f 0  192.98  31.20  1151.44   333.81   1151.44  333.81   0.00      0.00     192.98  31.20  ?       ?      0.00    31.20  
1 1 1 8   -10 12 o 17 207.79  22.43  1290.49   263.33   1310.65  370.71   1269.95   374.13   205.14  32.57  201.40  33.54  3.73    46.75  
1 1 1 8   -10 13 o 15 192.58  20.92  1107.29   227.60   1157.05  319.26   1055.87   324.56   193.31  29.72  183.48  31.98  9.83    43.65  
1 1 1 8   -10 14 o 9  84.82   16.45  217.50    77.20    215.50   103.04   220.05    116.55   83.65   21.38  84.50   23.28  -0.85   31.61  
1 1 1 8   -10 15 o 15 63.62   17.96  122.59    68.44    129.95   90.01    112.52    105.37   66.38   21.05  64.70   22.81  1.69    31.04  
1 1 1 8   -10 16 o 6  108.04  15.91  349.59    95.75    352.12   129.41   346.53    142.31   106.68  21.87  105.18  24.09  1.50    32.53  
1 1 1 8   -10 17 o 5  108.21  19.07  357.34    114.11   -1.94    145.64   928.61    183.65   56.60   24.47  176.05  18.45  -119.45 30.64  
1 1 1 8   -10 18 o 15 55.61   18.21  89.18     67.03    101.88   85.33    68.70     108.33   60.19   20.56  57.94   22.59  2.25    30.55  
1 1 1 8   -10 19 o 4  211.74  37.87  1530.90   443.38   0.00     0.00     1530.90   443.38   ?       ?      211.74  37.87  0.00    37.87  
1 1 1 8   -10 20 o 10 139.03  27.22  625.64    209.50   0.00     0.00     625.64    209.50   ?       ?      139.03  27.22  0.00    27.22  
1 1 1 8   -10 21 o 17 90.20   25.80  263.84    140.36   0.00     0.00     263.84    140.36   ?       ?      90.20   25.80  0.00    25.80  
1 1 1 8   -9  0  o 6  163.08  25.56  799.28    231.45   799.28   231.45   0.00      0.00     163.08  25.56  ?       ?      0.00    25.56  
1 1 1 8   -9  1  o 1  292.67  30.67  2568.06   507.61   2754.22  717.78   2381.82   717.96   297.23  43.34  274.00  47.36  23.23   64.20  
1 1 1 8   -9  2  o 2  441.32  48.36  6112.10   1205.23  6206.89  1704.19  6017.26   1704.72  423.65  72.69  415.59  74.18  8.06    103.85 
1 1 1 8   -9  3  o 19 488.97  54.47  7634.64   1502.97  7953.33  2125.48  7315.92   2125.57  472.08  81.37  447.48  85.87  24.59   118.29 
1 1 1 8   -9  4  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   -9  5  o 17 216.86  33.93  1428.82   408.55   0.00     0.00     1428.82   408.55   ?       ?      216.86  33.93  0.00    33.93  
1 1 1 8   -9  6  o 19 191.86  20.52  1081.98   222.47   1007.58  313.24   1157.71   316.03   182.35  31.03  196.39  28.89  -14.04  42.40  
1 1 1 8   -9  7  o 18 322.08  33.92  3112.04   617.81   3072.98  873.10   3151.20   874.33   312.27  50.42  316.66  49.74  -4.39   70.82  
1 1 1 8   -9  8  o 2  296.36  46.91  2744.29   771.62   0.00     0.00     2744.29   771.62   ?       ?      296.36  46.91  0.00    46.91  
1 1 1 8   -9  9  o 7  351.89  57.60  4012.49   1123.27  0.00     0.00     4012.49   1123.27  ?       ?      351.89  57.60  0.00    57.60  
1 1 1 8   -9  10 o 8  76.26   16.22  174.88    68.84    142.58   91.74    216.49    104.13   69.65   21.12  84.50   21.44  -14.85  30.09  
1 1 1 8   -9  11 o 15 206.47  22.04  1262.85   257.21   1263.15  362.35   1262.55   365.17   203.08  32.15  202.92  32.44  0.16    45.67  
1 1 1 8   -9  12 o 15 268.28  43.66  2303.96   649.27   2303.96  649.27   0.00      0.00     268.28  43.66  ?       ?      0.00    43.66  
1 1 1 8   -9  13 o 13 160.56  26.49  786.52    235.63   786.52   235.63   0.00      0.00     160.56  26.49  ?       ?      0.00    26.49  
1 1 1 8   -9  14 o 17 88.48   15.48  234.31    75.74    225.79   104.55   243.71    109.88   85.87   21.31  89.16   21.68  -3.29   30.40  
1 1 1 8   -9  15 o 18 316.34  34.78  3135.05   621.18   3195.42  878.14   3074.58   878.83   304.69  52.07  297.50  53.42  7.18    74.60  
1 1 1 8   -9  16 o 7  161.87  17.37  777.76    158.89   976.47   221.18   565.87    228.40   179.99  21.85  133.33  30.50  46.66   37.52  
1 1 1 8   -9  17 o 12 69.68   20.69  147.05    88.79    -414.06  115.35   963.00    139.09   27.79   14.09  181.26  13.46  -153.47 19.49  
1 1 1 8   -9  18 o 5  92.57   22.61  267.67    119.13   0.00     0.00     267.67    119.13   ?       ?      92.57   22.61  0.00    22.61  
1 1 1 8   -9  19 o 13 200.94  22.02  1230.10   249.82   1390.50  353.54   1070.12   353.07   208.65  30.41  179.35  35.55  29.31   46.78  
1 1 1 8   -9  20 o 7  108.40  24.40  372.99    148.14   0.00     0.00     372.99    148.14   ?       ?      108.40  24.40  0.00    24.40  
1 1 1 8   -9  21 o 14 65.94   23.13  122.87    108.28   0.00     0.00     122.87    108.28   ?       ?      65.94   23.13  0.00    23.13  
1 1 1 8   -9  22 o 6  74.18   24.21  169.50    118.48   0.00     0.00     169.50    118.48   ?       ?      74.18   24.21  0.00    24.21  
1 1 1 8   -8  0  o 17 290.39  45.62  2629.22   735.51   2629.22  735.51   0.00      0.00     290.39  45.62  ?       ?      0.00    45.62  
1 1 1 8   -8  1  o 7  49.22   16.17  67.10     52.84    67.10    52.84    0.00      0.00     49.22   16.17  ?       ?      0.00    16.17  
1 1 1 8   -8  2  o 8  432.40  46.71  5791.12   1141.09  5938.68  1613.67  5643.54   1613.81  420.73  69.22  408.04  71.50  12.69   99.51  
1 1 1 8   -8  3  o 15 159.59  24.84  762.25    220.13   762.25   220.13   0.00      0.00     159.59  24.84  ?       ?      0.00    24.84  
1 1 1 8   -8  4  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   -8  5  o 12 184.35  19.45  998.53    202.75   1022.42  285.74   974.31    287.73   184.42  27.86  179.65  28.88  4.77    40.12  
1 1 1 8   -8  6  o 19 314.91  33.12  2980.98   589.84   3032.88  833.84   2929.01   834.47   310.14  48.42  304.09  49.50  6.05    69.24  
1 1 1 8   -8  7  o 12 66.22   15.30  131.87    56.98    143.20   75.98    117.31    86.13    69.09   18.70  64.24   20.62  4.86    27.84  
1 1 1 8   -8  8  o 14 343.18  36.32  3552.60   704.67   3420.96  996.09   3684.48   997.02   326.96  55.02  340.98  52.63  -14.03  76.14  
1 1 1 8   -8  9  o 1  333.95  53.48  3536.37   990.64   0.00     0.00     3536.37   990.64   ?       ?      333.95  53.48  0.00    53.48  
1 1 1 8   -8  10 o 10 193.07  30.83  1125.11   330.24   0.00     0.00     1125.11   330.24   ?       ?      193.07  30.83  0.00    30.83  
1 1 1 8   -8  11 o 11 190.54  20.51  1067.75   220.84   1039.53  310.78   1096.54   313.88   185.44  30.23  190.74  29.63  -5.30   42.33  
1 1 1 8   -8  12 o 7  212.69  22.65  1337.26   272.25   1283.87  384.01   1391.23   386.05   204.81  33.84  213.88  32.46  -9.07   46.89  
1 1 1 8   -8  13 o 14 225.62  35.81  1574.35   448.29   1574.35  448.29   0.00      0.00     225.62  35.81  ?       ?      0.00    35.81  
1 1 1 8   -8  14 o 15 167.99  27.21  859.61    253.45   859.61   253.45   0.00      0.00     167.99  27.21  ?       ?      0.00    27.21  
1 1 1 8   -8  15 o 16 210.47  33.90  1381.85   395.69   1381.85  395.69   0.00      0.00     210.47  33.90  ?       ?      0.00    33.90  
1 1 1 8   -8  16 o 3  180.97  29.68  1013.81   297.68   0.00     0.00     1013.81   297.68   ?       ?      180.97  29.68  0.00    29.68  
1 1 1 8   -8  17 o 16 85.60   15.12  219.81    71.60    233.97   98.12    203.69    104.72   87.36   20.00  81.43   21.92  5.93    29.67  
1 1 1 8   -8  18 o 7  148.60  25.84  685.25    212.46   0.00     0.00     685.25    212.46   ?       ?      148.60  25.84  0.00    25.84  
1 1 1 8   -8  19 o 18 181.16  30.93  1047.59   310.15   0.00     0.00     1047.59   310.15   ?       ?      181.16  30.93  0.00    30.93  
1 1 1 8   -8  20 o 17 141.50  16.92  599.41    134.74   704.52   191.81   497.02    189.31   151.22  22.80  124.79  27.20  26.43   35.49  
1 1 1 8   -8  21 o 12 193.72  33.71  1239.95   361.31   0.00     0.00     1239.95   361.31   ?       ?      193.72  33.71  0.00    33.71  
1 1 1 8   -8  22 o 5  195.93  34.78  1297.04   376.92   0.00     0.00     1297.04   376.92   ?       ?      195.93  34.78  0.00    34.78  
1 1 1 8   -8  23 o 11 137.02  26.12  607.74    197.95   0.00     0.00     607.74    197.95   ?       ?      137.02  26.12  0.00    26.12  
1 1 1 8   -7  0  o 18 326.54  33.99  3177.81   627.77   3042.68  887.66   3313.03   887.95   312.39  51.28  327.43  48.72  -15.05  70.73  
1 1 1 8   -7  1  o 14 338.87  35.33  3429.20   677.18   3481.58  957.51   3376.77   957.86   334.53  51.51  328.89  52.50  5.64    73.55  
1 1 1 8   -7  2  o 17 226.40  34.52  1545.48   434.46   1545.48  434.46   0.00      0.00     226.40  34.52  ?       ?      0.00    34.52  
1 1 1 8   -7  3  x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   -7  4  o 4  446.86  75.50  6697.79   1867.88  0.00     0.00     6697.79   1867.88  ?       ?      446.86  75.50  0.00    75.50  
1 1 1 8   -7  5  o 16 416.94  44.48  5315.87   1048.15  5472.82  1482.19  5158.86   1482.43  409.55  65.23  395.65  67.70  13.90   94.01  
1 1 1 8   -7  6  o 2  342.75  36.06  3535.98   698.93   3479.34  988.37   3592.64   988.51   330.99  53.87  337.03  52.83  -6.04   75.45  
1 1 1 8   -7  7  o 14 141.94  15.60  589.62    125.02   513.19   175.84   667.74    177.79   130.49  24.37  150.04  21.23  -19.55  32.32  
1 1 1 8   -7  8  o 12 418.74  45.25  5420.93   1070.44  5299.88  1513.74  5542.00   1513.93  396.40  69.03  407.12  67.11  -10.72  96.28  
1 1 1 8   -7  9  o 16 182.31  19.37  976.21    199.63   953.61   281.61   999.03    283.04   177.86  28.55  182.31  27.93  -4.45   39.94  
1 1 1 8   -7  10 o 19 372.28  39.52  4210.75   831.74   4283.36  1176.16  4138.12   1176.35  364.45  58.17  357.28  59.44  7.18    83.17  
1 1 1 8   -7  11 o 4  53.39   20.47  56.26     87.86    0.00     0.00     56.26     87.86    ?       ?      53.39   20.47  0.00    20.47  
1 1 1 8   -7  12 o 2  133.97  24.46  539.95    181.21   0.00     0.00     539.95    181.21   ?       ?      133.97  24.46  0.00    24.46  
1 1 1 8   -7  13 o 17 165.09  18.34  800.30    170.88   754.51   239.37   847.89    244.02   158.11  27.36  168.16  26.13  -10.05  37.83  
1 1 1 8   -7  14 o 13 186.74  20.06  1027.95   211.72   1020.71  298.32   1035.30   300.52   183.44  29.31  184.78  29.31  -1.34   41.45  
1 1 1 8   -7  15 o 10 259.86  41.68  2137.60   600.79   2137.60  600.79   0.00      0.00     259.86  41.68  ?       ?      0.00    41.68  
1 1 1 8   -7  16 o 17 28.47   14.34  -338.18   107.88   -338.18  107.88   0.00      0.00     28.47   14.34  ?       ?      0.00    14.34  
1 1 1 8   -7  17 o 17 117.05  15.16  405.16    99.48    409.54   138.88   400.55    142.57   116.06  21.64  114.53  22.49  1.53    31.21  
1 1 1 8   -7  18 o 1  199.80  21.81  1196.84   246.05   1143.11  347.45   1250.88   348.48   190.21  33.02  199.99  31.38  -9.79   45.55  
1 1 1 8   -7  19 o 14 200.42  21.85  1210.63   247.33   1262.62  349.83   1158.66   349.73   199.86  31.54  190.38  33.21  9.48    45.80  
1 1 1 8   -7  20 o 10 180.52  20.01  981.17    203.91   1075.06  289.13   888.27    287.62   185.13  28.09  166.31  31.27  18.81   42.03  
1 1 1 8   -7  21 o 13 364.22  44.72  4633.23   915.44   4725.78  1295.26  4540.86   1294.00  326.94  71.05  317.29  72.62  9.65    101.59 
1 1 1 8   -7  22 o 14 140.38  17.45  593.77    137.57   621.00   197.12   567.92    192.09   140.13  25.44  133.61  25.98  6.51    36.36  
1 1 1 8   -7  23 o 17 109.67  23.83  383.48    145.70   0.00     0.00     383.48    145.70   ?       ?      109.67  23.83  0.00    23.83  
1 1 1 8   -7  24 o 14 175.38  32.05  1039.87   310.79   0.00     0.00     1039.87   310.79   ?       ?      175.38  32.05  0.00    32.05  
1 1 1 8   -6  0  o 8  299.66  46.21  2753.12   769.35   0.00     0.00     2753.12   769.35   ?       ?      299.66  46.21  0.00    46.21  
1 1 1 8   -6  1  o 8  350.82  36.52  3672.14   724.68   3735.99  1024.88  3608.30   1024.83  346.87  53.16  340.25  54.29  6.62    75.99  
1 1 1 8   -6  2  f 0  186.87  28.40  1041.83   295.09   1041.83  295.09   0.00      0.00     186.87  28.40  ?       ?      0.00    28.40  
1 1 1 8   -6  3  x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   -6  4  o 9  452.76  74.53  6706.37   1869.87  6706.37  1869.87  0.00      0.00     452.76  74.53  ?       ?      0.00    74.53  
1 1 1 8   -6  5  o 15 347.14  36.16  3594.78   710.03   3478.31  1003.87  3711.37   1004.39  333.86  54.24  346.06  52.18  -12.20  75.26  
1 1 1 8   -6  6  o 17 369.58  38.72  4097.61   809.23   3984.78  1144.24  4210.51   1144.59  355.24  58.12  366.38  56.21  -11.14  80.85  
1 1 1 8   -6  7  o 5  431.93  46.07  5697.80   1124.70  5387.73  1590.37  6008.03   1590.76  404.00  71.17  430.47  66.51  -26.46  97.42  
1 1 1 8   -6  8  o 11 384.93  40.79  4493.35   887.64   4304.21  1255.18  4682.57   1255.43  364.42  62.23  382.46  59.08  -18.04  85.81  
1 1 1 8   -6  9  o 13 225.28  23.46  1496.33   298.94   1526.53  422.13   1465.94   423.41   224.49  33.80  219.59  34.74  4.90    48.48  
1 1 1 8   -6  10 o 19 325.64  34.34  3191.38   632.26   3053.60  894.02   3329.23   894.27   309.54  52.16  325.01  49.49  -15.47  71.90  
1 1 1 8   -6  11 o 9  215.22  22.60  1365.71   275.05   1383.94  388.36   1347.35   389.61   213.70  32.70  210.59  33.34  3.11    46.69  
1 1 1 8   -6  12 o 19 396.62  66.08  5197.09   1451.64  0.00     0.00     5197.09   1451.64  ?       ?      396.62  66.08  0.00    66.08  
1 1 1 8   -6  13 o 19 377.65  61.95  4635.62   1296.44  0.00     0.00     4635.62   1296.44  ?       ?      377.65  61.95  0.00    61.95  
1 1 1 8   -6  14 o 1  310.68  32.68  2890.79   574.16   2882.02  811.45   2899.58   812.53   303.14  48.24  304.13  48.14  -0.99   68.15  
1 1 1 8   -6  15 o 2  271.36  30.78  2212.72   470.96   -71.66   660.97   4568.64   671.24   115.43  50.95  391.37  30.11  -275.94 59.18  
1 1 1 8   -6  16 o 18 260.80  41.82  2147.38   604.92   2147.38  604.92   0.00      0.00     260.80  41.82  ?       ?      0.00    41.82  
1 1 1 8   -6  17 o 9  265.95  43.65  2281.57   643.28   2281.57  643.28   0.00      0.00     265.95  43.65  ?       ?      0.00    43.65  
1 1 1 8   -6  18 o 2  220.74  23.68  1461.48   295.38   1507.38  417.54   1415.49   417.92   219.31  34.29  211.70  35.65  7.62    49.47  
1 1 1 8   -6  19 o 13 417.15  49.41  5898.36   1160.25  6190.58  1641.43  5606.55   1640.26  390.25  76.00  363.40  80.72  26.85   110.87 
1 1 1 8   -6  20 o 18 165.29  18.97  817.23    176.72   722.68   249.86   911.88    249.99   150.96  29.89  171.77  26.18  -20.82  39.73  
1 1 1 8   -6  21 f 0  182.28  20.49  1003.24   210.73   951.63   298.39   1054.60   297.65   172.06  31.36  182.44  29.42  -10.38  43.00  
1 1 1 8   -6  22 f 0  193.05  21.88  1137.09   238.20   1050.80  338.22   1222.02   335.54   178.22  34.30  194.73  31.06  -16.51  46.28  
1 1 1 8   -6  23 o 1  200.54  35.63  1355.30   395.11   1355.30  395.11   0.00      0.00     200.54  35.63  ?       ?      0.00    35.63  
1 1 1 8   -6  24 o 2  92.21   17.38  261.67    88.64    198.96   131.04   314.56    120.35   79.68   25.41  99.78   21.63  -20.10  33.37  
1 1 1 8   -6  25 o 4  102.16  23.77  337.96    136.80   0.00     0.00     337.96    136.80   ?       ?      102.16  23.77  0.00    23.77  
1 1 1 8   -5  0  o 2  528.91  93.27  9792.82   2728.49  0.00     0.00     9792.82   2728.49  ?       ?      528.91  93.27  0.00    93.27  
1 1 1 8   -5  1  o 14 151.61  23.24  682.83    195.84   0.00     0.00     682.83    195.84   ?       ?      151.61  23.24  0.00    23.24  
1 1 1 8   -5  2  x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   -5  3  x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   -5  4  o 11 422.48  68.23  5731.69   1598.53  5731.69  1598.53  0.00      0.00     422.48  68.23  ?       ?      0.00    68.23  
1 1 1 8   -5  5  f 0  545.68  95.25  10318.03  2875.26  10318.03 2875.26  0.00      0.00     545.68  95.25  ?       ?      0.00    95.25  
1 1 1 8   -5  6  o 18 164.95  17.49  794.69    163.12   894.06   231.56   696.81    229.82   173.89  23.82  152.41  27.27  21.48   36.21  
1 1 1 8   -5  7  o 19 227.64  23.57  1520.64   303.50   1621.44  429.89   1420.46   428.56   232.79  33.10  216.90  35.66  15.89   48.65  
1 1 1 8   -5  8  o 5  150.93  16.26  665.30    138.66   660.96   197.50   669.51    194.71   148.99  23.90  150.09  23.36  -1.10   33.42  
1 1 1 8   -5  9  o 13 200.13  20.89  1174.56   236.42   1159.71  334.89   1189.32   333.82   196.49  30.69  199.19  30.13  -2.70   43.01  
1 1 1 8   -5  10 o 4  257.21  26.73  1957.21   388.99   2060.53  550.54   1854.21   549.68   260.24  37.97  245.73  40.37  14.50   55.42  
1 1 1 8   -5  11 o 17 271.93  28.42  2198.41   437.12   2188.47  618.63   2208.33   617.72   266.16  41.87  267.51  41.57  -1.36   59.00  
1 1 1 8   -5  12 o 7  144.69  16.33  613.70    133.28   611.45   189.49   615.91    187.49   142.77  23.97  143.39  23.60  -0.62   33.64  
1 1 1 8   -5  13 o 9  516.33  98.64  10105.09  2817.20  0.00     0.00     10105.09  2817.20  ?       ?      516.33  98.64  0.00    98.64  
1 1 1 8   -5  14 o 6  366.65  59.84  4346.29   1216.06  0.00     0.00     4346.29   1216.06  ?       ?      366.65  59.84  0.00    59.84  
1 1 1 8   -5  15 o 2  240.30  37.66  1765.94   502.46   0.00     0.00     1765.94   502.46   ?       ?      240.30  37.66  0.00    37.66  
1 1 1 8   -5  16 o 5  155.53  17.41  710.42    152.77   742.04   215.40   678.42    216.70   157.29  24.67  149.87  26.14  7.42    35.94  
1 1 1 8   -5  17 o 7  77.29   21.23  180.52    97.05    180.52   97.05    0.00      0.00     77.29   21.23  ?       ?      0.00    21.23  
1 1 1 8   -5  18 o 7  185.55  30.45  1061.83   313.07   1061.83  313.07   0.00      0.00     185.55  30.45  ?       ?      0.00    30.45  
1 1 1 8   -5  19 o 13 265.28  28.68  2145.43   429.89   2116.98  608.62   2173.75   607.29   254.64  43.18  258.65  42.36  -4.02   60.49  
1 1 1 8   -5  20 o 13 48.75   18.22  53.72     68.59    45.23    99.90    61.29     94.33    53.58   21.44  54.91   21.17  -1.33   30.13  
1 1 1 8   -5  21 o 13 174.49  19.65  913.45    193.37   1018.63  277.27   813.83    269.82   180.83  27.58  159.90  30.51  20.94   41.13  
1 1 1 8   -5  22 o 16 40.95   17.46  2.53      72.22    -31.13   120.34   21.48     90.28    48.77   21.62  47.98   19.92  0.79    29.40  
1 1 1 8   -5  23 o 14 173.44  20.07  913.37    196.17   1078.07  285.43   765.94    270.05   184.28  27.85  152.56  31.86  31.72   42.32  
1 1 1 8   -5  24 o 3  85.32   19.10  226.66    91.24    311.75   150.42   177.14    114.75   98.16   26.20  75.68   23.74  22.49   35.36  
1 1 1 8   -5  25 o 4  94.43   18.33  276.77    95.77    264.22   149.70   285.47    124.61   90.03   26.90  94.25   23.19  -4.22   35.52  
1 1 1 8   -5  26 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   -4  0  o 1  236.52  36.08  1694.71   474.47   0.00     0.00     1694.71   474.47   ?       ?      236.52  36.08  0.00    36.08  
1 1 1 8   -4  1  x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   -4  2  x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   -4  3  o 10 221.76  22.85  1444.05   286.70   1542.26  405.68   1346.06   405.24   226.91  32.03  210.96  34.67  15.95   47.20  
1 1 1 8   -4  4  o 9  64.41   14.37  124.36    51.77    124.36   51.77    0.00      0.00     64.41   14.37  ?       ?      0.00    14.37  
1 1 1 8   -4  5  o 7  428.24  69.72  5936.68   1655.10  5936.68  1655.10  0.00      0.00     428.24  69.72  ?       ?      0.00    69.72  
1 1 1 8   -4  6  o 4  444.60  72.67  6423.65   1790.83  6423.65  1790.83  0.00      0.00     444.60  72.67  ?       ?      0.00    72.67  
1 1 1 8   -4  7  o 9  552.61  60.06  9509.17   1874.56  9746.80  2651.07  9271.54   2650.99  535.91  89.31  519.89  92.20  16.02   128.37 
1 1 1 8   -4  8  o 17 240.06  24.83  1692.71   337.22   1764.84  477.39   1620.88   476.40   242.47  35.34  231.67  37.07  10.79   51.21  
1 1 1 8   -4  9  o 18 459.60  48.87  6438.04   1269.71  6479.29  1795.71  6396.80   1795.57  446.35  72.57  443.05  73.15  3.30    103.04 
1 1 1 8   -4  10 o 19 292.21  30.33  2529.63   501.41   2537.86  709.56   2521.42   708.64   287.79  44.37  286.80  44.48  0.99    62.83  
1 1 1 8   -4  11 o 1  340.66  35.74  3481.74   688.52   3547.52  973.97   3416.04   973.45   336.09  52.17  329.06  53.36  7.03    74.62  
1 1 1 8   -4  12 o 7  430.44  46.46  5726.19   1129.95  5990.19  1598.37  5462.44   1597.62  424.32  67.91  401.60  71.94  22.72   98.93  
1 1 1 8   -4  13 o 13 394.17  42.29  4770.01   942.08   4840.36  1332.43  4699.68   1332.18  383.06  62.76  376.47  63.92  6.59    89.59  
1 1 1 8   -4  14 o 9  321.08  51.48  3272.23   916.85   0.00     0.00     3272.23   916.85   ?       ?      321.08  51.48  0.00    51.48  
1 1 1 8   -4  15 o 18 244.25  38.23  1825.45   518.54   0.00     0.00     1825.45   518.54   ?       ?      244.25  38.23  0.00    38.23  
1 1 1 8   -4  16 o 8  263.17  27.70  2057.01   412.17   2134.31  583.81   1980.20   581.98   263.64  39.81  253.07  41.50  10.57   57.51  
1 1 1 8   -4  17 o 9  288.53  30.59  2498.53   498.98   2423.92  706.50   2572.79   704.82   276.86  46.07  286.34  44.31  -9.49   63.92  
1 1 1 8   -4  18 o 8  423.04  81.56  6832.28   1908.83  6832.28  1908.83  0.00      0.00     423.04  81.56  ?       ?      0.00    81.56  
1 1 1 8   -4  19 o 6  354.24  65.01  4542.82   1273.33  4542.82  1273.33  0.00      0.00     354.24  65.01  ?       ?      0.00    65.01  
1 1 1 8   -4  20 o 10 279.07  48.05  2618.63   742.06   2618.63  742.06   0.00      0.00     279.07  48.05  ?       ?      0.00    48.05  
1 1 1 8   -4  21 o 8  193.23  21.48  1122.42   234.27   1179.95  334.11   1066.78   328.59   193.66  31.11  183.28  32.42  10.38   44.93  
1 1 1 8   -4  22 o 6  113.52  16.80  387.17    106.20   431.54   158.25   350.81    143.26   117.51  24.26  105.77  24.13  11.73   34.22  
1 1 1 8   -4  23 o 6  59.19   19.44  101.51    76.31    25.97    128.08   143.09    95.01    56.05   23.54  68.90   21.60  -12.85  31.94  
1 1 1 8   -4  24 o 13 137.64  18.06  573.92    139.25   616.53   208.41   539.55    187.17   138.51  27.18  129.94  26.00  8.58    37.61  
1 1 1 8   -4  25 o 7  115.89  18.25  411.81    117.41   454.44   179.38   379.85    155.29   117.89  27.08  108.30  25.42  9.59    37.14  
1 1 1 8   -4  26 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   -4  27 o 15 163.49  30.72  916.62    277.77   0.00     0.00     916.62    277.77   ?       ?      163.49  30.72  0.00    30.72  
1 1 1 8   -3  0  o 10 351.92  37.09  3738.61   738.09   3840.29  1043.99  3636.99   1043.64  347.65  54.07  337.08  55.89  10.57   77.76  
1 1 1 8   -3  1  x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   -3  2  o 7  318.16  50.23  3178.59   887.02   0.00     0.00     3178.59   887.02   ?       ?      318.16  50.23  0.00    50.23  
1 1 1 8   -3  3  o 14 361.92  38.08  3951.38   779.38   3926.44  1102.17  3976.34   1102.26  351.00  56.63  353.52  56.19  -2.52   79.77  
1 1 1 8   -3  4  o 14 362.17  38.03  3947.88   778.83   3868.81  1101.22  4027.02   1101.65  348.96  56.93  356.93  55.57  -7.97   79.56  
1 1 1 8   -3  5  o 1  201.52  20.83  1190.45   237.51   1218.62  335.49   1162.15   336.28   201.78  29.86  196.71  30.79  5.07    42.89  
1 1 1 8   -3  6  o 4  122.73  19.41  446.54    132.20   446.54   132.20   0.00      0.00     122.73  19.41  ?       ?      0.00    19.41  
1 1 1 8   -3  7  o 5  685.48  146.06 20003.58  5571.81  20003.58 5571.81  0.00      0.00     685.48  146.06 ?       ?      0.00    146.06 
1 1 1 8   -3  8  o 10 361.06  37.61  3891.31   768.15   3847.23  1086.18  3935.41   1086.49  351.29  55.72  355.73  54.97  -4.44   78.27  
1 1 1 8   -3  9  o 15 510.74  54.84  8033.16   1582.65  8420.49  2238.23  7645.85   2238.19  505.06  79.85  476.97  84.85  28.09   116.51 
1 1 1 8   -3  10 o 1  447.34  47.37  6079.00   1198.03  6474.24  1694.21  5683.69   1694.34  449.62  67.74  417.12  73.44  32.50   99.91  
1 1 1 8   -3  11 o 1  206.49  21.43  1249.93   250.34   1232.51  353.44   1267.46   354.64   202.66  31.39  205.68  31.00  -3.02   44.12  
1 1 1 8   -3  12 o 7  450.94  48.58  6275.33   1237.86  6222.38  1750.43  6328.31   1750.77  430.98  73.38  435.32  72.61  -4.34   103.23 
1 1 1 8   -3  13 o 1  281.68  29.35  2362.36   467.58   2522.20  660.68   2201.96   661.85   286.32  41.40  265.61  45.01  20.71   61.15  
1 1 1 8   -3  14 o 18 48.45   16.25  63.80     53.31    -161.83  64.67    541.90    94.14    24.07   11.97  136.53  12.14  -112.46 17.05  
1 1 1 8   -3  15 o 19 223.83  35.03  1527.02   435.36   0.00     0.00     1527.02   435.36   ?       ?      223.83  35.03  0.00    35.03  
1 1 1 8   -3  16 o 14 124.68  23.30  467.80    160.63   0.00     0.00     467.80    160.63   ?       ?      124.68  23.30  0.00    23.30  
1 1 1 8   -3  17 o 14 171.06  18.83  859.68    181.86   905.80   256.64   813.16    257.74   173.77  26.57  163.96  28.41  9.81    38.90  
1 1 1 8   -3  18 o 12 411.45  45.08  5310.47   1047.29  5578.49  1481.23  5042.56   1480.94  403.33  66.27  378.99  70.67  24.34   96.88  
1 1 1 8   -3  19 o 4  165.92  27.35  839.94    251.42   839.94   251.42   0.00      0.00     165.92  27.35  ?       ?      0.00    27.35  
1 1 1 8   -3  20 o 13 232.46  38.03  1723.13   489.99   1723.13  489.99   0.00      0.00     232.46  38.03  ?       ?      0.00    38.03  
1 1 1 8   -3  21 o 13 217.33  35.93  1509.58   432.62   1509.58  432.62   0.00      0.00     217.33  35.93  ?       ?      0.00    35.93  
1 1 1 8   -3  22 o 18 157.34  18.11  739.41    160.62   763.50   227.08   715.29    227.22   156.79  26.15  151.21  27.17  5.58    37.71  
1 1 1 8   -3  23 o 9  61.67   18.28  114.89    69.36    145.05   97.15    83.52     99.07    69.47   21.85  58.81   21.91  10.65   30.94  
1 1 1 8   -3  24 o 11 139.77  17.39  588.62    136.55   619.53   195.32   559.07    190.98   140.04  25.22  132.49  26.04  7.55    36.25  
1 1 1 8   -3  25 o 9  87.04   23.64  241.84    121.19   241.84   121.19   0.00      0.00     87.04   23.64  ?       ?      0.00    23.64  
1 1 1 8   -3  26 o 8  121.81  25.56  482.87    173.06   0.00     0.00     482.87    173.06   ?       ?      121.81  25.56  0.00    25.56  
1 1 1 8   -3  27 o 2  221.69  26.09  1600.13   325.69   1667.96  461.38   1532.74   459.83   211.62  39.43  200.28  41.36  11.34   57.15  
1 1 1 8   -2  0  o 15 359.64  58.82  4204.14   1172.40  4204.14  1172.40  0.00      0.00     359.64  58.82  ?       ?      0.00    58.82  
1 1 1 8   -2  1  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   -2  2  f 0  286.19  44.82  2550.71   712.22   0.00     0.00     2550.71   712.22   ?       ?      286.19  44.82  0.00    44.82  
1 1 1 8   -2  3  o 4  120.79  18.78  433.08    125.98   0.00     0.00     433.08    125.98   ?       ?      120.79  18.78  0.00    18.78  
1 1 1 8   -2  4  o 11 357.87  37.85  3870.94   765.83   4207.33  1083.32  3534.90   1082.76  364.74  53.31  330.31  59.28  34.43   79.73  
1 1 1 8   -2  5  o 14 123.43  13.43  444.64    93.64    449.38   131.60   439.78    133.27   123.05  19.26  121.60  19.77  1.45    27.60  
1 1 1 8   -2  6  o 16 162.53  24.82  787.11    224.27   787.11   224.27   0.00      0.00     162.53  24.82  ?       ?      0.00    24.82  
1 1 1 8   -2  7  o 13 299.21  46.29  2754.06   769.46   2754.06  769.46   0.00      0.00     299.21  46.29  ?       ?      0.00    46.29  
1 1 1 8   -2  8  o 5  377.47  59.94  4500.09   1255.43  4500.09  1255.43  0.00      0.00     377.47  59.94  ?       ?      0.00    59.94  
1 1 1 8   -2  9  o 10 416.36  43.81  5229.02   1031.39  4984.77  1458.46  5473.37   1458.76  394.40  66.80  415.88  63.08  -21.48  91.87  
1 1 1 8   -2  10 o 7  306.95  31.77  2789.77   551.77   2778.51  780.14   2801.04   780.49   301.22  46.62  302.54  46.42  -1.32   65.79  
1 1 1 8   -2  11 o 15 267.39  27.67  2107.76   418.55   2008.34  591.35   2207.55   592.48   256.80  41.53  270.23  39.35  -13.44  57.21  
1 1 1 8   -2  12 o 5  405.25  42.73  4971.56   979.10   5360.79  1384.56  4582.21   1384.75  410.89  60.51  375.62  66.66  35.27   90.03  
1 1 1 8   -2  13 o 19 190.92  21.17  1072.25   228.17   -76.25   318.02   2290.69   327.56   80.12   35.35  280.07  20.52  -199.96 40.88  
1 1 1 8   -2  14 o 16 475.41  52.46  7140.59   1407.87  7175.55  1990.80  7105.60   1991.26  451.57  79.71  448.79  80.24  2.78    113.10 
1 1 1 8   -2  15 o 13 208.72  32.47  1323.37   376.36   1323.37  376.36   0.00      0.00     208.72  32.47  ?       ?      0.00    32.47  
1 1 1 8   -2  16 o 2  410.33  69.96  5689.86   1588.93  0.00     0.00     5689.86   1588.93  ?       ?      410.33  69.96  0.00    69.96  
1 1 1 8   -2  17 o 14 156.39  26.21  735.72    227.00   0.00     0.00     735.72    227.00   ?       ?      156.39  26.21  0.00    26.21  
1 1 1 8   -2  18 o 15 33.26   14.97  -29.82    59.97    -5.46    81.40    -58.75    88.69    42.80   18.39  38.93   17.79  3.87    25.59  
1 1 1 8   -2  19 o 18 90.60   15.62  244.86    78.33    211.97   109.93   278.76    111.63   83.53   22.45  95.79   20.89  -12.26  30.66  
1 1 1 8   -2  20 o 8  109.38  21.91  364.75    132.79   364.75   132.79   0.00      0.00     109.38  21.91  ?       ?      0.00    21.91  
1 1 1 8   -2  21 o 1  243.84  40.60  1932.73   548.29   1932.73  548.29   0.00      0.00     243.84  40.60  ?       ?      0.00    40.60  
1 1 1 8   -2  22 o 7  140.97  17.03  591.62    135.03   544.28   193.31   636.72    188.68   131.98  26.44  144.09  23.63  -12.11  35.46  
1 1 1 8   -2  23 o 17 214.25  23.95  1405.58   289.54   1264.23  409.25   1547.25   409.70   194.30  38.05  218.62  33.73  -24.32  50.85  
1 1 1 8   -2  24 f 0  87.48   17.34  234.55    84.01    248.56   120.72   221.39    116.97   88.69   23.38  83.87   23.41  4.81    33.09  
1 1 1 8   -2  25 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   -2  26 o 13 132.62  17.57  536.16    130.48   474.91   185.52   596.10    183.53   119.92  27.53  136.58  24.30  -16.66  36.72  
1 1 1 8   -2  27 o 9  218.45  25.50  1542.07   313.74   1680.89  445.42   1405.38   441.98   215.47  37.36  192.12  41.30  23.35   55.70  
1 1 1 8   -2  28 o 8  45.79   18.86  28.42     79.92    83.80    112.73   -27.56    113.34   59.29   23.06  46.48   20.77  12.82   31.04  
1 1 1 8   -1  0  x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   -1  1  o 9  323.34  51.89  3336.17   930.58   0.00     0.00     3336.17   930.58   ?       ?      323.34  51.89  0.00    51.89  
1 1 1 8   -1  2  o 7  357.58  58.64  4167.27   1162.02  0.00     0.00     4167.27   1162.02  ?       ?      357.58  58.64  0.00    58.64  
1 1 1 8   -1  3  o 17 99.62   15.82  294.14    87.43    0.00     0.00     294.14    87.43    ?       ?      99.62   15.82  0.00    15.82  
1 1 1 8   -1  4  o 3  359.77  38.13  3925.32   775.60   4058.45  1096.96  3792.23   1096.77  355.85  55.51  342.27  57.88  13.58   80.20  
1 1 1 8   -1  5  o 16 300.55  31.31  2696.27   532.30   2649.81  752.63   2742.76   752.94   291.45  46.55  297.07  45.61  -5.62   65.17  
1 1 1 8   -1  6  o 12 196.51  29.95  1160.38   327.23   1160.38  327.23   0.00      0.00     196.51  29.95  ?       ?      0.00    29.95  
1 1 1 8   -1  7  o 13 289.74  44.89  2584.84   722.49   2584.84  722.49   0.00      0.00     289.74  44.89  ?       ?      0.00    44.89  
1 1 1 8   -1  8  o 5  575.23  106.80 12192.62  3396.91  12192.62 3396.91  0.00      0.00     575.23  106.80 ?       ?      0.00    106.80 
1 1 1 8   -1  9  f 0  234.67  24.30  1617.84   322.56   1752.75  456.06   1482.78   456.29   241.91  33.76  221.14  37.27  20.77   50.28  
1 1 1 8   -1  10 o 19 514.92  55.44  8182.28   1613.00  8269.84  2281.12  8094.71   2281.14  497.75  82.73  491.45  83.86  6.31    117.80 
1 1 1 8   -1  11 o 1  343.29  35.72  3510.16   693.72   3619.57  981.05   3400.73   981.10   342.26  51.53  330.67  53.51  11.59   74.29  
1 1 1 8   -1  12 o 4  367.68  38.48  4052.04   800.22   4396.35  1131.56  3707.58   1131.80  375.85  53.99  341.65  59.89  34.20   80.63  
1 1 1 8   -1  13 o 19 182.58  19.87  978.03    204.93   -63.13   284.73   2097.14   295.19   76.37   33.59  268.28  19.30  -191.92 38.73  
1 1 1 8   -1  14 o 18 372.28  39.51  4212.24   831.50   4460.86  1175.88  3963.58   1175.96  372.89  56.72  348.32  61.03  24.57   83.32  
1 1 1 8   -1  15 o 9  118.81  20.47  422.32    134.55   422.32   134.55   0.00      0.00     118.81  20.47  ?       ?      0.00    20.47  
1 1 1 8   -1  16 o 4  291.79  30.74  2549.60   507.15   2474.50  716.55   2624.98   717.89   280.49  46.10  289.84  44.57  -9.35   64.12  
1 1 1 8   -1  17 o 5  177.28  28.71  948.14    282.19   0.00     0.00     948.14    282.19   ?       ?      177.28  28.71  0.00    28.71  
1 1 1 8   -1  18 o 16 124.06  23.35  464.05    160.21   0.00     0.00     464.05    160.21   ?       ?      124.06  23.35  0.00    23.35  
1 1 1 8   -1  19 o 15 148.55  16.94  649.16    141.87   715.96   199.97   581.48    201.30   154.55  23.26  138.16  26.34  16.39   35.14  
1 1 1 8   -1  20 o 11 104.53  21.77  333.09    126.36   333.09   126.36   0.00      0.00     104.53  21.77  ?       ?      0.00    21.77  
1 1 1 8   -1  21 o 11 163.06  27.24  819.37    245.97   819.37   245.97   0.00      0.00     163.06  27.24  ?       ?      0.00    27.24  
1 1 1 8   -1  22 o 5  149.87  26.29  695.93    217.91   695.93   217.91   0.00      0.00     149.87  26.29  ?       ?      0.00    26.29  
1 1 1 8   -1  23 o 14 90.74   23.31  257.53    122.05   257.53   122.05   0.00      0.00     90.74   23.31  ?       ?      0.00    23.31  
1 1 1 8   -1  24 o 11 185.48  32.60  1127.46   334.47   1127.46  334.47   0.00      0.00     185.48  32.60  ?       ?      0.00    32.60  
1 1 1 8   -1  25 o 8  220.40  40.40  1713.72   492.34   0.00     0.00     1713.72   492.34   ?       ?      220.40  40.40  0.00    40.40  
1 1 1 8   -1  26 o 2  106.83  25.48  371.92    154.08   371.92   154.08   0.00      0.00     106.83  25.48  ?       ?      0.00    25.48  
1 1 1 8   -1  27 o 3  69.50   19.99  152.41    84.03    48.26    124.53   239.50    113.87   56.92   23.50  85.96   22.73  -29.05  32.69  
1 1 1 8   -1  28 o 2  49.50   21.90  -15.15    122.76   -15.15   122.76   0.00      0.00     49.50   21.90  ?       ?      0.00    21.90  
1 1 1 8   0   0  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   0   1  o 1  198.04  30.16  1184.81   332.11   0.00     0.00     1184.81   332.11   ?       ?      198.04  30.16  0.00    30.16  
1 1 1 8   0   2  o 5  338.00  54.77  3680.18   1026.37  0.00     0.00     3680.18   1026.37  ?       ?      338.00  54.77  0.00    54.77  
1 1 1 8   0   3  o 8  311.11  49.52  3063.63   854.86   0.00     0.00     3063.63   854.86   ?       ?      311.11  49.52  0.00    49.52  
1 1 1 8   0   4  o 15 241.43  25.12  1725.04   343.12   1878.17  485.79   1572.58   484.71   248.70  34.99  225.80  38.79  22.90   52.24  
1 1 1 8   0   5  f 0  461.06  50.26  6644.44   1308.69  6557.93  1850.66  6730.97   1850.86  435.97  76.75  442.97  75.49  -7.00   107.65 
1 1 1 8   0   6  o 17 466.10  50.69  6770.42   1334.49  6775.97  1887.19  6764.88   1887.32  445.32  76.58  444.88  76.67  0.45    108.36 
1 1 1 8   0   7  o 5  395.88  64.76  5095.30   1421.00  5095.30  1421.00  0.00      0.00     395.88  64.76  ?       ?      0.00    64.76  
1 1 1 8   0   8  o 5  410.68  67.04  5472.15   1525.93  5472.15  1525.93  0.00      0.00     410.68  67.04  ?       ?      0.00    67.04  
1 1 1 8   0   9  o 9  576.76  106.26 12162.93  3388.71  12162.93 3388.71  0.00      0.00     576.76  106.26 ?       ?      0.00    106.26 
1 1 1 8   0   10 o 14 519.79  56.16  8364.72   1649.14  8433.14  2332.19  8296.30   2332.28  500.78  84.10  495.88  84.99  4.89    119.57 
1 1 1 8   0   11 o 12 232.26  24.01  1583.84   315.54   1623.82  446.07   1543.79   446.41   232.55  34.45  226.33  35.53  6.22    49.49  
1 1 1 8   0   12 o 3  289.92  29.31  2483.15   481.20   -123.66  677.35   5139.48   683.75   117.02  51.62  418.34  28.64  -301.33 59.03  
1 1 1 8   0   13 o 3  156.55  16.65  716.26    147.32   708.78   205.68   724.15    211.12   154.26  24.01  155.87  24.39  -1.61   34.23  
1 1 1 8   0   14 o 12 306.80  32.11  2814.11   557.20   2825.50  787.85   2802.70   788.16   300.81  47.17  299.44  47.43  1.36    66.89  
1 1 1 8   0   15 o 1  320.67  33.87  3099.93   614.16   3193.80  868.38   3005.99   868.74   317.56  49.23  306.82  51.12  10.73   70.97  
1 1 1 8   0   16 o 5  169.30  18.40  842.29    175.98   904.02   249.30   780.99    248.44   173.63  25.79  160.54  27.97  13.09   38.05  
1 1 1 8   0   17 o 14 541.65  112.69 12160.84  3389.78  0.00     0.00     12160.84  3389.78  ?       ?      541.65  112.69 0.00    112.69 
1 1 1 8   0   18 o 5  281.28  44.73  2474.47   698.11   0.00     0.00     2474.47   698.11   ?       ?      281.28  44.73  0.00    44.73  
1 1 1 8   0   19 o 16 267.78  28.32  2146.05   428.82   2214.03  606.84   2078.25   606.05   266.38  41.00  257.17  42.54  9.21    59.08  
1 1 1 8   0   20 o 10 485.18  57.63  7991.84   1573.70  8439.65  2225.80  7544.24   2225.29  455.49  88.31  419.99  94.58  35.50   129.40 
1 1 1 8   0   21 o 12 147.86  17.61  648.83    146.57   661.79   208.90   636.27    205.69   146.78  25.73  143.80  25.87  2.97    36.48  
1 1 1 8   0   22 o 15 211.51  35.37  1433.83   414.27   1433.83  414.27   0.00      0.00     211.51  35.37  ?       ?      0.00    35.37  
1 1 1 8   0   23 o 5  135.16  25.57  571.05    191.15   571.05   191.15   0.00      0.00     135.16  25.57  ?       ?      0.00    25.57  
1 1 1 8   0   24 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   0   25 o 17 329.09  40.96  3810.64   757.16   3826.90  1071.92  3794.44   1069.67  290.33  65.84  288.75  65.98  1.58    93.21  
1 1 1 8   0   26 o 12 70.81   19.48  157.07    81.63    169.64   116.28   144.86    114.61   74.02   23.97  69.76   23.83  4.26    33.80  
1 1 1 8   0   27 o 4  96.29   26.34  308.73    149.76   308.73   149.76   0.00      0.00     96.29   26.34  ?       ?      0.00    26.34  
1 1 1 8   0   28 o 12 97.34   27.06  324.43    156.64   324.43   156.64   0.00      0.00     97.34   27.06  ?       ?      0.00    27.06  
1 1 1 8   1   0  o 19 370.91  61.23  4513.23   1258.20  0.00     0.00     4513.23   1258.20  ?       ?      370.91  61.23  0.00    61.23  
1 1 1 8   1   1  o 17 213.41  32.61  1381.49   386.88   0.00     0.00     1381.49   386.88   ?       ?      213.41  32.61  0.00    32.61  
1 1 1 8   1   2  x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   1   3  o 19 130.16  13.78  494.71    101.39   532.02   144.35   458.37    142.45   133.99  19.32  123.87  20.77  10.11   28.37  
1 1 1 8   1   4  o 8  569.84  66.06  10724.14  2121.15  11429.73 2999.87  10018.66  2999.66  547.56  99.08  500.28  107.64 47.28   146.30 
1 1 1 8   1   5  o 6  197.73  20.47  1148.52   228.94   1123.94  323.19   1173.27   324.36   193.05  30.15  197.52  29.51  -4.47   42.19  
1 1 1 8   1   6  o 5  370.90  60.35  4448.65   1240.83  4448.65  1240.83  0.00      0.00     370.90  60.35  ?       ?      0.00    60.35  
1 1 1 8   1   7  o 15 374.98  60.61  4517.95   1260.17  4517.95  1260.17  0.00      0.00     374.98  60.61  ?       ?      0.00    60.61  
1 1 1 8   1   8  o 18 618.22  125.23 15407.63  4292.02  15407.63 4292.02  0.00      0.00     618.22  125.23 ?       ?      0.00    125.23 
1 1 1 8   1   9  o 11 524.03  56.88  8552.23   1683.68  8364.39  2380.92  8740.13   2381.24  493.90  87.16  507.25  84.76  -13.34  121.58 
1 1 1 8   1   10 o 15 392.33  41.18  4628.32   913.65   4676.89  1291.99  4579.73   1292.21  384.82  60.48  380.28  61.27  4.53    86.09  
1 1 1 8   1   11 o 10 136.75  14.78  545.51    114.20   638.67   159.69   447.99    163.38   147.33  19.35  122.08  24.17  25.26   30.96  
1 1 1 8   1   12 o 10 270.65  27.03  2157.63   414.42   -38.41   582.67   4405.68   589.53   112.05  48.69  387.78  26.64  -275.72 55.50  
1 1 1 8   1   13 f 0  372.30  39.19  4173.92   824.96   4275.54  1166.47  4072.23   1166.86  367.70  57.11  357.70  58.87  10.00   82.02  
1 1 1 8   1   14 o 15 479.80  52.64  7225.99   1426.08  7414.46  2016.75  7037.50   2016.82  463.46  78.61  448.76  81.28  14.70   113.07 
1 1 1 8   1   15 o 12 299.03  31.42  2681.72   531.34   2598.07  751.31   2765.41   751.54   286.87  47.27  297.07  45.52  -10.20  65.62  
1 1 1 8   1   16 o 11 182.33  19.55  978.46    201.41   963.72   284.82   993.20    284.86   178.44  28.78  181.36  28.28  -2.92   40.35  
1 1 1 8   1   17 o 6  215.48  33.90  1415.87   405.50   0.00     0.00     1415.87   405.50   ?       ?      215.48  33.90  0.00    33.90  
1 1 1 8   1   18 o 3  321.76  52.14  3313.82   930.21   0.00     0.00     3313.82   930.21   ?       ?      321.76  52.14  0.00    52.14  
1 1 1 8   1   19 o 10 88.86   22.17  240.01    112.70   0.00     0.00     240.01    112.70   ?       ?      88.86   22.17  0.00    22.17  
1 1 1 8   1   20 o 11 68.90   17.91  143.63    71.50    127.24   99.70    160.99    102.60   67.17   22.22  73.63   22.33  -6.47   31.51  
1 1 1 8   1   21 f 0  295.12  32.19  2695.84   536.54   2848.86  759.56   2543.46   757.99   292.41  46.83  273.30  50.16  19.11   68.62  
1 1 1 8   1   22 o 17 260.51  45.01  2288.02   648.83   2288.02  648.83   0.00      0.00     260.51  45.01  ?       ?      0.00    45.01  
1 1 1 8   1   23 o 4  123.30  24.55  474.55    167.67   474.55   167.67   0.00      0.00     123.30  24.55  ?       ?      0.00    24.55  
1 1 1 8   1   24 x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   1   25 o 7  88.72   18.42  243.94    90.74    200.24   134.35   280.60    123.04   80.17   25.75  93.87   23.01  -13.70  34.54  
1 1 1 8   1   26 o 11 101.53  18.30  319.09    102.74   348.73   150.21   293.02    140.84   103.32  25.49  94.75   25.38  8.57    35.97  
1 1 1 8   1   27 o 14 70.34   20.62  156.50    88.65    151.57   135.29   160.21    117.35   71.72   25.79  71.94   24.12  -0.21   35.31  
1 1 1 8   1   28 o 16 240.11  75.91  4157.98   1171.28  4157.98  1171.28  0.00      0.00     240.11  75.91  ?       ?      0.00    75.91  
1 1 1 8   1   29 o 9  104.92  20.14  355.17    116.90   408.20   175.47   312.86    156.76   107.51  28.12  94.52   27.34  12.99   39.22  
1 1 1 8   2   0  o 15 264.48  40.92  2152.94   601.22   0.00     0.00     2152.94   601.22   ?       ?      264.48  40.92  0.00    40.92  
1 1 1 8   2   1  o 13 208.44  31.73  1312.91   367.66   0.00     0.00     1312.91   367.66   ?       ?      208.44  31.73  0.00    31.73  
1 1 1 8   2   2  o 18 269.12  28.16  2152.62   428.55   2351.24  606.66   1954.79   605.45   277.17  39.22  250.44  43.70  26.72   58.72  
1 1 1 8   2   3  f 0  320.48  33.63  3083.02   609.48   3150.51  862.13   3015.59   861.73   316.62  49.01  308.95  50.32  7.67    70.24  
1 1 1 8   2   4  o 8  705.66  88.49  17841.28  3506.21  17332.63 4958.42  18349.98  4958.65  598.25  145.74 626.11  141.32 -27.87  203.01 
1 1 1 8   2   5  o 1  326.12  34.09  3189.35   628.84   3127.72  889.06   3251.06   889.59   315.03  50.89  321.91  49.74  -6.88   71.16  
1 1 1 8   2   6  o 14 225.90  34.56  1545.20   433.96   1545.20  433.96   0.00      0.00     225.90  34.56  ?       ?      0.00    34.56  
1 1 1 8   2   7  o 3  502.76  88.99  8879.59   2474.36  8879.59  2474.36  0.00      0.00     502.76  88.99  ?       ?      0.00    88.99  
1 1 1 8   2   8  f 0  310.75  48.33  2986.37   834.15   2986.37  834.15   0.00      0.00     310.75  48.33  ?       ?      0.00    48.33  
1 1 1 8   2   9  o 17 545.39  59.73  9323.46   1839.47  9547.46  2601.33  9099.42   2601.48  526.62  89.23  511.26  92.02  15.36   128.18 
1 1 1 8   2   10 o 2  338.24  35.10  3406.45   671.63   3280.71  949.35   3532.43   950.31   324.82  52.72  338.32  50.47  -13.50  72.98  
1 1 1 8   2   11 o 18 189.96  19.22  1054.69   206.68   -112.54  287.87   2296.50   296.92   74.03   33.09  281.19  18.50  -207.17 37.91  
1 1 1 8   2   12 o 10 254.50  26.28  1907.98   378.38   1852.32  533.82   1964.19   536.42   247.04  38.93  254.91  37.80  -7.87   54.26  
1 1 1 8   2   13 o 13 140.04  15.33  572.98    121.22   601.44   170.36   543.80    172.51   142.35  21.52  134.88  23.11  7.47    31.58  
1 1 1 8   2   14 o 10 505.18  56.14  8112.74   1600.75  8259.08  2263.74  7966.39   2263.87  481.96  84.92  471.05  86.92  10.91   121.52 
1 1 1 8   2   15 o 1  285.78  30.07  2444.54   485.99   2520.81  686.90   2368.10   687.68   284.22  43.48  274.45  45.22  9.77    62.73  
1 1 1 8   2   16 o 7  522.57  60.28  8993.67   1775.12  9270.92  2510.40  8716.43   2510.41  491.74  92.32  471.48  96.02  20.26   133.20 
1 1 1 8   2   17 o 9  234.36  36.91  1687.68   480.16   0.00     0.00     1687.68   480.16   ?       ?      234.36  36.91  0.00    36.91  
1 1 1 8   2   18 o 19 236.94  37.49  1727.55   493.03   0.00     0.00     1727.55   493.03   ?       ?      236.94  37.49  0.00    37.49  
1 1 1 8   2   19 o 2  185.58  30.16  1048.34   310.31   0.00     0.00     1048.34   310.31   ?       ?      185.58  30.16  0.00    30.16  
1 1 1 8   2   20 o 16 446.38  51.62  6575.17   1298.35  6658.70  1836.28  6491.67   1836.02  414.49  80.07  407.36  81.36  7.13    114.16 
1 1 1 8   2   21 o 16 214.59  23.29  1384.38   282.37   1317.53  399.82   1450.89   398.83   203.49  35.52  214.90  33.41  -11.41  48.77  
1 1 1 8   2   22 o 17 75.99   22.99  174.76    108.80   174.76   108.80   0.00      0.00     75.99   22.99  ?       ?      0.00    22.99  
1 1 1 8   2   23 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   2   24 o 6  163.04  29.54  857.93    266.26   857.93   266.26   0.00      0.00     163.04  29.54  ?       ?      0.00    29.54  
1 1 1 8   2   25 o 8  157.37  19.15  755.75    169.49   748.97   240.00   762.50    239.38   151.44  28.66  153.06  28.28  -1.62   40.26  
1 1 1 8   2   26 o 14 77.16   19.37  187.70    85.67    185.37   130.71   189.45    113.43   77.05   25.44  77.25   23.49  -0.19   34.63  
1 1 1 8   2   27 o 6  214.44  44.10  1808.41   524.72   1808.41  524.72   0.00      0.00     214.44  44.10  ?       ?      0.00    44.10  
1 1 1 8   2   28 o 12 142.39  19.66  639.59    156.42   564.88   226.14   708.11    216.58   125.20  31.50  144.48  27.11  -19.28  41.56  
1 1 1 8   2   29 o 14 53.77   20.83  70.02     91.68    109.09   141.27   41.59     120.50   65.00   25.66  54.39   22.83  10.61   34.35  
1 1 1 8   3   0  o 10 405.68  66.91  5395.99   1504.03  0.00     0.00     5395.99   1504.03  ?       ?      405.68  66.91  0.00    66.91  
1 1 1 8   3   1  o 1  264.62  27.67  2074.61   414.20   2277.74  586.04   1871.87   585.50   273.71  38.35  245.91  43.04  27.80   57.65  
1 1 1 8   3   2  o 8  312.60  32.88  2920.87   581.14   3173.55  822.09   2668.48   821.62   320.20  46.05  290.77  51.08  29.43   68.77  
1 1 1 8   3   3  o 6  478.49  52.02  7145.23   1405.95  7015.65  1988.20  7274.84   1988.42  451.46  79.62  461.55  77.81  -10.09  111.33 
1 1 1 8   3   4  o 7  73.34   10.72  158.14    43.80    136.42   62.06    179.70    61.84    67.36   16.24  77.68   14.40  -10.32  21.70  
1 1 1 8   3   5  f 0  139.76  21.78  580.88    169.08   580.88   169.08   0.00      0.00     139.76  21.78  ?       ?      0.00    21.78  
1 1 1 8   3   6  o 17 472.34  81.05  7601.88   2118.62  7601.88  2118.62  0.00      0.00     472.34  81.05  ?       ?      0.00    81.05  
1 1 1 8   3   7  o 10 209.29  31.79  1315.24   369.95   1315.24  369.95   0.00      0.00     209.29  31.79  ?       ?      0.00    31.79  
1 1 1 8   3   8  o 4  404.42  42.60  4940.25   974.19   4923.80  1377.59  4956.71   1377.84  392.60  63.27  394.09  63.03  -1.48   89.31  
1 1 1 8   3   9  o 18 251.81  25.95  1866.20   369.77   1836.62  522.61   1895.85   523.25   246.33  38.19  250.57  37.53  -4.23   53.55  
1 1 1 8   3   10 o 6  134.64  14.59  528.80    111.00   653.28   155.16   398.31    158.86   149.18  18.51  114.87  24.82  34.31   30.96  
1 1 1 8   3   11 o 8  117.28  13.52  401.62    89.37    -4.60    119.57   915.64    134.50   52.26   22.37  177.76  13.28  -125.50 26.02  
1 1 1 8   3   12 o 5  422.25  44.79  5418.22   1069.25  5454.83  1511.87  5381.58   1512.44  410.87  66.36  407.66  66.95  3.21    94.27  
1 1 1 8   3   13 o 5  70.08   13.26  146.27    51.37    159.10   67.93    129.13    78.53    72.74   16.63  66.16   19.41  6.58    25.56  
1 1 1 8   3   14 o 10 283.33  29.71  2394.87   476.09   2479.09  672.79   2310.41   673.79   282.87  42.77  272.00  44.70  10.87   61.87  
1 1 1 8   3   15 o 15 132.48  15.33  514.84    114.46   482.19   159.21   549.77    164.67   126.56  22.75  135.55  21.91  -8.99   31.58  
1 1 1 8   3   16 o 11 207.55  22.00  1272.87   258.14   1256.31  364.34   1289.57   365.80   202.93  32.36  205.77  32.01  -2.85   45.52  
1 1 1 8   3   17 f 0  183.13  29.39  1015.41   298.58   0.00     0.00     1015.41   298.58   ?       ?      183.13  29.39  0.00    29.39  
1 1 1 8   3   18 o 11 384.63  65.75  5003.07   1399.57  0.00     0.00     5003.07   1399.57  ?       ?      384.63  65.75  0.00    65.75  
1 1 1 8   3   19 o 7  301.96  49.45  2943.09   827.49   0.00     0.00     2943.09   827.49   ?       ?      301.96  49.45  0.00    49.45  
1 1 1 8   3   20 o 19 68.42   18.53  141.50    74.58    121.40   105.51   161.57    105.43   66.67   22.86  73.83   22.69  -7.16   32.21  
1 1 1 8   3   21 o 7  263.71  28.73  2133.37   427.89   2154.85  604.68   2111.83   605.59   255.74  42.69  252.67  43.31  3.07    60.81  
1 1 1 8   3   22 o 4  306.99  57.69  3487.35   979.34   3487.35  979.34   0.00      0.00     306.99  57.69  ?       ?      0.00    57.69  
1 1 1 8   3   23 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   3   24 o 4  227.01  41.26  1807.61   517.90   1807.61  517.90   0.00      0.00     227.01  41.26  ?       ?      0.00    41.26  
1 1 1 8   3   25 o 12 140.89  18.41  605.82    145.32   533.47   207.62   675.32    203.48   126.74  29.14  145.30  25.31  -18.56  38.60  
1 1 1 8   3   26 o 1  224.09  26.30  1619.68   331.90   1704.04  471.39   1536.74   467.39   216.25  39.42  202.67  41.57  13.58   57.29  
1 1 1 8   3   27 o 11 54.28   20.10  76.53     83.09    47.79    120.55   102.55    114.69   55.97   23.11  62.41   23.51  -6.45   32.97  
1 1 1 8   3   28 o 18 113.60  19.45  410.68    122.27   429.14   178.69   394.43    167.68   110.72  28.08  106.56  27.29  4.16    39.16  
1 1 1 8   3   29 o 15 81.51   23.68  225.73    117.36   242.47   153.76   202.36    181.64   83.30   27.60  78.49   29.58  4.81    40.46  
1 1 1 8   4   0  o 1  67.19   10.55  133.02    39.36    136.68   53.08    128.56    58.65    67.60   14.13  65.43   15.80  2.16    21.20  
1 1 1 8   4   1  o 5  294.24  30.36  2565.59   505.41   2490.89  714.54   2640.39   714.97   284.61  45.25  293.80  43.72  -9.20   62.92  
1 1 1 8   4   2  o 9  245.17  25.16  1769.72   349.05   1691.44  493.46   1848.10   493.80   236.02  37.69  247.55  35.79  -11.53  51.97  
1 1 1 8   4   3  o 15 153.33  23.48  699.15    200.10   699.15   200.10   0.00      0.00     153.33  23.48  ?       ?      0.00    23.48  
1 1 1 8   4   4  o 1  241.45  36.81  1764.10   494.15   1764.10  494.15   0.00      0.00     241.45  36.81  ?       ?      0.00    36.81  
1 1 1 8   4   5  o 2  324.80  50.69  3275.93   914.37   3275.93  914.37   0.00      0.00     324.80  50.69  ?       ?      0.00    50.69  
1 1 1 8   4   6  o 9  439.62  72.41  6327.16   1763.86  6327.16  1763.86  0.00      0.00     439.62  72.41  ?       ?      0.00    72.41  
1 1 1 8   4   7  o 15 437.59  46.29  5818.76   1145.27  5704.28  1619.47  5933.28   1619.84  419.32  69.72  428.93  68.05  -9.61   97.43  
1 1 1 8   4   8  f 0  633.84  71.63  12950.94  2560.79  13521.95 3621.51  12379.93  3621.51  609.45  107.44 575.34  113.68 34.11   156.42 
1 1 1 8   4   9  o 14 313.75  32.63  2920.41   579.18   3027.30  818.95   2813.44   819.22   314.36  46.81  301.99  48.93  12.37   67.71  
1 1 1 8   4   10 o 12 427.77  40.72  5491.68   987.90   -148.22  1394.54  11173.18  1399.67  165.44  73.47  611.76  40.08  -446.32 83.69  
1 1 1 8   4   11 o 8  218.71  22.42  1403.46   277.57   1266.82  391.13   1542.10   393.98   204.63  34.52  227.26  31.01  -22.62  46.40  
1 1 1 8   4   12 o 7  279.20  28.97  2310.05   457.55   2283.94  646.65   2336.23   647.49   272.78  42.69  276.15  42.18  -3.37   60.02  
1 1 1 8   4   13 o 3  266.87  27.92  2114.87   421.48   2223.67  596.05   2006.06   596.06   269.33  39.74  254.53  42.28  14.80   58.02  
1 1 1 8   4   14 o 19 308.18  32.37  2855.44   564.11   2721.20  797.24   2990.03   798.30   292.48  49.23  308.38  46.54  -15.90  67.75  
1 1 1 8   4   15 o 18 428.46  47.30  5780.00   1144.06  6087.41  1617.82  5472.48   1618.08  419.84  69.56  392.94  74.46  26.89   101.89 
1 1 1 8   4   16 o 4  220.26  23.33  1436.58   290.52   1355.60  408.69   1519.30   413.05   209.93  35.15  223.24  33.24  -13.31  48.38  
1 1 1 8   4   17 o 15 139.28  25.24  586.29    194.35   0.00     0.00     586.29    194.35   ?       ?      139.28  25.24  0.00    25.24  
1 1 1 8   4   18 o 5  292.00  47.33  2710.75   766.25   0.00     0.00     2710.75   766.25   ?       ?      292.00  47.33  0.00    47.33  
1 1 1 8   4   19 o 5  145.74  26.09  646.63    210.28   0.00     0.00     646.63    210.28   ?       ?      145.74  26.09  0.00    26.09  
1 1 1 8   4   20 o 15 226.48  24.53  1542.28   313.85   1592.39  443.39   1491.95   444.32   224.89  35.52  216.73  37.04  8.15    51.32  
1 1 1 8   4   21 o 5  412.60  49.85  5846.71   1156.86  5966.51  1636.17  5726.94   1635.92  374.97  78.53  363.80  80.47  11.17   112.44 
1 1 1 8   4   22 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   4   23 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   4   24 o 17 100.68  24.86  325.47    142.84   325.47   142.84   0.00      0.00     100.68  24.86  ?       ?      0.00    24.86  
1 1 1 8   4   25 o 1  85.93   18.81  231.00    90.23    285.63   132.21   183.39    123.43   93.90   24.33  76.60   24.69  17.30   34.66  
1 1 1 8   4   26 o 3  94.67   18.67  280.88    97.87    294.20   143.20   269.20    134.07   94.23   25.75  90.44   24.99  3.79    35.88  
1 1 1 8   4   27 o 6  58.97   20.81  100.23    87.75    43.61    126.75   152.35    121.60   56.29   23.51  70.38   24.53  -14.09  33.97  
1 1 1 8   4   28 o 12 107.75  19.73  372.97    117.52   385.90   170.51   361.26    162.21   104.51  27.90  101.47  27.27  3.04    39.01  
1 1 1 8   4   29 o 2  49.40   21.17  20.32     107.17   47.51    135.94   -24.33    174.21   56.90   24.09  56.16   25.37  0.74    34.99  
1 1 1 8   5   0  o 2  468.34  77.13  7182.48   2001.58  7182.48  2001.58  0.00      0.00     468.34  77.13  ?       ?      0.00    77.13  
1 1 1 8   5   1  o 17 211.71  32.03  1341.77   377.07   1341.77  377.07   0.00      0.00     211.71  32.03  ?       ?      0.00    32.03  
1 1 1 8   5   2  o 3  380.02  60.15  4549.07   1268.66  4549.07  1268.66  0.00      0.00     380.02  60.15  ?       ?      0.00    60.15  
1 1 1 8   5   3  o 10 619.88  117.63 14477.19  4032.68  14477.19 4032.68  0.00      0.00     619.88  117.63 ?       ?      0.00    117.63 
1 1 1 8   5   4  o 4  145.82  22.64  631.24    183.39   631.24   183.39   0.00      0.00     145.82  22.64  ?       ?      0.00    22.64  
1 1 1 8   5   5  o 13 279.76  28.95  2310.30   458.19   2350.24  647.84   2270.33   648.12   278.17  41.87  272.99  42.76  5.17    59.84  
1 1 1 8   5   6  f 0  116.84  13.01  398.12    85.77    388.82   120.54   407.65    122.06   114.45  19.01  117.30  18.76  -2.85   26.71  
1 1 1 8   5   7  o 18 368.92  38.34  4068.61   800.16   3945.33  1131.33  4192.00   1131.85  354.77  57.52  366.94  55.46  -12.17  79.90  
1 1 1 8   5   8  o 12 582.18  64.45  10704.57  2118.08  11134.71 2995.33  10274.38  2995.50  565.12  95.75  537.39  100.80 27.72   139.03 
1 1 1 8   5   9  o 3  727.31  85.78  17818.21  3512.80  17970.52 4967.69  17665.87  4968.01  664.18  134.90 656.11  136.36 8.07    191.81 
1 1 1 8   5   10 o 9  276.71  25.93  2251.59   407.11   3.24     572.23   4555.99   579.31   112.89  48.65  394.50  25.72  -281.61 55.03  
1 1 1 8   5   11 o 9  527.61  58.07  8777.35   1729.67  8757.03  2445.93  8797.67   2446.32  499.52  88.54  500.95  88.29  -1.43   125.04 
1 1 1 8   5   12 o 7  436.20  47.34  5890.80   1166.56  6122.71  1649.78  5658.90   1649.75  427.96  69.54  408.21  73.08  19.74   100.88 
1 1 1 8   5   13 o 11 126.53  14.91  469.38    106.24   508.97   151.17   430.74    149.35   130.62  20.86  119.57  22.59  11.05   30.75  
1 1 1 8   5   14 o 19 358.34  38.30  3930.84   775.63   3851.65  1096.65  4010.10   1097.16  341.75  57.97  349.89  56.55  -8.14   80.98  
1 1 1 8   5   15 o 2  369.55  39.57  4200.19   826.48   3976.89  1168.36  4423.84   1169.27  344.35  61.35  366.69  57.43  -22.34  84.04  
1 1 1 8   5   16 o 4  157.21  26.13  745.45    227.52   0.00     0.00     745.45    227.52   ?       ?      157.21  26.13  0.00    26.13  
1 1 1 8   5   17 o 13 177.79  29.08  958.28    286.57   0.00     0.00     958.28    286.57   ?       ?      177.79  29.08  0.00    29.08  
1 1 1 8   5   18 o 18 389.83  68.95  5316.28   1486.55  0.00     0.00     5316.28   1486.55  ?       ?      389.83  68.95  0.00    68.95  
1 1 1 8   5   19 o 14 273.44  29.43  2268.82   454.70   2350.10  642.07   2187.04   644.02   270.72  42.73  259.66  44.82  11.05   61.93  
1 1 1 8   5   20 o 3  382.10  44.00  4785.28   947.57   4840.30  1339.54  4730.18   1340.59  356.15  68.00  350.57  69.07  5.58    96.93  
1 1 1 8   5   21 o 2  183.64  20.67  1013.16   214.14   916.13   298.60   1115.90   307.27   169.54  31.85  188.87  29.29  -19.33  43.27  
1 1 1 8   5   22 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   5   23 o 13 151.66  27.75  735.72    232.71   735.72   232.71   0.00      0.00     151.66  27.75  ?       ?      0.00    27.75  
1 1 1 8   5   24 o 18 110.01  25.42  391.66    157.30   391.66   157.30   0.00      0.00     110.01  25.42  ?       ?      0.00    25.42  
1 1 1 8   5   25 o 6  208.84  24.42  1385.68   287.23   1429.13  405.04   1341.72   407.37   201.11  36.42  193.01  38.12  8.11    52.72  
1 1 1 8   5   26 o 11 57.85   20.23  95.94     82.74    32.51    119.43   154.50    114.75   54.06   22.72  70.66   23.85  -16.60  32.94  
1 1 1 8   5   27 o 4  54.81   20.56  77.81     87.52    83.19    124.18   72.50     123.35   60.43   23.99  58.97   23.74  1.46    33.75  
1 1 1 8   5   28 o 4  91.96   23.08  286.02    121.64   246.46   155.74   347.91    194.79   83.86   27.78  96.71   31.00  -12.85  41.62  
1 1 1 8   6   0  o 8  299.19  45.83  2728.37   762.10   2728.37  762.10   0.00      0.00     299.19  45.83  ?       ?      0.00    45.83  
1 1 1 8   6   1  o 19 269.34  27.71  2135.14   422.37   2123.61  596.99   2146.71   597.65   264.98  40.53  266.52  40.32  -1.53   57.17  
1 1 1 8   6   2  o 3  460.20  48.87  6429.81   1271.27  6655.51  1797.67  6204.03   1798.02  455.23  71.11  437.19  74.30  18.04   102.85 
1 1 1 8   6   3  o 17 371.60  38.66  4123.18   812.56   4064.47  1148.92  4181.94   1149.35  360.88  57.38  366.62  56.42  -5.74   80.47  
1 1 1 8   6   4  f 0  412.23  43.28  5114.66   1009.04  5131.81  1426.79  5097.49   1427.20  402.52  63.88  400.99  64.16  1.53    90.54  
1 1 1 8   6   5  o 15 67.19   11.71  133.72    43.53    125.72   58.03    144.01    65.84    64.73   15.76  69.26   16.75  -4.52   23.00  
1 1 1 8   6   6  f 0  217.85  22.53  1391.28   277.73   1401.80  392.87   1380.76   392.67   216.28  32.66  214.55  32.93  1.74    46.38  
1 1 1 8   6   7  o 11 583.12  64.54  10749.26  2124.39  11007.88 3004.22  10490.59  3004.46  560.25  96.91  543.59  99.96  16.66   139.23 
1 1 1 8   6   8  o 8  591.06  65.73  11123.66  2192.48  11151.98 3100.47  11095.33  3100.80  557.86  100.51 556.04  100.85 1.82    142.39 
1 1 1 8   6   9  o 11 189.47  17.53  1046.94   188.48   -153.78  261.40   2347.07   272.01   67.49   30.72  284.48  16.73  -216.99 34.98  
1 1 1 8   6   10 o 16 134.60  14.36  528.83    109.21   415.44   150.40   655.28    158.84   117.46  23.13  149.18  18.98  -31.72  29.92  
1 1 1 8   6   11 o 5  360.46  38.01  3936.02   774.72   3809.06  1095.06  4063.24   1096.17  343.52  57.56  356.41  55.37  -12.90  79.87  
1 1 1 8   6   12 o 8  392.94  42.52  4758.38   943.77   4954.89  1334.49  4561.74   1334.89  386.92  62.19  368.37  65.53  18.55   90.34  
1 1 1 8   6   13 o 6  488.30  55.70  7725.46   1533.41  8186.50  2168.52  7264.37   2168.61  472.66  82.94  436.84  89.49  35.81   122.02 
1 1 1 8   6   14 o 9  120.93  15.12  429.94    102.65   390.65   146.77   467.56    143.61   113.47  23.31  124.99  20.74  -11.52  31.20  
1 1 1 8   6   15 o 3  257.11  40.74  2055.90   581.33   0.00     0.00     2055.90   581.33   ?       ?      257.11  40.74  0.00    40.74  
1 1 1 8   6   16 o 13 194.42  31.32  1150.21   337.67   0.00     0.00     1150.21   337.67   ?       ?      194.42  31.32  0.00    31.32  
1 1 1 8   6   17 o 3  179.93  29.66  985.16    295.74   0.00     0.00     985.16    295.74   ?       ?      179.93  29.66  0.00    29.66  
1 1 1 8   6   18 o 6  158.14  27.10  762.94    237.15   0.00     0.00     762.94    237.15   ?       ?      158.14  27.10  0.00    27.10  
1 1 1 8   6   19 o 4  388.45  44.28  4910.57   969.72   4829.93  1370.87  4991.32   1371.90  357.01  69.39  364.82  68.01  -7.81   97.16  
1 1 1 8   6   20 o 5  255.25  27.84  2002.46   401.36   1948.15  567.32   2056.87   567.90   241.84  42.41  249.67  41.05  -7.84   59.02  
1 1 1 8   6   21 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   6   22 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   6   23 o 9  242.03  46.00  2164.54   615.70   2164.54  615.70   0.00      0.00     242.03  46.00  ?       ?      0.00    46.00  
1 1 1 8   6   24 o 1  209.00  24.47  1382.17   288.04   1402.79  404.76   1361.02   409.97   199.91  36.62  195.60  37.88  4.31    52.69  
1 1 1 8   6   25 o 11 176.65  21.19  976.93    210.63   836.67   297.17   1118.53   298.59   153.21  34.61  182.58  29.49  -29.37  45.47  
1 1 1 8   6   26 o 13 110.97  18.86  387.19    115.84   387.27   163.46   387.10    164.18   106.72  26.74  106.64  26.84  0.08    37.89  
1 1 1 8   6   27 o 17 122.61  19.44  478.78    132.28   560.96   186.49   395.56    187.65   128.07  26.25  104.64  29.80  23.43   39.71  
1 1 1 8   6   28 o 11 179.94  24.32  1094.37   244.81   1076.26  350.71   1111.58   341.88   160.83  38.50  166.06  36.83  -5.23   53.28  
1 1 1 8   7   0  o 18 402.33  42.18  4872.00   959.78   4782.60  1356.85  4961.52   1357.82  388.04  63.08  396.14  61.72  -8.10   88.25  
1 1 1 8   7   1  o 16 434.10  45.89  5706.56   1126.30  5769.11  1592.38  5643.95   1593.26  424.24  67.65  418.93  68.62  5.32    96.37  
1 1 1 8   7   2  o 6  277.75  28.47  2275.26   447.60   2068.67  631.81   2483.44   634.22   259.99  43.89  286.93  39.55  -26.95  59.09  
1 1 1 8   7   3  o 12 266.79  27.54  2097.66   415.74   2114.40  587.73   2080.89   588.15   264.18  40.00  261.90  40.42  2.28    56.87  
1 1 1 8   7   4  o 6  129.42  14.06  488.52    102.77   445.17   143.12   534.67    147.66   122.23  21.16  134.52  19.71  -12.29  28.92  
1 1 1 8   7   5  o 16 66.37   12.23  130.86    44.89    156.86   60.50    99.02     66.95    72.41   15.05  58.60   18.09  13.81   23.53  
1 1 1 8   7   6  f 0  421.34  44.80  5392.93   1067.03  5549.59  1508.90  5236.22   1509.11  415.24  65.47  401.56  67.88  13.68   94.31  
1 1 1 8   7   7  o 4  469.74  50.64  6814.61   1344.13  6838.39  1900.65  6790.81   1901.12  451.97  75.95  450.07  76.30  1.90    107.66 
1 1 1 8   7   8  o 3  603.56  69.33  11968.88  2358.65  11985.19 3335.39  11952.56  3335.87  557.76  108.07 556.70  108.28 1.06    152.99 
1 1 1 8   7   9  o 2  268.48  24.25  2122.61   369.69   4.47     518.63   4310.62   527.11   107.03  46.22  383.40  24.07  -276.38 52.11  
1 1 1 8   7   10 o 1  389.30  41.93  4652.03   922.32   4797.26  1304.04  4506.65   1304.67  381.99  61.56  368.16  64.06  13.83   88.84  
1 1 1 8   7   11 o 17 230.28  24.44  1571.70   318.18   1700.65  449.96   1442.72   450.00   236.27  34.16  215.96  37.67  20.32   50.85  
1 1 1 8   7   12 o 3  266.55  27.98  2122.00   421.74   2097.49  595.87   2146.60   596.99   259.24  41.43  262.56  40.94  -3.31   58.25  
1 1 1 8   7   13 o 13 333.69  35.50  3383.75   669.53   3365.30  946.21   3402.25   947.52   322.45  52.95  324.43  52.68  -1.98   74.69  
1 1 1 8   7   14 o 8  452.81  83.61  7501.37   2093.21  0.00     0.00     7501.37   2093.21  ?       ?      452.81  83.61  0.00    83.61  
1 1 1 8   7   15 o 12 173.85  28.63  915.56    275.77   0.00     0.00     915.56    275.77   ?       ?      173.85  28.63  0.00    28.63  
1 1 1 8   7   16 o 12 312.21  51.17  3150.94   885.41   0.00     0.00     3150.94   885.41   ?       ?      312.21  51.17  0.00    51.17  
1 1 1 8   7   17 f 0  305.93  33.08  2858.64   571.69   2972.07  808.76   2745.35   808.23   302.41  48.20  288.77  50.60  13.63   69.88  
1 1 1 8   7   18 o 10 172.12  19.52  880.60    189.49   934.47   268.69   827.29    267.28   174.49  27.75  163.26  29.61  11.23   40.58  
1 1 1 8   7   19 o 3  160.43  18.77  767.90    169.63   820.89   241.14   715.98    238.68   162.99  26.70  151.25  28.54  11.74   39.08  
1 1 1 8   7   20 o 6  157.05  18.77  739.12    165.91   823.74   236.09   656.55    233.21   162.93  26.12  143.78  29.25  19.16   39.22  
1 1 1 8   7   21 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   7   22 o 4  318.27  88.75  6013.74   1682.22  6013.74  1682.22  0.00      0.00     318.27  88.75  ?       ?      0.00    88.75  
1 1 1 8   7   23 o 19 100.67  24.39  327.49    139.46   327.49   139.46   0.00      0.00     100.67  24.39  ?       ?      0.00    24.39  
1 1 1 8   7   24 o 11 146.79  19.22  665.88    158.06   740.40   218.36   583.86    229.07   150.62  26.21  130.23  31.08  20.39   40.65  
1 1 1 8   7   25 o 16 56.34   20.31  87.50     83.98    118.25   111.90   47.85     127.07   64.46   23.41  56.96   23.65  7.49    33.28  
1 1 1 8   7   26 o 19 120.91  19.73  464.93    132.23   511.42   182.46   413.50    191.91   122.26  26.74  107.48  29.98  14.78   40.17  
1 1 1 8   7   27 o 1  77.88   22.89  204.63    109.13   140.94   138.99   306.99    176.21   68.45   25.86  91.69   29.49  -23.24  39.23  
1 1 1 8   7   28 o 5  60.33   23.32  101.16    114.67   82.46    174.65   115.32    152.02   64.23   27.25  65.47   26.36  -1.24   37.92  
1 1 1 8   8   0  o 17 508.61  55.98  8139.24   1607.43  8331.10  2273.14  7947.35   2273.35  489.88  83.84  475.74  86.42  14.14   120.41 
1 1 1 8   8   1  o 3  129.24  14.52  488.13    105.84   560.84   147.01   409.91    152.49   137.83  19.09  116.59  23.59  21.23   30.35  
1 1 1 8   8   2  o 16 271.23  28.11  2178.94   431.41   2118.46  608.92   2239.90   611.29   262.67  41.78  270.71  40.58  -8.04   58.25  
1 1 1 8   8   3  o 11 326.76  34.23  3195.22   632.56   3247.53  893.92   3142.76   895.22   322.40  49.91  316.51  51.00  5.89    71.36  
1 1 1 8   8   4  o 10 442.91  47.58  6047.15   1190.88  5950.39  1683.71  6144.01   1684.62  421.66  72.15  429.72  70.75  -8.06   101.05 
1 1 1 8   8   5  o 3  190.65  20.06  1066.89   216.31   1160.13  304.87   972.36    306.97   197.04  27.72  179.20  30.96  17.84   41.55  
1 1 1 8   8   6  o 15 165.34  17.50  800.63    163.55   797.82   229.51   803.52    233.12   163.33  25.30  163.84  25.62  -0.51   36.01  
1 1 1 8   8   7  o 16 256.88  26.86  1957.88   390.25   2017.41  551.20   1898.04   552.61   256.54  38.62  248.07  40.18  8.48    55.73  
1 1 1 8   8   8  o 19 192.93  18.26  1089.96   199.87   -150.22  277.88   2419.40   287.70   69.90   31.76  288.30  17.47  -218.40 36.25  
1 1 1 8   8   9  o 16 242.11  23.98  1733.30   328.90   957.81   462.49   2526.83   467.84   173.05  45.83  291.23  28.34  -118.18 53.89  
1 1 1 8   8   10 o 10 371.09  39.62  4223.89   830.97   4087.62  1174.56  4360.44   1175.78  350.93  60.49  364.46  58.15  -13.53  83.91  
1 1 1 8   8   11 o 7  447.34  49.66  6330.74   1253.76  6489.46  1772.86  6171.93   1773.30  429.89  74.54  416.54  76.99  13.35   107.16 
1 1 1 8   8   12 o 12 355.01  58.98  4145.11   1159.80  0.00     0.00     4145.11   1159.80  ?       ?      355.01  58.98  0.00    58.98  
1 1 1 8   8   13 o 8  415.85  73.01  6010.26   1679.40  0.00     0.00     6010.26   1679.40  ?       ?      415.85  73.01  0.00    73.01  
1 1 1 8   8   14 o 12 264.66  42.24  2188.72   620.17   0.00     0.00     2188.72   620.17   ?       ?      264.66  42.24  0.00    42.24  
1 1 1 8   8   15 f 0  201.06  32.30  1237.49   360.21   0.00     0.00     1237.49   360.21   ?       ?      201.06  32.30  0.00    32.30  
1 1 1 8   8   16 o 3  327.71  35.38  3309.91   655.02   3253.28  925.59   3366.73   927.08   311.86  53.63  318.19  52.59  -6.33   75.12  
1 1 1 8   8   17 o 9  179.18  19.86  954.94    200.84   988.85   282.26   920.16    285.83   179.29  28.37  172.16  30.01  7.13    41.30  
1 1 1 8   8   18 o 3  182.63  20.21  997.79    208.37   990.02   293.08   1005.73   296.29   177.91  29.74  179.30  29.83  -1.39   42.13  
1 1 1 8   8   19 o 10 114.34  22.71  404.27    143.79   404.27   143.79   0.00      0.00     114.34  22.71  ?       ?      0.00    22.71  
1 1 1 8   8   20 o 18 199.38  33.99  1296.10   375.09   1296.10  375.09   0.00      0.00     199.38  33.99  ?       ?      0.00    33.99  
1 1 1 8   8   21 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   8   22 o 18 230.57  44.26  1972.80   564.51   1972.80  564.51   0.00      0.00     230.57  44.26  ?       ?      0.00    44.26  
1 1 1 8   8   23 o 9  99.66   19.47  311.58    107.41   471.69   156.55   169.16    147.64   121.26  23.34  75.39   26.96  45.87   35.65  
1 1 1 8   8   24 o 19 128.00  18.50  508.75    132.02   530.81   188.76   487.62    184.72   125.85  26.94  120.20  27.38  5.64    38.41  
1 1 1 8   8   25 o 3  114.72  19.19  416.22    121.93   395.70   172.89   436.54    171.99   106.74  27.91  112.87  26.92  -6.13   38.78  
1 1 1 8   8   26 o 15 143.84  20.40  665.39    163.74   524.07   227.73   816.63    235.59   117.61  32.60  153.03  27.84  -35.42  42.87  
1 1 1 8   8   27 o 17 62.95   24.98  105.88    134.54   3.55     209.02   178.27    175.81   61.92   27.90  74.28   28.83  -12.35  40.12  
1 1 1 8   9   0  o 6  610.19  71.13  12418.83  2444.81  12297.98 3457.28  12539.71  3457.70  553.83  112.58 561.40  111.22 -7.57   158.26 
1 1 1 8   9   1  o 3  231.77  24.36  1586.56   319.27   1651.93  451.83   1521.38   451.21   233.28  34.80  223.10  36.49  10.17   50.43  
1 1 1 8   9   2  o 15 282.55  29.64  2378.85   473.61   2437.75  669.32   2319.77   670.25   280.69  42.90  273.06  44.27  7.63    61.65  
1 1 1 8   9   3  o 7  314.02  32.78  2957.10   582.31   2745.37  822.11   3170.27   824.92   294.17  50.50  318.77  46.44  -24.60  68.61  
1 1 1 8   9   4  o 7  367.80  39.10  4117.34   812.97   4077.42  1148.96  4157.36   1150.47  354.20  58.55  358.13  57.94  -3.94   82.37  
1 1 1 8   9   5  o 6  327.16  34.66  3227.84   640.99   3332.60  905.54   3122.64   907.46   324.34  50.26  312.52  52.44  11.82   72.63  
1 1 1 8   9   6  o 17 360.26  38.33  3950.43   780.53   3915.96  1102.39  3985.09   1105.28  347.14  57.32  350.55  56.87  -3.41   80.74  
1 1 1 8   9   7  o 17 252.60  26.51  1895.30   378.74   1935.80  534.57   1854.47   536.68   250.92  38.32  245.00  39.50  5.92    55.04  
1 1 1 8   9   8  o 16 163.88  26.56  808.46    241.32   0.00     0.00     808.46    241.32   ?       ?      163.88  26.56  0.00    26.56  
1 1 1 8   9   9  o 3  180.36  28.70  981.99    287.22   0.00     0.00     981.99    287.22   ?       ?      180.36  28.70  0.00    28.70  
1 1 1 8   9   10 o 3  459.75  83.73  7628.83   2128.45  0.00     0.00     7628.83   2128.45  ?       ?      459.75  83.73  0.00    83.73  
1 1 1 8   9   11 o 16 176.29  28.87  939.91    282.07   0.00     0.00     939.91    282.07   ?       ?      176.29  28.87  0.00    28.87  
1 1 1 8   9   12 o 17 164.28  27.71  816.38    252.04   0.00     0.00     816.38    252.04   ?       ?      164.28  27.71  0.00    27.71  
1 1 1 8   9   13 o 8  325.57  34.76  3219.77   639.67   3252.79  903.85   3186.63   905.42   317.52  51.34  313.71  52.10  3.80    73.15  
1 1 1 8   9   14 o 17 235.30  25.03  1651.84   332.89   1631.57  469.23   1672.39   472.34   228.93  36.96  231.96  36.69  -3.03   52.08  
1 1 1 8   9   15 o 5  218.29  23.62  1424.89   291.31   1462.44  411.96   1387.34   411.98   216.64  34.26  210.37  35.37  6.27    49.24  
1 1 1 8   9   16 o 3  202.83  22.15  1232.40   253.68   1239.50  358.47   1225.27   359.04   198.85  32.53  197.54  32.81  1.31    46.20  
1 1 1 8   9   17 f 0  130.33  16.92  506.20    123.61   566.99   174.47   444.92    175.15   136.05  23.17  119.20  26.30  16.85   35.05  
1 1 1 8   9   18 o 2  165.86  28.56  865.13    262.14   865.13   262.14   0.00      0.00     165.86  28.56  ?       ?      0.00    28.56  
1 1 1 8   9   19 o 18 214.11  36.94  1523.19   437.60   1523.19  437.60   0.00      0.00     214.11  36.94  ?       ?      0.00    36.94  
1 1 1 8   9   20 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   9   21 f 0  92.10   17.87  262.07    91.05    343.19   120.82   155.46    138.50   104.59  20.86  73.38   26.12  31.21   33.43  
1 1 1 8   9   22 o 9  213.04  24.97  1448.93   299.59   1497.92  422.33   1399.31   425.06   204.92  37.27  195.91  39.16  9.01    54.07  
1 1 1 8   9   23 o 4  124.34  18.06  478.58    125.16   504.48   170.69   448.47    184.05   123.99  24.85  114.79  28.15  9.20    37.55  
1 1 1 8   9   24 o 19 51.74   19.68  65.18     80.80    128.10   105.22   -25.26    126.15   65.19   22.81  49.13   21.94  16.06   31.65  
1 1 1 8   9   25 o 19 100.65  19.36  325.83    107.82   314.84   143.80   339.93    162.94   95.41   25.69  97.97   27.73  -2.56   37.80  
1 1 1 8   9   26 o 9  70.74   23.06  167.55    107.54   210.66   129.05   69.54     194.58   77.90   25.25  65.41   28.28  12.49   37.91  
1 1 1 8   9   27 o 6  54.69   24.05  18.32     146.04   25.04    219.56   12.98     195.58   63.75   28.67  60.44   27.13  3.31    39.47  
1 1 1 8   10  0  o 16 672.32  183.34 26097.56  7269.68  0.00     0.00     26097.56  7269.68  ?       ?      672.32  183.34 0.00    183.34 
1 1 1 8   10  1  o 17 152.94  26.40  702.88    223.39   0.00     0.00     702.88    223.39   ?       ?      152.94  26.40  0.00    26.40  
1 1 1 8   10  2  o 19 339.34  54.38  3650.67   1023.56  0.00     0.00     3650.67   1023.56  ?       ?      339.34  54.38  0.00    54.38  
1 1 1 8   10  3  o 3  321.07  51.16  3245.57   911.40   0.00     0.00     3245.57   911.40   ?       ?      321.07  51.16  0.00    51.16  
1 1 1 8   10  4  o 7  534.76  102.87 10916.29  3043.25  0.00     0.00     10916.29  3043.25  ?       ?      534.76  102.87 0.00    102.87 
1 1 1 8   10  5  o 12 153.82  26.78  712.78    227.92   0.00     0.00     712.78    227.92   ?       ?      153.82  26.78  0.00    26.78  
1 1 1 8   10  6  o 19 271.90  43.14  2290.27   650.82   0.00     0.00     2290.27   650.82   ?       ?      271.90  43.14  0.00    43.14  
1 1 1 8   10  7  o 6  336.06  54.47  3614.05   1014.96  0.00     0.00     3614.05   1014.96  ?       ?      336.06  54.47  0.00    54.47  
1 1 1 8   10  8  o 12 450.36  80.22  7153.55   1997.88  0.00     0.00     7153.55   1997.88  ?       ?      450.36  80.22  0.00    80.22  
1 1 1 8   10  9  o 11 258.38  27.01  1984.22   394.72   1878.42  557.18   2090.81   559.27   246.06  40.88  260.92  38.49  -14.86  56.15  
1 1 1 8   10  10 f 0  255.13  26.78  1936.93   386.39   1865.89  544.82   2008.82   548.08   245.18  40.09  255.24  38.61  -10.06  55.66  
1 1 1 8   10  11 o 6  254.71  26.86  1935.73   386.79   1908.42  545.96   1963.25   548.06   247.53  39.77  251.36  39.26  -3.84   55.89  
1 1 1 8   10  12 o 8  210.36  22.67  1314.56   269.49   1386.29  379.19   1241.35   383.09   212.68  32.05  200.02  34.62  12.67   47.18  
1 1 1 8   10  13 o 2  241.74  25.95  1755.94   354.44   1798.28  500.03   1713.19   502.48   239.05  37.68  232.51  39.03  6.55    54.25  
1 1 1 8   10  14 o 11 259.54  27.98  2048.92   410.31   2066.98  579.15   2030.72   581.38   252.77  41.34  250.07  41.98  2.70    58.92  
1 1 1 8   10  15 o 2  163.69  27.36  829.36    248.06   829.36   248.06   0.00      0.00     163.69  27.36  ?       ?      0.00    27.36  
1 1 1 8   10  16 o 5  230.86  38.91  1749.38   497.35   1749.38  497.35   0.00      0.00     230.86  38.91  ?       ?      0.00    38.91  
1 1 1 8   10  17 o 12 308.66  60.50  3689.78   1033.71  3689.78  1033.71  0.00      0.00     308.66  60.50  ?       ?      0.00    60.50  
1 1 1 8   10  18 o 7  109.35  23.93  376.38    146.02   376.38   146.02   0.00      0.00     109.35  23.93  ?       ?      0.00    23.93  
1 1 1 8   10  19 o 6  58.31   22.34  76.82     104.59   76.82    104.59   0.00      0.00     58.31   22.34  ?       ?      0.00    22.34  
1 1 1 8   10  20 o 16 74.11   24.64  167.67    122.52   0.00     0.00     167.67    122.52   ?       ?      74.11   24.64  0.00    24.64  
1 1 1 8   10  21 o 5  140.96  18.85  612.36    148.68   673.82   207.30   547.25    213.37   143.78  26.08  126.98  29.79  16.79   39.59  
1 1 1 8   10  22 o 4  74.43   20.47  177.17    90.17    142.97   122.18   218.09    133.63   69.28   24.55  81.65   25.62  -12.37  35.48  
1 1 1 8   10  23 o 5  183.73  22.58  1084.83   233.16   1093.93  326.69   1075.38   332.87   173.60  34.00  170.87  35.11  2.73    48.87  
1 1 1 8   10  24 o 3  56.34   20.57  89.19     86.51    111.32   113.46   58.49     133.68   62.66   23.43  58.26   24.22  4.40    33.70  
1 1 1 8   10  25 o 12 59.65   20.84  109.72    87.87    53.35    112.43   198.17    140.84   53.98   22.31  76.02   26.40  -22.04  34.56  
1 1 1 8   10  26 o 6  50.64   22.05  17.11     119.95   2.25     149.50   43.94     200.96   53.80   23.96  63.21   27.99  -9.41   36.85  
1 1 1 8   11  0  o 13 287.06  30.29  2463.99   491.65   2479.36  693.87   2448.49   696.73   281.83  44.35  279.76  44.90  2.06    63.11  
1 1 1 8   11  1  o 6  105.86  16.58  332.19    97.47    369.59   133.02   288.82    143.24   110.77  21.70  97.48   25.36  13.29   33.37  
1 1 1 8   11  2  o 10 219.21  23.37  1419.03   289.54   1424.61  406.74   1413.30   412.26   216.44  33.84  215.33  34.52  1.11    48.34  
1 1 1 8   11  3  o 6  219.08  23.23  1417.06   287.69   1392.27  407.03   1441.81   406.67   213.73  34.34  217.83  33.60  -4.10   48.04  
1 1 1 8   11  4  o 7  267.04  28.12  2122.79   424.64   2132.33  600.07   2113.22   601.00   262.52  41.17  261.19  41.47  1.33    58.43  
1 1 1 8   11  5  o 4  242.57  25.63  1745.53   351.52   1744.27  495.86   1746.80   498.40   238.27  37.49  238.37  37.67  -0.10   53.15  
1 1 1 8   11  6  o 12 184.94  20.29  1007.90   211.84   1059.82  298.52   955.24    300.65   187.40  28.66  177.10  30.68  10.29   41.98  
1 1 1 8   11  7  o 5  146.99  17.55  636.22    145.19   1.50     189.91   1529.01   225.23   65.94   28.21  228.84  17.27  -162.90 33.08  
1 1 1 8   11  8  o 16 162.85  18.40  781.57    169.02   803.68   230.87   756.04    248.11   163.31  25.46  157.39  28.51  5.92    38.22  
1 1 1 8   11  9  o 4  594.05  76.45  12926.85  2546.72  12880.27 3600.94  12973.46  3602.28  505.34  124.86 508.23  124.47 -2.89   176.31 
1 1 1 8   11  10 o 13 294.65  31.85  2647.66   530.23   2784.07  748.19   2510.03   751.53   293.49  45.91  276.19  49.20  17.30   67.30  
1 1 1 8   11  11 o 17 228.27  36.86  1643.78   466.58   1643.78  466.58   0.00      0.00     228.27  36.86  ?       ?      0.00    36.86  
1 1 1 8   11  12 o 13 128.99  22.69  506.53    161.87   506.53   161.87   0.00      0.00     128.99  22.69  ?       ?      0.00    22.69  
1 1 1 8   11  13 o 12 95.22   20.83  278.21    110.71   278.21   110.71   0.00      0.00     95.22   20.83  ?       ?      0.00    20.83  
1 1 1 8   11  14 o 6  53.53   19.82  67.81     80.75    67.81    80.75    0.00      0.00     53.53   19.82  ?       ?      0.00    19.82  
1 1 1 8   11  15 o 14 134.65  23.83  560.18    177.45   560.18   177.45   0.00      0.00     134.65  23.83  ?       ?      0.00    23.83  
1 1 1 8   11  16 o 7  135.97  24.67  577.06    185.46   577.06   185.46   0.00      0.00     135.97  24.67  ?       ?      0.00    24.67  
1 1 1 8   11  17 o 15 254.09  28.81  2046.74   412.83   2096.46  582.63   1996.60   585.05   243.89  43.20  236.28  44.77  7.61    62.21  
1 1 1 8   11  18 o 9  112.87  16.56  385.98    104.10   390.48   142.81   380.88    152.08   111.01  23.16  108.92  24.87  2.08    33.98  
1 1 1 8   11  19 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   11  20 o 9  73.81   19.20  172.19    82.14    181.18   106.05   158.70    129.87   75.42   22.67  72.58   25.34  2.84    34.00  
1 1 1 8   11  21 o 10 273.20  34.75  2651.85   532.67   2671.02  751.12   2632.45   755.51   240.48  55.53  236.98  56.36  3.49    79.12  
1 1 1 8   11  22 o 18 113.51  18.40  404.79    115.79   394.66   161.59   415.47    166.00   107.53  26.38  110.29  26.54  -2.76   37.42  
1 1 1 8   11  23 o 18 107.35  19.59  370.74    116.30   415.77   158.02   317.50    171.80   109.98  25.52  94.04   28.97  15.94   38.61  
1 1 1 8   11  24 o 10 85.97   21.49  249.03    105.76   228.27   145.89   272.02    153.54   80.41   26.89  86.74   27.49  -6.34   38.46  
1 1 1 8   11  25 o 18 47.28   20.64  8.29      105.82   -26.83   124.47   99.85     200.96   47.35   21.41  67.53   28.96  -20.18  36.02  
1 1 1 8   12  0  o 1  191.51  30.69  1125.18   325.98   1125.18  325.98   0.00      0.00     191.51  30.69  ?       ?      0.00    30.69  
1 1 1 8   12  1  o 4  271.86  44.19  2365.16   665.97   2365.16  665.97   0.00      0.00     271.86  44.19  ?       ?      0.00    44.19  
1 1 1 8   12  2  o 17 168.91  27.86  869.49    260.72   869.49   260.72   0.00      0.00     168.91  27.86  ?       ?      0.00    27.86  
1 1 1 8   12  3  o 15 154.63  26.13  726.74    223.68   726.74   223.68   0.00      0.00     154.63  26.13  ?       ?      0.00    26.13  
1 1 1 8   12  4  o 4  279.84  45.86  2528.49   711.25   2528.49  711.25   0.00      0.00     279.84  45.86  ?       ?      0.00    45.86  
1 1 1 8   12  5  o 16 143.47  24.46  624.45    194.21   624.45   194.21   0.00      0.00     143.47  24.46  ?       ?      0.00    24.46  
1 1 1 8   12  6  o 2  132.54  22.17  530.37    162.74   530.37   162.74   0.00      0.00     132.54  22.17  ?       ?      0.00    22.17  
1 1 1 8   12  7  o 3  28.99   14.58  -332.73   109.34   -332.73  109.34   0.00      0.00     28.99   14.58  ?       ?      0.00    14.58  
1 1 1 8   12  8  o 13 407.11  85.36  6919.28   1931.12  6919.28  1931.12  0.00      0.00     407.11  85.36  ?       ?      0.00    85.36  
1 1 1 8   12  9  o 2  61.07   21.08  100.94    89.74    100.94   89.74    0.00      0.00     61.07   21.08  ?       ?      0.00    21.08  
1 1 1 8   12  10 o 5  71.62   19.99  155.79    85.30    155.79   85.30    0.00      0.00     71.62   19.99  ?       ?      0.00    19.99  
1 1 1 8   12  11 o 13 148.11  25.09  674.64    205.75   674.64   205.75   0.00      0.00     148.11  25.09  ?       ?      0.00    25.09  
1 1 1 8   12  12 o 10 153.66  17.70  703.25    153.29   726.35   212.61   678.25    221.20   153.58  24.97  147.43  27.14  6.14    36.88  
1 1 1 8   12  13 o 18 118.67  15.62  419.60    103.86   416.36   140.41   423.50    154.32   116.32  21.83  116.67  23.85  -0.35   32.33  
1 1 1 8   12  14 o 19 79.79   16.42  194.10    72.72    142.41   97.93    257.60    108.56   69.08   21.96  91.02   21.18  -21.93  30.51  
1 1 1 8   12  15 o 8  265.74  30.40  2256.17   455.45   2370.76  642.16   2140.18   646.06   258.10  44.97  241.39  48.31  16.72   66.00  
1 1 1 8   12  16 o 8  101.95  16.32  315.22    92.27    352.68   123.41   267.74    138.93   106.31  20.97  91.38   25.51  14.94   33.02  
1 1 1 8   12  17 o 4  156.83  18.67  749.96    164.82   724.83   227.32   777.81    239.34   149.29  27.54  154.46  28.02  -5.17   39.29  
1 1 1 8   12  18 o 1  73.02   22.11  167.81    100.60   167.81   100.60   0.00      0.00     73.02   22.11  ?       ?      0.00    22.11  
1 1 1 8   12  19 o 3  124.43  26.83  515.42    186.00   0.00     0.00     515.42    186.00   ?       ?      124.43  26.83  0.00    26.83  
1 1 1 8   12  20 o 1  152.92  19.41  730.42    166.55   733.47   229.22   727.00    242.41   147.08  28.17  144.82  30.14  2.26    41.26  
1 1 1 8   12  21 o 9  79.49   19.84  204.57    90.22    216.97   117.49   186.75    140.82   80.71   23.76  75.97   26.40  4.74    35.52  
1 1 1 8   12  22 o 1  162.44  20.91  852.28    190.44   842.15   262.31   863.58    276.92   151.81  31.14  152.07  32.69  -0.26   45.15  
1 1 1 8   12  23 o 9  99.29   19.89  324.34    109.39   241.24   144.35   436.44    167.66   82.20   26.71  110.27  26.76  -28.06  37.81  
1 1 1 8   12  24 o 14 111.70  20.20  413.69    124.77   422.78   166.25   401.97    188.80   107.36  27.00  101.64  30.17  5.72    40.49  
1 1 1 8   13  0  o 17 187.96  20.51  1051.75   217.69   996.78   305.05   1108.78   310.75   179.06  30.79  189.62  29.51  -10.56  42.64  
1 1 1 8   13  1  o 6  154.74  17.80  709.35    155.27   672.63   215.89   748.70    223.47   147.98  26.38  156.53  25.76  -8.55   36.88  
1 1 1 8   13  2  o 3  165.06  18.60  808.11    173.14   734.07   242.34   885.31    247.45   153.97  28.46  170.34  26.14  -16.36  38.64  
1 1 1 8   13  3  o 9  167.30  19.00  831.32    179.21   816.83   248.30   847.08    258.91   162.93  27.53  165.71  28.23  -2.78   39.43  
1 1 1 8   13  4  o 1  189.04  20.58  1065.01   219.74   962.63   307.29   1172.15   314.36   175.33  31.70  195.13  28.94  -19.80  42.92  
1 1 1 8   13  5  o 14 188.53  20.78  1060.95   221.20   1021.34  307.67   1103.33   318.25   181.01  30.71  188.39  30.47  -7.38   43.26  
1 1 1 8   13  6  o 12 54.71   15.28  89.82     49.81    0.57     55.46    462.05    113.26   35.93   15.31  124.77  16.19  -88.84  22.28  
1 1 1 8   13  7  o 12 104.30  15.61  324.36    90.59    349.40   123.27   294.95    133.58   106.98  20.82  97.50   24.02  9.48    31.79  
1 1 1 8   13  8  o 19 153.15  17.87  698.17    154.17   710.88   215.58   684.87    220.55   151.83  25.65  148.49  26.86  3.34    37.14  
1 1 1 8   13  9  o 5  281.58  31.47  2481.55   499.97   2646.66  706.33   2315.74   707.81   279.00  45.68  256.96  49.78  22.03   67.56  
1 1 1 8   13  10 o 2  103.44  17.46  323.23    99.99    331.16   132.64   312.79    152.17   103.18  22.98  99.61   26.25  3.57    34.89  
1 1 1 8   13  11 o 13 63.81   19.81  121.35    80.17    139.99   103.33   93.17     127.07   69.08   22.61  64.39   24.63  4.69    33.44  
1 1 1 8   13  12 o 12 67.41   18.55  139.41    74.05    140.72   91.92    136.99    124.98   68.32   21.22  70.29   24.83  -1.97   32.66  
1 1 1 8   13  13 o 9  206.78  23.22  1316.69   270.83   1306.35  377.35   1327.68   388.94   198.43  34.37  199.38  35.27  -0.95   49.25  
1 1 1 8   13  14 o 11 122.99  16.30  455.89    112.23   471.89   154.98   438.24    162.73   122.54  22.87  117.09  24.97  5.45    33.86  
1 1 1 8   13  15 o 11 73.57   18.01  168.61    75.43    189.21   97.57    138.01    118.90   77.45   21.29  69.16   24.24  8.29    32.26  
1 1 1 8   13  16 f 0  42.11   17.25  22.46     66.39    -27.11   85.79    96.46     104.83   40.55   18.10  60.91   22.57  -20.36  28.93  
1 1 1 8   13  17 o 15 104.36  17.12  335.42    99.01    388.87   131.56   265.60    150.35   110.58  21.50  89.59   27.01  20.98   34.52  
1 1 1 8   13  18 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   13  19 o 18 166.76  33.57  1005.06   310.22   0.00     0.00     1005.06   310.22   ?       ?      166.76  33.57  0.00    33.57  
1 1 1 8   13  20 o 15 166.00  20.82  882.33    194.06   886.02   267.68   878.24    281.74   157.40  30.73  154.55  32.77  2.85    44.92  
1 1 1 8   13  21 o 1  97.18   18.75  304.79    100.83   297.07   130.44   316.27    158.92   92.77   24.23  93.69   27.65  -0.92   36.77  
1 1 1 8   13  22 o 14 58.55   20.45  106.08    84.60    109.95   104.92   98.89     143.06   60.74   22.57  62.77   25.46  -2.03   34.02  
1 1 1 8   14  0  o 19 100.85  16.87  306.20    94.21    329.77   124.74   274.91    143.73   103.43  21.70  93.79   25.86  9.64    33.76  
1 1 1 8   14  1  o 11 100.10  16.56  301.26    91.83    224.68   124.05   394.11    136.59   85.25   24.22  113.28  21.80  -28.03  32.58  
1 1 1 8   14  2  o 11 138.87  17.44  575.50    135.96   523.74   186.01   634.87    199.22   129.55  25.92  143.26  25.14  -13.71  36.11  
1 1 1 8   14  3  o 2  233.89  25.79  1673.51   340.58   1716.95  478.26   1628.81   485.11   229.46  37.61  222.06  39.50  7.41    54.54  
1 1 1 8   14  4  o 10 172.50  19.54  891.86    190.10   826.19   262.70   964.07    275.44   161.83  29.36  175.63  28.28  -13.80  40.76  
1 1 1 8   14  5  o 17 121.69  15.93  441.34    108.63   519.52   139.82   322.28    172.53   131.21  19.12  100.88  28.53  30.33   34.34  
1 1 1 8   14  6  o 9  68.65   24.91  123.07    126.67   0.00     0.00     123.07    126.67   ?       ?      68.65   24.91  0.00    24.91  
1 1 1 8   14  7  o 17 163.39  28.82  845.60    260.44   0.00     0.00     845.60    260.44   ?       ?      163.39  28.82  0.00    28.82  
1 1 1 8   14  8  o 7  253.07  28.69  2009.78   409.50   2181.28  576.36   1834.97   581.91   253.27  41.05  227.25  46.18  26.01   61.79  
1 1 1 8   14  9  o 8  140.03  17.81  590.33    139.97   661.18   192.66   511.14    203.69   145.83  23.84  125.75  28.83  20.08   37.41  
1 1 1 8   14  10 o 5  145.92  17.88  642.00    146.68   653.20   204.47   630.13    210.53   143.75  25.72  140.46  27.09  3.29    37.36  
1 1 1 8   14  11 o 6  113.31  17.30  389.77    108.94   368.84   145.54   416.44    164.30   107.67  24.14  113.92  25.73  -6.24   35.29  
1 1 1 8   14  12 o 15 218.03  24.91  1490.63   306.17   1423.38  428.53   1560.75   437.60   202.08  38.34  212.93  37.15  -10.86  53.39  
1 1 1 8   14  13 o 19 194.82  22.47  1179.80   246.75   1142.19  344.01   1219.66   354.11   183.24  33.95  189.64  33.77  -6.40   47.89  
1 1 1 8   14  14 o 1  74.17   19.63  173.27    84.85    154.61   107.09   204.76    139.10   70.89   23.01  80.46   26.23  -9.58   34.89  
1 1 1 8   14  15 o 16 106.59  16.70  348.45    98.82    389.96   130.43   292.53    151.40   110.87  21.27  93.83   26.79  17.04   34.20  
1 1 1 8   14  16 o 3  72.72   18.62  167.47    78.04    185.56   100.49   139.99    123.87   75.96   21.87  68.98   24.69  6.99    32.98  
1 1 1 8   14  17 f 0  135.90  26.33  618.89    198.00   618.89   198.00   0.00      0.00     135.90  26.33  ?       ?      0.00    26.33  
1 1 1 8   14  18 o 8  139.00  29.88  684.10    231.31   0.00     0.00     684.10    231.31   ?       ?      139.00  29.88  0.00    29.88  
1 1 1 8   14  19 o 17 66.80   19.73  144.81    80.88    173.98   102.23   96.00     132.23   72.45   22.35  62.20   24.74  10.25   33.34  
1 1 1 8   14  20 o 4  40.68   17.67  1.13      76.73    -5.76    94.49    14.46     131.46   43.87   19.32  52.71   23.01  -8.83   30.04  
1 1 1 8   15  0  o 7  64.52   18.50  126.68    72.04    141.25   91.21    102.51    117.47   68.46   21.11  64.34   23.88  4.12    31.88  
1 1 1 8   15  1  o 16 240.40  26.62  1793.63   361.24   1758.24  508.36   1829.72   513.43   227.60  40.39  232.71  39.87  -5.12   56.75  
1 1 1 8   15  2  o 1  103.31  16.78  322.44    96.08    337.54   126.79   302.06    147.25   104.17  21.90  97.55   25.87  6.62    33.90  
1 1 1 8   15  3  o 2  165.98  19.52  831.82    182.45   859.41   250.60   800.71    266.15   165.01  27.42  157.51  30.54  7.50    41.04  
1 1 1 8   15  4  o 2  75.36   18.53  175.42    79.61    208.91   99.42    115.56    132.93   81.87   21.04  67.99   25.37  13.89   32.96  
1 1 1 8   15  5  o 4  66.16   18.47  134.24    72.82    -46.44   82.46    774.47    155.23   37.93   17.26  160.89  17.07  -122.96 24.27  
1 1 1 8   15  6  o 18 343.77  42.59  4117.38   822.50   4272.96  1161.02  3960.64   1165.38  313.63  66.55  295.56  69.81  18.07   96.44  
1 1 1 8   15  7  o 11 173.31  20.47  915.60    199.75   979.12   276.29   846.04    289.12   174.80  28.52  159.73  32.63  15.07   43.34  
1 1 1 8   15  8  o 19 222.73  25.87  1558.25   324.63   1734.95  455.72   1376.21   462.56   226.39  36.29  195.74  42.39  30.65   55.81  
1 1 1 8   15  9  o 15 203.41  23.75  1289.18   272.09   1419.80  381.03   1153.28   388.67   206.26  33.31  181.24  38.54  25.02   50.95  
1 1 1 8   15  10 o 19 171.40  20.65  903.98    199.11   995.51   276.46   805.35    286.99   175.01  28.50  153.69  33.48  21.32   43.96  
1 1 1 8   15  11 o 13 46.25   18.44  37.14     73.71    51.24    96.33    17.22     114.49   52.85   21.08  51.93   22.05  0.91    30.51  
1 1 1 8   15  12 o 8  88.32   19.34  245.42    95.34    269.47   125.59   212.73    146.46   91.15   23.76  81.75   26.93  9.40    35.91  
1 1 1 8   15  13 o 10 49.35   19.64  45.65     83.34    79.60    106.47   -8.08     133.94   58.28   22.48  52.69   23.11  5.59    32.24  
1 1 1 8   15  14 o 17 151.01  19.79  712.18    167.45   697.75   229.81   728.52    244.48   143.25  28.94  145.40  30.28  -2.15   41.88  
1 1 1 8   15  15 o 18 226.88  27.84  1729.67   355.04   1705.91  495.17   1754.82   509.34   205.53  43.33  207.36  44.14  -1.83   61.86  
1 1 1 8   15  16 o 1  119.38  19.06  451.60    126.22   437.61   167.67   469.88    191.73   112.89  26.35  115.12  29.02  -2.24   39.20  
1 1 1 8   15  17 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 8   15  18 o 7  47.12   21.60  -54.32    132.34   0.00     0.00     -54.32    132.34   ?       ?      47.12   21.60  0.00    21.60  
1 1 1 8   16  0  o 9  134.42  28.06  585.36    209.53   0.00     0.00     585.36    209.53   ?       ?      134.42  28.06  0.00    28.06  
1 1 1 8   16  1  o 6  92.17   25.93  272.44    142.91   0.00     0.00     272.44    142.91   ?       ?      92.17   25.93  0.00    25.93  
1 1 1 8   16  2  o 8  58.73   23.61  60.16     121.84   0.00     0.00     60.16     121.84   ?       ?      58.73   23.61  0.00    23.61  
1 1 1 8   16  3  o 11 97.50   26.03  306.86    148.43   0.00     0.00     306.86    148.43   ?       ?      97.50   26.03  0.00    26.03  
1 1 1 8   16  4  o 1  115.52  27.03  433.96    176.04   0.00     0.00     433.96    176.04   ?       ?      115.52  27.03  0.00    27.03  
1 1 1 8   16  5  o 7  141.67  28.67  656.88    225.17   0.00     0.00     656.88    225.17   ?       ?      141.67  28.67  0.00    28.67  
1 1 1 8   16  6  o 6  180.09  33.73  1099.70   335.92   0.00     0.00     1099.70   335.92   ?       ?      180.09  33.73  0.00    33.73  
1 1 1 8   16  7  o 3  214.34  41.45  1673.65   491.62   0.00     0.00     1673.65   491.62   ?       ?      214.34  41.45  0.00    41.45  
1 1 1 8   16  8  o 3  235.04  47.89  2169.26   624.20   0.00     0.00     2169.26   624.20   ?       ?      235.04  47.89  0.00    47.89  
1 1 1 8   16  9  o 10 122.13  28.44  500.25    195.66   0.00     0.00     500.25    195.66   ?       ?      122.13  28.44  0.00    28.44  
1 1 1 8   16  10 o 17 236.26  51.10  2355.42   672.90   0.00     0.00     2355.42   672.90   ?       ?      236.26  51.10  0.00    51.10  
1 1 1 8   16  11 o 10 101.34  27.77  349.40    166.33   0.00     0.00     349.40    166.33   ?       ?      101.34  27.77  0.00    27.77  
1 1 1 8   16  12 o 14 106.74  27.28  389.52    167.74   0.00     0.00     389.52    167.74   ?       ?      106.74  27.28  0.00    27.28  
1 1 1 8   16  13 o 2  84.41   27.35  241.47    151.37   0.00     0.00     241.47    151.37   ?       ?      84.41   27.35  0.00    27.35  
1 1 1 8   16  14 o 5  116.00  31.20  492.13    212.25   0.00     0.00     492.13    212.25   ?       ?      116.00  31.20  0.00    31.20  
1 1 1 8   16  15 o 17 213.24  57.03  2466.06   711.65   0.00     0.00     2466.06   711.65   ?       ?      213.24  57.03  0.00    57.03  
1 1 1 8   17  1  o 18 211.13  24.48  1406.80   291.25   1534.41  416.57   1284.78   407.35   210.64  35.72  189.56  38.74  21.09   52.70  
1 1 1 8   17  2  o 16 130.45  17.89  520.36    130.45   452.09   170.16   617.70    203.17   117.70  25.89  137.64  26.68  -19.93  37.17  
1 1 1 8   17  3  o 3  185.83  21.96  1077.83   229.78   1094.99  317.16   1058.87   333.35   179.86  31.89  174.59  34.48  5.27    46.97  
1 1 1 8   17  4  o 16 ?       ?      -190.71   44.65    -223.67  46.91    127.64    145.79   ?       ?      69.72   26.45  0.00    26.45  
1 1 1 8   17  5  o 19 128.93  18.28  512.11    131.50   653.51   173.43   320.92    201.67   144.09  21.63  97.17   31.58  46.92   38.28  
1 1 1 8   17  6  o 1  105.77  28.82  380.85    179.75   0.00     0.00     380.85    179.75   ?       ?      105.77  28.82  0.00    28.82  
1 1 1 8   17  7  o 6  45.62   18.84  25.88     80.05    50.50    95.60    -31.88    146.45   52.23   20.95  52.75   23.59  -0.52   31.55  
1 1 1 8   17  8  o 15 120.86  30.36  509.53    210.34   0.00     0.00     509.53    210.34   ?       ?      120.86  30.36  0.00    30.36  
1 1 1 8   17  9  f 0  174.80  21.95  971.92    215.44   1023.84  295.86   913.33    314.33   171.54  31.19  157.53  35.60  14.01   47.33  
1 1 1 9   -16 0  o 17 45.22   19.72  -3.56     96.38    37.78    108.78   -154.48   207.86   52.52   21.85  54.49   25.67  -1.97   33.71  
1 1 1 9   -16 1  o 2  99.87   21.86  324.19    121.82   352.01   147.85   265.41    214.95   102.36  25.31  88.89   32.43  13.47   41.13  
1 1 1 9   -16 2  o 10 138.92  20.68  610.85    159.89   599.22   206.56   628.24    252.54   132.69  28.00  131.63  33.38  1.05    43.57  
1 1 1 9   -15 0  o 13 107.73  24.49  379.01    148.01   379.01   148.01   0.00      0.00     107.73  24.49  ?       ?      0.00    24.49  
1 1 1 9   -15 1  o 3  93.38   20.20  276.18    105.11   299.20   128.73   230.13    182.06   95.97   23.55  85.19   29.99  10.78   38.13  
1 1 1 9   -15 2  o 8  74.70   21.66  177.31    98.30    173.44   118.35   185.93    176.49   74.41   24.19  79.42   29.31  -5.01   38.01  
1 1 1 9   -15 3  o 5  55.88   19.97  85.36     81.01    115.60   98.08    20.42     143.74   63.18   22.03  57.22   24.51  5.96    32.96  
1 1 1 9   -15 4  o 18 80.04   20.09  203.60    92.19    221.25   111.52   165.53    163.81   82.83   22.76  75.96   28.20  6.86    36.24  
1 1 1 9   -15 5  o 10 58.31   20.08  98.01     81.39    134.37   95.30    -0.01     156.47   66.33   21.72  57.37   25.07  8.96    33.17  
1 1 1 9   -15 6  o 12 41.73   18.05  -2.08     79.39    31.93    94.09    -86.16    147.92   49.49   20.43  49.07   22.62  0.42    30.48  
1 1 1 9   -15 7  o 19 144.54  19.67  648.55    159.00   751.01   210.67   512.94    242.37   152.47  24.93  120.10  33.76  32.37   41.96  
1 1 1 9   -14 0  o 4  42.61   18.59  -10.01    85.79    0.77     98.94    -42.66    172.18   46.97   20.23  57.15   25.57  -10.18  32.61  
1 1 1 9   -14 1  x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   -14 2  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   -14 3  o 1  120.97  17.33  444.58    116.91   490.57   151.66   377.21    183.55   125.28  21.88  106.80  29.14  18.48   36.44  
1 1 1 9   -14 4  o 18 66.63   25.88  101.64    141.83   0.00     0.00     101.64    141.83   ?       ?      66.63   25.88  0.00    25.88  
1 1 1 9   -14 5  o 19 155.16  19.13  734.33    166.76   757.08   224.21   706.17    249.46   153.75  26.35  145.73  30.79  8.02    40.52  
1 1 1 9   -14 6  o 13 111.15  17.54  377.32    108.20   377.87   136.04   376.36    178.51   109.32  22.43  106.72  28.57  2.60    36.32  
1 1 1 9   -14 7  o 12 134.22  18.30  549.86    137.35   525.26   179.76   584.36    212.90   127.81  25.39  133.15  28.70  -5.34   38.32  
1 1 1 9   -14 8  o 6  97.13   22.73  301.50    124.50   301.50   124.50   0.00      0.00     97.13   22.73  ?       ?      0.00    22.73  
1 1 1 9   -14 9  o 15 167.14  32.49  949.25    300.49   0.00     0.00     949.25    300.49   ?       ?      167.14  32.49  0.00    32.49  
1 1 1 9   -14 10 o 10 102.61  27.66  350.23    166.58   0.00     0.00     350.23    166.58   ?       ?      102.61  27.66  0.00    27.66  
1 1 1 9   -14 11 o 4  78.93   26.85  193.52    145.48   0.00     0.00     193.52    145.48   ?       ?      78.93   26.85  0.00    26.85  
1 1 1 9   -13 0  o 6  273.66  54.11  2879.41   819.90   0.00     0.00     2879.41   819.90   ?       ?      273.66  54.11  0.00    54.11  
1 1 1 9   -13 1  o 14 335.04  40.39  3828.20   761.25   3833.56  1073.10  3822.77   1080.08  302.25  63.85  300.77  64.49  1.49    90.75  
1 1 1 9   -13 2  o 16 39.95   16.81  8.64      65.47    61.80    79.34    -104.89   115.93   51.91   19.56  41.58   19.46  10.33   27.59  
1 1 1 9   -13 3  o 9  68.15   20.24  141.87    84.92    141.87   84.92    0.00      0.00     68.15   20.24  ?       ?      0.00    20.24  
1 1 1 9   -13 4  o 11 215.66  37.53  1568.08   447.76   1568.08  447.76   0.00      0.00     215.66  37.53  ?       ?      0.00    37.53  
1 1 1 9   -13 5  o 12 229.75  25.68  1642.26   332.94   1752.69  467.49   1528.59   474.30   228.68  36.86  209.95  40.82  18.73   55.00  
1 1 1 9   -13 6  f 0  230.19  25.76  1650.84   334.63   1741.50  470.62   1558.14   475.90   227.32  37.36  212.04  40.58  15.28   55.16  
1 1 1 9   -13 7  o 3  124.37  16.78  465.82    116.74   511.34   158.29   411.53    172.85   128.27  22.31  112.99  27.01  15.28   35.03  
1 1 1 9   -13 8  x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   -13 9  o 4  185.12  21.20  1049.02   221.26   1091.19  309.35   1004.85   316.61   183.14  30.50  173.96  32.91  9.18    44.87  
1 1 1 9   -13 10 o 12 77.60   18.90  187.56    83.41    133.46   106.85   271.95    133.45   67.65   23.01  92.15   24.72  -24.50  33.77  
1 1 1 9   -13 11 o 11 142.92  18.47  621.88    148.03   572.76   203.74   676.81    215.43   132.63  27.66  144.91  26.89  -12.28  38.57  
1 1 1 9   -13 12 o 8  135.73  28.04  604.47    211.29   0.00     0.00     604.47    211.29   ?       ?      135.73  28.04  0.00    28.04  
1 1 1 9   -13 13 o 18 143.88  29.10  686.30    232.10   0.00     0.00     686.30    232.10   ?       ?      143.88  29.10  0.00    29.10  
1 1 1 9   -12 0  o 8  60.06   23.88  63.50     123.19   0.00     0.00     63.50     123.19   ?       ?      60.06   23.88  0.00    23.88  
1 1 1 9   -12 1  o 6  171.61  29.33  925.90    278.55   0.00     0.00     925.90    278.55   ?       ?      171.61  29.33  0.00    29.33  
1 1 1 9   -12 2  o 19 163.70  27.99  838.08    253.60   0.00     0.00     838.08    253.60   ?       ?      163.70  27.99  0.00    27.99  
1 1 1 9   -12 3  o 1  188.26  20.75  1065.68   220.54   1054.53  309.78   1077.14   314.04   182.63  30.63  184.56  30.72  -1.94   43.38  
1 1 1 9   -12 4  o 7  115.97  15.70  400.93    101.83   444.25   137.42   348.20    151.63   120.71  20.57  105.25  25.39  15.46   32.68  
1 1 1 9   -12 5  o 10 238.28  40.91  1903.14   539.49   1903.14  539.49   0.00      0.00     238.28  40.91  ?       ?      0.00    40.91  
1 1 1 9   -12 6  o 2  108.70  22.24  366.14    134.08   366.14   134.08   0.00      0.00     108.70  22.24  ?       ?      0.00    22.24  
1 1 1 9   -12 7  o 10 92.42   21.38  265.47    111.15   265.47   111.15   0.00      0.00     92.42   21.38  ?       ?      0.00    21.38  
1 1 1 9   -12 8  o 19 169.74  29.45  917.75    276.58   0.00     0.00     917.75    276.58   ?       ?      169.74  29.45  0.00    29.45  
1 1 1 9   -12 9  o 6  195.50  21.63  1161.95   238.73   1279.29  334.77   1040.52   340.54   200.39  30.02  177.52  34.66  22.87   45.86  
1 1 1 9   -12 10 o 11 55.41   18.65  86.66     70.15    137.37   94.36    23.99     104.89   67.78   21.56  51.35   21.41  16.42   30.39  
1 1 1 9   -12 11 o 1  184.85  20.83  1039.49   217.18   1109.52  306.00   968.42    308.28   185.99  29.65  171.80  32.45  14.19   43.96  
1 1 1 9   -12 12 o 4  69.64   18.48  149.91    75.08    154.46   99.24    143.83    114.79   71.13   22.04  70.22   23.85  0.91    32.48  
1 1 1 9   -12 13 o 11 158.99  29.49  822.54    259.22   0.00     0.00     822.54    259.22   ?       ?      158.99  29.49  0.00    29.49  
1 1 1 9   -12 14 o 11 69.90   24.77  139.01    124.37   0.00     0.00     139.01    124.37   ?       ?      69.90   24.77  0.00    24.77  
1 1 1 9   -12 15 o 10 47.64   18.60  45.35     73.56    23.94    98.25    72.67     110.97   49.56   20.70  58.37   22.83  -8.81   30.82  
1 1 1 9   -12 16 o 12 86.10   18.62  231.47    89.34    237.43   122.45   224.69    130.63   85.90   23.94  83.67   25.16  2.24    34.73  
1 1 1 9   -11 0  o 15 164.22  19.00  802.73    175.83   802.02   243.59   803.51    254.05   161.24  27.29  160.89  28.55  0.35    39.49  
1 1 1 9   -11 1  o 11 48.35   16.77  61.89     56.79    52.92    71.46    77.27     93.54    49.22   18.55  57.42   21.31  -8.21   28.26  
1 1 1 9   -11 2  o 1  247.62  41.14  1993.41   564.35   0.00     0.00     1993.41   564.35   ?       ?      247.62  41.14  0.00    41.14  
1 1 1 9   -11 3  o 12 131.56  24.52  531.52    178.35   0.00     0.00     531.52    178.35   ?       ?      131.56  24.52  0.00    24.52  
1 1 1 9   -11 4  o 14 230.09  24.79  1598.67   322.33   1605.25  454.64   1592.01   457.07   224.41  36.55  223.22  36.96  1.19    51.98  
1 1 1 9   -11 5  o 9  285.03  30.88  2508.63   497.26   2660.35  702.53   2356.30   703.93   283.44  44.65  263.57  48.30  19.87   65.78  
1 1 1 9   -11 6  o 4  251.56  42.24  2082.24   588.45   2082.24  588.45   0.00      0.00     251.56  42.24  ?       ?      0.00    42.24  
1 1 1 9   -11 7  x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   -11 8  o 4  56.30   20.08  81.90     81.89    81.90    81.89    0.00      0.00     56.30   20.08  ?       ?      0.00    20.08  
1 1 1 9   -11 9  o 1  292.91  32.60  2707.10   538.96   2723.53  761.16   2690.59   763.25   278.74  49.38  276.46  49.93  2.28    70.22  
1 1 1 9   -11 10 o 9  148.33  17.65  657.58    147.34   682.87   203.74   629.84    213.34   148.50  24.77  141.46  27.26  7.04    36.83  
1 1 1 9   -11 11 o 10 347.59  40.95  4053.94   801.50   4156.81  1133.20  3950.95   1133.79  322.03  63.56  310.60  65.65  11.44   91.37  
1 1 1 9   -11 12 o 6  281.46  31.77  2526.65   504.36   2558.75  712.20   2494.36   714.35   267.19  48.21  262.68  49.18  4.51    68.86  
1 1 1 9   -11 13 o 12 48.01   18.70  44.86     74.25    51.64    97.58    35.53     114.42   53.64   21.28  54.65   22.54  -1.01   31.00  
1 1 1 9   -11 14 o 12 88.90   17.50  242.15    86.12    287.26   114.90   184.32    130.10   95.85   21.42  77.90   25.36  17.94   33.20  
1 1 1 9   -11 15 o 13 160.69  29.17  835.82    259.19   0.00     0.00     835.82    259.19   ?       ?      160.69  29.17  0.00    29.17  
1 1 1 9   -11 16 o 19 94.21   25.04  285.81    137.71   0.00     0.00     285.81    137.71   ?       ?      94.21   25.04  0.00    25.04  
1 1 1 9   -11 17 o 12 111.03  17.30  376.66    106.67   370.28   146.83   383.80    155.22   107.19  24.41  108.77  25.33  -1.59   35.18  
1 1 1 9   -10 0  o 1  148.61  25.33  670.21    208.36   0.00     0.00     670.21    208.36   ?       ?      148.61  25.33  0.00    25.33  
1 1 1 9   -10 1  o 2  232.52  37.33  1690.22   481.39   0.00     0.00     1690.22   481.39   ?       ?      232.52  37.33  0.00    37.33  
1 1 1 9   -10 2  o 11 262.31  27.81  2071.13   412.35   2123.31  582.45   2018.70   583.86   259.28  40.45  251.92  41.84  7.36    58.20  
1 1 1 9   -10 3  f 0  129.86  15.52  496.74    113.42   477.55   157.21   517.58    163.78   125.56  22.64  130.85  22.62  -5.29   32.01  
1 1 1 9   -10 4  o 10 246.99  39.98  1935.72   547.53   0.00     0.00     1935.72   547.53   ?       ?      246.99  39.98  0.00    39.98  
1 1 1 9   -10 5  o 16 287.32  48.01  2717.32   763.89   0.00     0.00     2717.32   763.89   ?       ?      287.32  48.01  0.00    48.01  
1 1 1 9   -10 6  o 18 252.38  41.34  2047.32   578.25   2047.32  578.25   0.00      0.00     252.38  41.34  ?       ?      0.00    41.34  
1 1 1 9   -10 7  x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   -10 8  o 3  74.00   20.40  166.36    89.45    166.36   89.45    0.00      0.00     74.00   20.40  ?       ?      0.00    20.40  
1 1 1 9   -10 9  o 2  296.36  51.54  3009.58   844.97   3009.58  844.97   0.00      0.00     296.36  51.54  ?       ?      0.00    51.54  
1 1 1 9   -10 10 o 13 250.80  27.19  1919.32   385.27   1921.88  544.15   1916.75   545.55   242.75  40.47  242.29  40.66  0.46    57.37  
1 1 1 9   -10 11 o 19 332.10  37.08  3532.66   694.94   3844.74  982.80   3220.58   982.80   329.08  53.89  293.60  60.33  35.49   80.89  
1 1 1 9   -10 12 o 15 151.23  17.53  681.83    149.40   770.63   209.58   590.07    213.04   158.60  23.75  136.73  28.08  21.88   36.78  
1 1 1 9   -10 13 o 19 151.32  17.63  684.42    150.30   732.73   212.65   636.19    212.47   153.78  24.94  142.20  27.01  11.58   36.77  
1 1 1 9   -10 14 o 17 61.98   18.42  115.82    70.32    106.85   96.07    126.18    103.20   62.43   21.80  66.56   22.62  -4.14   31.41  
1 1 1 9   -10 15 o 5  139.11  17.05  580.17    133.31   588.80   188.66   571.57    188.40   137.06  24.90  134.83  25.27  2.23    35.47  
1 1 1 9   -10 16 o 11 214.46  23.93  1419.80   289.61   1443.12  409.86   1396.55   409.27   207.95  35.61  203.98  36.28  3.97    50.84  
1 1 1 9   -10 17 o 17 217.50  39.09  1638.52   470.14   0.00     0.00     1638.52   470.14   ?       ?      217.50  39.09  0.00    39.09  
1 1 1 9   -10 18 o 9  71.73   23.83  155.19    114.57   0.00     0.00     155.19    114.57   ?       ?      71.73   23.83  0.00    23.83  
1 1 1 9   -10 19 o 7  71.80   21.06  161.43    92.43    -255.33  118.72   802.64    147.26   33.66   16.65  163.50  15.89  -129.83 23.02  
1 1 1 9   -9  0  o 17 213.09  33.29  1383.42   393.90   1383.42  393.90   0.00      0.00     213.09  33.29  ?       ?      0.00    33.29  
1 1 1 9   -9  1  o 10 156.06  17.20  714.69    151.55   763.21   213.29   665.22    215.38   159.77  24.00  148.38  26.25  11.40   35.56  
1 1 1 9   -9  2  o 18 151.83  16.95  676.52    145.19   703.73   204.24   648.71    206.45   153.29  24.00  146.69  25.44  6.61    34.97  
1 1 1 9   -9  3  o 15 313.96  33.13  2970.12   588.15   3045.46  831.61   2894.72   831.93   310.15  48.28  301.35  49.83  8.80    69.38  
1 1 1 9   -9  4  o 4  551.27  63.90  10127.39  1984.83  11080.44 2807.24  9174.71   2806.69  536.44  94.62  470.23  106.46 66.22   142.43 
1 1 1 9   -9  5  o 1  554.34  65.38  10395.56  2040.52  11112.04 2885.87  9679.21   2885.60  526.10  99.19  476.37  108.02 49.74   146.65 
1 1 1 9   -9  6  x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   -9  7  f 0  374.51  66.35  4917.39   1374.19  0.00     0.00     4917.39   1374.19  ?       ?      374.51  66.35  0.00    66.35  
1 1 1 9   -9  8  o 14 97.76   14.80  283.44    80.48    299.05   114.23   268.05    113.41   99.22   20.72  93.73   21.53  5.50    29.88  
1 1 1 9   -9  9  o 2  169.98  18.73  855.15    179.78   807.10   254.01   903.39    254.48   162.03  28.34  172.27  26.59  -10.24  38.86  
1 1 1 9   -9  10 o 6  207.49  33.52  1344.28   385.71   1344.28  385.71   0.00      0.00     207.49  33.52  ?       ?      0.00    33.52  
1 1 1 9   -9  11 f 0  175.79  29.06  954.53    282.97   954.53   282.97   0.00      0.00     175.79  29.06  ?       ?      0.00    29.06  
1 1 1 9   -9  12 o 5  333.00  36.67  3505.60   689.34   3815.26  975.38   3196.59   974.36   332.20  52.92  297.41  59.15  34.80   79.37  
1 1 1 9   -9  13 o 2  132.81  16.07  523.21    120.01   595.03   169.72   451.39    169.72   140.00  21.83  120.48  25.34  19.52   33.45  
1 1 1 9   -9  14 f 0  58.09   17.68  100.10    64.22    129.10   90.85    71.15     90.79    66.27   21.16  55.75   20.94  10.52   29.77  
1 1 1 9   -9  15 o 5  204.12  22.62  1265.70   260.66   1234.80  368.20   1296.74   369.07   195.13  34.11  200.64  33.20  -5.51   47.60  
1 1 1 9   -9  16 o 5  134.52  16.39  540.54    123.99   562.49   173.32   517.54    177.46   134.77  23.24  128.47  24.96  6.30    34.11  
1 1 1 9   -9  17 o 14 55.39   21.80  58.67     101.75   0.00     0.00     58.67     101.75   ?       ?      55.39   21.80  0.00    21.80  
1 1 1 9   -9  18 o 15 126.42  24.49  504.80    171.27   0.00     0.00     504.80    171.27   ?       ?      126.42  24.49  0.00    24.49  
1 1 1 9   -9  19 o 2  129.65  25.14  536.43    180.33   0.00     0.00     536.43    180.33   ?       ?      129.65  25.14  0.00    25.14  
1 1 1 9   -9  20 o 9  262.34  30.66  2265.98   453.11   2342.94  641.79   2189.50   639.81   247.32  46.92  236.43  48.76  10.89   67.67  
1 1 1 9   -8  0  o 18 159.07  17.29  742.23    155.38   711.08   217.70   774.57    221.84   153.74  25.56  160.80  24.83  -7.06   35.64  
1 1 1 9   -8  1  o 3  248.35  26.01  1829.57   365.40   1784.57  516.36   1874.71   517.14   240.71  38.68  247.26  37.62  -6.56   53.95  
1 1 1 9   -8  2  o 4  410.43  44.35  5200.25   1028.37  4964.41  1454.06  5436.26   1454.61  383.40  68.58  404.69  64.80  -21.29  94.35  
1 1 1 9   -8  3  o 6  570.19  65.86  10735.23  2116.20  10696.38 2992.69  10774.08  2992.84  523.38  103.28 525.97  102.81 -2.60   145.72 
1 1 1 9   -8  4  o 2  218.82  23.15  1412.88   286.35   1412.47  403.92   1413.29   406.00   215.61  33.74  215.62  33.92  -0.00   47.84  
1 1 1 9   -8  5  x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   -8  6  o 19 413.41  70.63  5785.85   1616.00  0.00     0.00     5785.85   1616.00  ?       ?      413.41  70.63  0.00    70.63  
1 1 1 9   -8  7  o 19 254.40  40.00  1997.58   564.92   0.00     0.00     1997.58   564.92   ?       ?      254.40  40.00  0.00    40.00  
1 1 1 9   -8  8  o 7  303.66  48.93  2934.90   823.97   0.00     0.00     2934.90   823.97   ?       ?      303.66  48.93  0.00    48.93  
1 1 1 9   -8  9  o 8  388.06  42.24  4687.19   925.88   4764.41  1309.21  4609.93   1309.58  374.55  63.13  367.12  64.49  7.43    90.25  
1 1 1 9   -8  10 o 6  140.01  16.23  577.05    128.06   616.13   179.65   536.67    182.60   143.17  22.61  132.82  24.86  10.35   33.60  
1 1 1 9   -8  11 o 16 230.02  36.98  1660.53   471.79   1660.53  471.79   0.00      0.00     230.02  36.98  ?       ?      0.00    36.98  
1 1 1 9   -8  12 o 15 274.72  45.72  2470.42   695.74   2470.42  695.74   0.00      0.00     274.72  45.72  ?       ?      0.00    45.72  
1 1 1 9   -8  13 o 11 125.01  15.57  462.04    109.30   496.90   153.78   426.46    155.38   128.09  21.69  117.88  23.78  10.21   32.19  
1 1 1 9   -8  14 o 11 358.86  40.46  4149.52   819.07   4301.80  1158.59  3997.36   1158.10  343.54  60.98  327.52  63.89  16.02   88.32  
1 1 1 9   -8  15 o 12 100.03  15.40  298.92    85.60    360.04   120.40   236.44    121.74   108.73  20.03  87.38   23.68  21.35   31.01  
1 1 1 9   -8  16 o 18 100.06  15.78  300.33    87.63    230.97   122.77   372.37    125.13   86.19   23.95  110.27  20.52  -24.09  31.54  
1 1 1 9   -8  17 o 8  201.99  21.73  1236.76   248.02   1438.22  348.24   1029.36   353.33   213.72  29.14  176.15  36.15  37.57   46.44  
1 1 1 9   -8  18 o 14 19.96   10.05  -164.77   52.79    -378.74  63.30    323.66    95.64    ?       ?      103.48  16.67  0.00    16.67  
1 1 1 9   -8  19 o 19 124.15  16.53  463.61    114.86   459.23   162.32   468.01    162.56   120.59  24.29  121.85  24.09  -1.26   34.21  
1 1 1 9   -8  20 o 16 145.24  26.71  676.67    214.50   0.00     0.00     676.67    214.50   ?       ?      145.24  26.71  0.00    26.71  
1 1 1 9   -8  21 o 2  152.06  28.27  757.40    237.70   0.00     0.00     757.40    237.70   ?       ?      152.06  28.27  0.00    28.27  
1 1 1 9   -8  22 o 17 56.96   22.41  67.87     107.39   0.00     0.00     67.87     107.39   ?       ?      56.96   22.41  0.00    22.41  
1 1 1 9   -7  0  o 17 106.35  19.16  338.76    112.65   338.76   112.65   0.00      0.00     106.35  19.16  ?       ?      0.00    19.16  
1 1 1 9   -7  1  o 2  123.03  14.19  443.37    98.39    452.13   138.32   434.40    139.98   123.03  20.29  120.38  21.02  2.65    29.22  
1 1 1 9   -7  2  o 19 280.58  29.45  2353.55   467.30   2281.30  660.62   2425.91   661.10   269.76  44.19  279.13  42.60  -9.37   61.38  
1 1 1 9   -7  3  o 13 219.09  22.99  1418.10   284.83   1354.70  402.36   1481.78   403.26   210.45  34.50  220.91  32.79  -10.47  47.60  
1 1 1 9   -7  4  o 6  132.29  21.99  523.66    161.15   523.66   161.15   0.00      0.00     132.29  21.99  ?       ?      0.00    21.99  
1 1 1 9   -7  5  x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   -7  6  o 2  141.05  16.02  582.95    127.40   603.35   179.56   562.27    180.79   142.13  22.78  136.84  23.88  5.28    33.00  
1 1 1 9   -7  7  o 12 405.60  43.52  5046.27   997.47   4984.27  1410.39  5108.30   1410.87  388.18  65.63  393.81  64.65  -5.63   92.12  
1 1 1 9   -7  8  o 13 198.20  31.57  1188.33   347.20   0.00     0.00     1188.33   347.20   ?       ?      198.20  31.57  0.00    31.57  
1 1 1 9   -7  9  o 11 100.85  22.02  307.70    123.92   0.00     0.00     307.70    123.92   ?       ?      100.85  22.02  0.00    22.02  
1 1 1 9   -7  10 o 16 391.56  42.17  4720.20   933.03   4729.27  1319.33  4711.11   1319.68  377.09  63.18  376.21  63.35  0.87    89.47  
1 1 1 9   -7  11 o 10 189.40  20.35  1058.51   217.80   1054.54  307.22   1062.52   308.82   186.28  29.73  186.98  29.77  -0.70   42.07  
1 1 1 9   -7  12 o 17 190.61  30.46  1111.96   322.06   1111.96  322.06   0.00      0.00     190.61  30.46  ?       ?      0.00    30.46  
1 1 1 9   -7  13 o 18 140.36  24.08  598.16    187.05   598.16   187.05   0.00      0.00     140.36  24.08  ?       ?      0.00    24.08  
1 1 1 9   -7  14 o 3  250.19  41.08  2012.86   569.57   2012.86  569.57   0.00      0.00     250.19  41.08  ?       ?      0.00    41.08  
1 1 1 9   -7  15 o 1  167.45  18.60  832.45    175.82   853.03   248.12   811.69    249.17   166.68  26.84  162.15  27.77  4.53    38.62  
1 1 1 9   -7  16 o 16 221.99  24.08  1490.34   301.96   1478.18  426.63   1502.55   427.44   214.79  35.86  216.75  35.59  -1.96   50.52  
1 1 1 9   -7  17 o 3  24.25   11.42  -44.83    41.09    -117.95  45.19    304.19    98.74    19.78   9.87   100.21  17.82  -80.43  20.37  
1 1 1 9   -7  18 o 17 195.66  21.26  1158.06   234.97   1338.67  332.27   977.38    332.33   206.37  28.83  172.48  34.76  33.88   45.17  
1 1 1 9   -7  19 o 10 138.43  17.16  574.83    133.41   556.58   189.58   592.73    187.77   132.78  25.80  137.63  24.67  -4.85   35.70  
1 1 1 9   -7  20 o 19 64.20   18.41  126.11    71.33    58.47    100.50   194.79    101.26   55.04   21.67  78.93   21.68  -23.90  30.65  
1 1 1 9   -7  21 o 11 82.50   23.01  215.40    113.08   0.00     0.00     215.40    113.08   ?       ?      82.50   23.01  0.00    23.01  
1 1 1 9   -7  22 o 14 123.80  24.92  493.67    170.98   0.00     0.00     493.67    170.98   ?       ?      123.80  24.92  0.00    24.92  
1 1 1 9   -7  23 o 6  53.75   19.19  78.21     74.81    70.99    110.77   84.26     101.44   57.85   22.76  58.45   22.09  -0.60   31.72  
1 1 1 9   -6  0  o 8  178.87  27.86  962.31    276.76   962.31   276.76   0.00      0.00     178.87  27.86  ?       ?      0.00    27.86  
1 1 1 9   -6  1  o 8  363.08  59.62  4296.19   1199.62  4296.19  1199.62  0.00      0.00     363.08  59.62  ?       ?      0.00    59.62  
1 1 1 9   -6  2  o 5  229.23  35.53  1602.92   452.44   1602.92  452.44   0.00      0.00     229.23  35.53  ?       ?      0.00    35.53  
1 1 1 9   -6  3  o 11 296.32  31.05  2627.08   520.31   2792.76  736.34   2461.84   735.34   299.74  44.11  279.42  47.54  20.32   64.85  
1 1 1 9   -6  4  x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   -6  5  o 13 274.09  43.21  2339.31   657.45   0.00     0.00     2339.31   657.45   ?       ?      274.09  43.21  0.00    43.21  
1 1 1 9   -6  6  o 14 296.30  31.13  2629.73   521.57   2741.61  737.82   2517.98   737.41   296.34  44.77  282.59  47.11  13.75   64.99  
1 1 1 9   -6  7  o 4  378.93  40.61  4391.29   869.73   4032.28  1230.34  4749.89   1229.62  348.04  63.93  383.01  57.71  -34.97  86.13  
1 1 1 9   -6  8  o 19 396.08  42.47  4807.21   950.59   4731.54  1344.90  4882.75   1343.78  378.47  64.19  385.57  62.87  -7.10   89.85  
1 1 1 9   -6  9  o 10 266.31  41.83  2187.79   618.39   0.00     0.00     2187.79   618.39   ?       ?      266.31  41.83  0.00    41.83  
1 1 1 9   -6  10 o 8  504.69  93.80  9386.23   2617.64  0.00     0.00     9386.23   2617.64  ?       ?      504.69  93.80  0.00    93.80  
1 1 1 9   -6  11 o 10 188.99  30.13  1078.85   315.90   0.00     0.00     1078.85   315.90   ?       ?      188.99  30.13  0.00    30.13  
1 1 1 9   -6  12 o 10 149.22  17.19  654.28    144.52   723.01   206.27   588.00    202.55   155.40  23.88  139.23  26.31  16.17   35.53  
1 1 1 9   -6  13 o 9  192.17  20.81  1091.84   225.92   991.63   319.33   1192.26   319.68   179.48  32.18  198.37  28.92  -18.90  43.26  
1 1 1 9   -6  14 x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   -6  15 o 19 48.02   19.25  33.84     80.73    33.84    80.73    0.00      0.00     48.02   19.25  ?       ?      0.00    19.25  
1 1 1 9   -6  16 o 7  58.31   21.72  78.75     97.31    0.00     0.00     78.75     97.31    ?       ?      58.31   21.72  0.00    21.72  
1 1 1 9   -6  17 o 4  157.63  26.82  768.22    234.05   0.00     0.00     768.22    234.05   ?       ?      157.63  26.82  0.00    26.82  
1 1 1 9   -6  18 o 14 190.64  21.27  1094.86   228.85   986.06   323.81   1203.45   323.49   175.01  33.45  195.87  29.70  -20.86  44.73  
1 1 1 9   -6  19 o 3  216.21  23.81  1429.46   290.63   1518.86  413.12   1341.85   408.95   216.16  34.45  201.37  36.73  14.79   50.36  
1 1 1 9   -6  20 o 12 105.84  24.36  354.15    144.96   354.15   144.96   0.00      0.00     105.84  24.36  ?       ?      0.00    24.36  
1 1 1 9   -6  21 f 0  68.36   19.61  143.95    80.94    199.46   128.92   107.83    103.99   80.19   25.16  63.19   22.62  17.00   33.83  
1 1 1 9   -6  22 o 2  134.02  25.64  575.20    190.10   0.00     0.00     575.20    190.10   ?       ?      134.02  25.64  0.00    25.64  
1 1 1 9   -6  23 o 5  108.31  24.25  379.20    147.04   0.00     0.00     379.20    147.04   ?       ?      108.31  24.25  0.00    24.25  
1 1 1 9   -6  24 o 8  212.02  25.16  1441.65   300.32   1469.38  433.15   1415.99   416.77   200.38  39.06  197.65  38.11  2.73    54.57  
1 1 1 9   -5  0  o 6  139.20  14.94  565.90    117.52   579.80   165.08   551.63    167.34   139.74  21.25  136.03  22.19  3.71    30.72  
1 1 1 9   -5  1  f 0  289.81  45.05  2593.47   725.23   2593.47  725.23   0.00      0.00     289.81  45.05  ?       ?      0.00    45.05  
1 1 1 9   -5  2  f 0  208.10  31.83  1304.37   368.17   1304.37  368.17   0.00      0.00     208.10  31.83  ?       ?      0.00    31.83  
1 1 1 9   -5  3  o 7  284.58  44.29  2501.43   699.97   2501.43  699.97   0.00      0.00     284.58  44.29  ?       ?      0.00    44.29  
1 1 1 9   -5  4  x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   -5  5  o 10 223.99  23.37  1479.13   296.11   1559.43  417.83   1398.11   419.71   227.22  33.00  214.14  35.38  13.08   48.38  
1 1 1 9   -5  6  o 8  302.27  31.67  2733.20   541.37   2633.86  765.81   2832.44   765.43   289.54  47.74  301.53  45.65  -11.99  66.05  
1 1 1 9   -5  7  o 19 314.46  33.09  2971.04   588.39   2852.67  832.48   3089.21   831.75   299.81  50.14  313.58  47.71  -13.77  69.21  
1 1 1 9   -5  8  o 11 171.13  18.53  859.98    179.09   873.50   254.46   846.71    252.11   170.44  26.90  167.69  27.11  2.75    38.19  
1 1 1 9   -5  9  o 16 508.89  57.06  8309.84   1638.37  8717.09  2317.41  7902.88   2316.60  492.07  85.12  461.87  90.61  30.19   124.32 
1 1 1 9   -5  10 o 18 127.23  15.85  475.36    113.26   433.30   163.06   514.57    157.44   119.64  24.56  131.28  21.65  -11.64  32.74  
1 1 1 9   -5  11 o 13 90.58   22.26  248.47    114.91   0.00     0.00     248.47    114.91   ?       ?      90.58   22.26  0.00    22.26  
1 1 1 9   -5  12 o 17 154.50  26.00  717.53    222.46   0.00     0.00     717.53    222.46   ?       ?      154.50  26.00  0.00    26.00  
1 1 1 9   -5  13 o 17 201.19  21.63  1193.58   245.87   1186.99  349.53   1200.03   345.91   197.66  31.89  198.96  31.32  -1.29   44.70  
1 1 1 9   -5  14 o 19 252.07  26.70  1897.07   380.49   1997.03  539.40   1798.07   536.79   253.84  38.20  239.58  40.47  14.27   55.65  
1 1 1 9   -5  15 o 1  241.04  39.04  1830.07   521.70   1830.07  521.70   0.00      0.00     241.04  39.04  ?       ?      0.00    39.04  
1 1 1 9   -5  16 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   -5  17 o 16 334.33  36.70  3518.51   692.72   3873.73  980.22   3164.10   979.10   336.62  52.43  296.94  59.51  39.67   79.31  
1 1 1 9   -5  18 f 0  227.09  24.66  1562.56   316.36   1660.99  448.86   1465.39   445.96   228.22  35.41  212.58  37.94  15.63   51.89  
1 1 1 9   -5  19 f 0  110.17  16.77  364.35    102.75   390.79   152.91   342.58    138.74   111.84  24.50  104.83  23.62  7.01    34.03  
1 1 1 9   -5  20 o 8  135.77  17.48  553.34    133.12   515.93   194.91   586.05    182.24   127.25  27.49  137.32  23.99  -10.07  36.48  
1 1 1 9   -5  21 o 18 71.91   19.23  159.91    80.92    94.25    128.04   203.58    104.42   64.36   24.70  80.71   21.96  -16.35  33.05  
1 1 1 9   -5  22 o 8  99.00   18.90  302.47    103.51   270.59   161.55   324.66    134.82   91.83   28.06  101.04  23.66  -9.21   36.70  
1 1 1 9   -5  23 o 4  54.51   21.55  57.81     99.79    0.00     0.00     57.81     99.79    ?       ?      54.51   21.55  0.00    21.55  
1 1 1 9   -5  24 o 14 88.82   23.92  256.20    124.65   0.00     0.00     256.20    124.65   ?       ?      88.82   23.92  0.00    23.92  
1 1 1 9   -5  25 o 15 101.86  25.28  343.16    147.13   0.00     0.00     343.16    147.13   ?       ?      101.86  25.28  0.00    25.28  
1 1 1 9   -4  0  o 12 214.63  22.16  1351.16   269.11   1372.56  380.47   1329.75   380.67   213.95  31.96  210.35  32.58  3.60    45.63  
1 1 1 9   -4  1  o 15 320.56  33.30  3055.52   603.79   3081.70  853.78   3029.34   854.00   316.00  48.62  313.03  49.14  2.97    69.13  
1 1 1 9   -4  2  o 7  659.51  138.58 18235.85  5079.69  18235.85 5079.69  0.00      0.00     659.51  138.58 ?       ?      0.00    138.58 
1 1 1 9   -4  3  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   -4  4  o 7  568.64  105.93 11953.07  3330.82  0.00     0.00     11953.07  3330.82  ?       ?      568.64  105.93 0.00    105.93 
1 1 1 9   -4  5  o 9  383.21  40.42  4434.97   875.84   4210.13  1238.36  4660.00   1238.88  361.86  61.83  383.35  58.11  -21.49  84.86  
1 1 1 9   -4  6  o 7  481.72  52.41  7233.87   1425.89  7445.18  2016.45  7022.53   2016.58  468.04  77.78  451.68  80.74  16.36   112.10 
1 1 1 9   -4  7  o 1  95.95   12.85  270.24    69.00    276.83   93.42    262.33    102.36   96.31   17.54  93.34   19.72  2.96    26.40  
1 1 1 9   -4  8  o 6  219.57  22.91  1421.39   284.53   1310.70  401.78   1532.75   403.01   207.15  35.03  225.40  32.05  -18.25  47.48  
1 1 1 9   -4  9  o 11 327.23  34.53  3227.73   638.97   3112.78  903.31   3342.85   903.98   312.17  52.25  325.01  50.06  -12.84  72.36  
1 1 1 9   -4  10 o 15 384.68  41.24  4535.03   896.50   4378.15  1267.67  4692.00   1268.02  363.43  63.05  378.48  60.39  -15.05  87.30  
1 1 1 9   -4  11 o 13 490.16  91.02  8846.09   2466.93  0.00     0.00     8846.09   2466.93  ?       ?      490.16  91.02  0.00    91.02  
1 1 1 9   -4  12 o 5  383.19  63.46  4818.30   1347.16  0.00     0.00     4818.30   1347.16  ?       ?      383.19  63.46  0.00    63.46  
1 1 1 9   -4  13 o 6  52.66   20.64  48.07     90.80    0.00     0.00     48.07     90.80    ?       ?      52.66   20.64  0.00    20.64  
1 1 1 9   -4  14 o 14 253.21  26.70  1904.82   382.27   1811.15  539.46   1999.29   541.77   241.81  40.28  255.22  38.15  -13.41  55.47  
1 1 1 9   -4  15 o 3  459.94  51.73  6808.03   1342.10  7039.78  1897.63  6576.08   1898.41  439.93  77.99  420.80  81.53  19.13   112.83 
1 1 1 9   -4  16 o 6  26.73   13.44  -276.30   91.87    -276.30  91.87    0.00      0.00     26.73   13.44  ?       ?      0.00    13.44  
1 1 1 9   -4  17 o 1  66.57   21.38  128.16    92.64    128.16   92.64    0.00      0.00     66.57   21.38  ?       ?      0.00    21.38  
1 1 1 9   -4  18 o 3  382.91  43.79  4786.83   945.35   4912.83  1336.89  4660.82   1336.96  361.25  66.93  348.72  69.23  12.53   96.29  
1 1 1 9   -4  19 o 13 303.44  34.01  2906.40   582.31   2661.41  822.81   3152.23   824.22   272.10  54.58  302.29  49.19  -30.19  73.47  
1 1 1 9   -4  20 o 3  187.70  20.96  1063.15   222.00   1027.11  313.54   1099.38   314.36   179.16  31.64  186.15  30.47  -6.99   43.93  
1 1 1 9   -4  21 o 19 152.80  17.86  701.07    153.73   798.78   216.86   602.37    217.95   160.43  24.31  136.96  28.64  23.47   37.57  
1 1 1 9   -4  22 o 14 290.69  33.58  2769.32   550.01   2890.11  778.29   2648.82   777.36   276.63  50.88  260.93  53.69  15.70   73.97  
1 1 1 9   -4  23 o 6  108.19  16.69  355.54    100.32   386.88   142.61   324.83    141.15   110.43  23.23  100.54  24.65  9.89    33.87  
1 1 1 9   -4  24 o 3  51.61   21.78  21.33     110.54   0.00     0.00     21.33     110.54   ?       ?      51.61   21.78  0.00    21.78  
1 1 1 9   -4  25 o 5  172.91  32.41  1033.57   309.92   0.00     0.00     1033.57   309.92   ?       ?      172.91  32.41  0.00    32.41  
1 1 1 9   -3  0  o 19 119.87  13.24  419.00    89.57    516.07   128.29   326.69    125.11   132.56  17.27  104.26  21.61  28.29   27.66  
1 1 1 9   -3  1  o 17 537.03  58.26  8974.46   1767.28  8826.82  2499.16  9122.13   2499.45  508.15  88.91  518.38  87.08  -10.23  124.45 
1 1 1 9   -3  2  o 1  464.38  77.00  7105.70   1980.76  7105.70  1980.76  0.00      0.00     464.38  77.00  ?       ?      0.00    77.00  
1 1 1 9   -3  3  x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   -3  4  o 12 539.55  94.81  10153.51  2829.47  10153.51 2829.47  0.00      0.00     539.55  94.81  ?       ?      0.00    94.81  
1 1 1 9   -3  5  o 4  314.43  32.62  2935.25   580.22   2839.90  820.16   3030.79   820.97   303.23  48.77  314.22  46.95  -10.99  67.70  
1 1 1 9   -3  6  o 15 88.30   12.38  228.93    61.01    232.53   81.91    224.43    91.44    88.27   16.78  86.40   18.96  1.88    25.31  
1 1 1 9   -3  7  o 12 207.45  21.60  1263.18   253.45   1213.92  357.58   1312.91   359.29   200.68  32.12  209.24  30.84  -8.56   44.53  
1 1 1 9   -3  8  f 0  546.85  61.08  9571.18   1884.72  9996.89  2665.44  9145.50   2665.35  528.12  91.21  498.73  96.58  29.39   132.85 
1 1 1 9   -3  9  o 2  424.05  45.68  5545.87   1094.50  5550.15  1547.75  5541.59   1547.97  407.66  68.57  407.28  68.65  0.38    97.03  
1 1 1 9   -3  10 f 0  155.01  16.81  704.12    147.19   712.27   207.18   695.81    209.16   154.28  24.19  152.30  24.77  1.98    34.62  
1 1 1 9   -3  11 o 5  524.53  59.57  8931.10   1761.92  8748.54  2491.66  9113.69   2491.80  481.54  93.51  494.75  91.09  -13.21  130.54 
1 1 1 9   -3  12 o 10 463.72  83.63  7687.04   2144.29  0.00     0.00     7687.04   2144.29  ?       ?      463.72  83.63  0.00    83.63  
1 1 1 9   -3  13 f 0  283.35  44.71  2496.55   703.12   0.00     0.00     2496.55   703.12   ?       ?      283.35  44.71  0.00    44.71  
1 1 1 9   -3  14 o 14 81.25   22.72  198.16    110.07   0.00     0.00     198.16    110.07   ?       ?      81.25   22.72  0.00    22.72  
1 1 1 9   -3  15 f 0  416.80  72.82  6011.80   1679.06  0.00     0.00     6011.80   1679.06  ?       ?      416.80  72.82  0.00    72.82  
1 1 1 9   -3  16 o 13 241.62  25.31  1740.23   345.86   2040.97  487.81   1436.23   490.44   258.40  33.69  212.67  41.66  45.74   53.58  
1 1 1 9   -3  17 o 16 104.55  21.13  332.22    122.48   332.22   122.48   0.00      0.00     104.55  21.13  ?       ?      0.00    21.13  
1 1 1 9   -3  18 o 19 259.76  43.24  2202.41   622.17   2202.41  622.17   0.00      0.00     259.76  43.24  ?       ?      0.00    43.24  
1 1 1 9   -3  19 o 1  185.20  20.67  1025.87   216.02   858.42   304.15   1196.34   306.88   164.05  33.43  197.13  27.90  -33.08  43.54  
1 1 1 9   -3  20 o 17 151.73  17.93  687.15    153.19   627.69   215.78   747.58    217.51   141.39  27.57  155.63  25.21  -14.24  37.36  
1 1 1 9   -3  21 o 17 44.87   17.67  35.79     66.89    41.24    92.27    29.75     97.11    51.20   20.56  50.59   20.80  0.61    29.25  
1 1 1 9   -3  22 o 2  95.35   16.73  276.37    88.25    281.31   123.64   271.24    125.99   94.43   23.02  92.59   23.63  1.83    32.99  
1 1 1 9   -3  23 o 8  51.05   18.69  65.16     71.56    -31.49   100.83   163.24    101.57   44.03   19.64  72.71   22.25  -28.68  29.68  
1 1 1 9   -3  24 o 9  125.44  17.25  478.66    120.94   474.44   172.01   482.78    170.06   121.11  25.55  122.45  25.04  -1.34   35.77  
1 1 1 9   -3  25 o 9  181.21  34.14  1146.06   342.17   0.00     0.00     1146.06   342.17   ?       ?      181.21  34.14  0.00    34.14  
1 1 1 9   -3  26 o 7  163.85  31.56  932.82    286.07   0.00     0.00     932.82    286.07   ?       ?      163.85  31.56  0.00    31.56  
1 1 1 9   -2  0  o 6  365.80  38.20  4000.23   790.36   4110.83  1117.90  3889.69   1117.58  363.32  55.34  352.32  57.22  11.00   79.60  
1 1 1 9   -2  1  o 1  213.41  22.02  1334.45   265.89   1386.50  376.48   1282.65   375.58   215.41  31.36  206.67  32.75  8.74    45.34  
1 1 1 9   -2  2  x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   -2  3  x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   -2  4  o 10 537.55  93.59  9988.12   2783.21  9988.12  2783.21  0.00      0.00     537.55  93.59  ?       ?      0.00    93.59  
1 1 1 9   -2  5  o 6  307.56  31.85  2802.32   554.21   2799.85  783.75   2804.78   783.78   302.24  46.67  302.53  46.63  -0.29   65.97  
1 1 1 9   -2  6  o 19 577.09  63.56  10506.91  2070.81  10580.40 2928.56  10433.42  2928.57  549.32  96.38  544.54  97.25  4.78    136.92 
1 1 1 9   -2  7  o 16 466.51  49.94  6671.37   1316.69  6921.58  1862.18  6421.21   1861.98  459.69  73.00  439.88  76.51  19.81   105.75 
1 1 1 9   -2  8  f 0  407.71  43.21  5044.98   996.06   5118.01  1408.66  4971.96   1408.62  398.73  63.68  392.15  64.84  6.58    90.88  
1 1 1 9   -2  9  o 4  634.69  74.23  13466.32  2653.74  13745.42 3752.98  13187.23  3752.92  587.52  115.39 570.64  118.44 16.88   165.36 
1 1 1 9   -2  10 o 3  213.45  22.31  1341.87   269.33   1420.87  380.14   1262.24   381.65   217.13  31.41  203.65  33.83  13.48   46.16  
1 1 1 9   -2  11 o 13 152.48  16.68  681.47    143.66   655.67   201.85   707.95    204.51   147.75  24.67  153.84  23.93  -6.09   34.37  
1 1 1 9   -2  12 o 18 422.08  73.61  6159.06   1718.76  6159.06  1718.76  0.00      0.00     422.08  73.61  ?       ?      0.00    73.61  
1 1 1 9   -2  13 o 6  243.38  38.19  1818.26   516.03   0.00     0.00     1818.26   516.03   ?       ?      243.38  38.19  0.00    38.19  
1 1 1 9   -2  14 o 2  170.13  27.74  871.45    261.58   0.00     0.00     871.45    261.58   ?       ?      170.13  27.74  0.00    27.74  
1 1 1 9   -2  15 o 16 270.48  42.74  2271.29   641.61   0.00     0.00     2271.29   641.61   ?       ?      270.48  42.74  0.00    42.74  
1 1 1 9   -2  16 o 8  171.82  18.71  868.73    181.60   947.17   255.68   788.87    257.97   177.65  25.83  160.92  28.99  16.73   38.83  
1 1 1 9   -2  17 o 11 254.07  40.97  2041.97   577.22   2041.97  577.22   0.00      0.00     254.07  40.97  ?       ?      0.00    40.97  
1 1 1 9   -2  18 o 9  98.59   21.94  297.70    120.99   297.70   120.99   0.00      0.00     98.59   21.94  ?       ?      0.00    21.94  
1 1 1 9   -2  19 o 2  279.65  47.99  2635.63   742.68   2635.63  742.68   0.00      0.00     279.65  47.99  ?       ?      0.00    47.99  
1 1 1 9   -2  20 o 2  178.24  29.93  996.70    295.43   996.70   295.43   0.00      0.00     178.24  29.93  ?       ?      0.00    29.93  
1 1 1 9   -2  21 o 9  99.80   16.42  300.13    90.80    344.70   128.65   255.88    128.18   105.46  21.96  90.38   24.22  15.08   32.69  
1 1 1 9   -2  22 o 19 164.75  19.16  819.93    177.79   887.16   250.59   751.78    252.29   167.62  26.96  152.49  29.89  15.13   40.25  
1 1 1 9   -2  23 o 6  166.09  19.32  837.90    180.77   904.34   256.24   772.07    255.07   168.20  27.49  153.70  29.98  14.50   40.68  
1 1 1 9   -2  24 o 8  122.43  17.55  456.71    119.81   441.03   172.61   471.28    166.44   116.38  26.44  121.21  24.76  -4.83   36.22  
1 1 1 9   -2  25 o 10 48.65   19.03  47.98     77.14    -30.70   111.67   119.82    106.70   46.25   20.65  64.77   22.94  -18.52  30.86  
1 1 1 9   -2  26 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   -1  0  o 4  541.38  58.96  9116.53   1802.77  9570.03  2549.56  8663.06   2549.43  532.96  86.28  501.78  91.89  31.18   126.05 
1 1 1 9   -1  1  o 13 210.15  31.85  1322.11   372.25   1322.11  372.25   0.00      0.00     210.15  31.85  ?       ?      0.00    31.85  
1 1 1 9   -1  2  x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   -1  3  o 15 118.04  19.32  413.32    126.38   413.32   126.38   0.00      0.00     118.04  19.32  ?       ?      0.00    19.32  
1 1 1 9   -1  4  o 15 232.76  35.36  1629.30   457.66   1629.30  457.66   0.00      0.00     232.76  35.36  ?       ?      0.00    35.36  
1 1 1 9   -1  5  o 3  536.51  93.22  9929.07   2766.83  9929.07  2766.83  0.00      0.00     536.51  93.22  ?       ?      0.00    93.22  
1 1 1 9   -1  6  o 4  773.55  92.79  20499.11  4038.40  20605.58 5711.11  20392.63  5711.22  696.42  147.45 691.10  148.39 5.32    209.19 
1 1 1 9   -1  7  o 15 204.26  21.21  1222.16   245.04   1166.40  345.96   1278.30   347.11   197.09  31.65  206.92  30.10  -9.84   43.68  
1 1 1 9   -1  8  o 18 652.01  74.61  13920.18  2742.37  13898.24 3878.28  13942.11  3878.33  602.70  116.31 603.98  116.07 -1.28   164.32 
1 1 1 9   -1  9  o 13 495.22  53.93  7646.60   1508.36  7776.46  2133.17  7516.76   2133.13  477.63  80.67  467.86  82.43  9.77    115.34 
1 1 1 9   -1  10 f 0  250.66  26.09  1858.24   369.96   1813.92  523.49   1902.46   522.91   243.44  38.76  249.86  37.62  -6.41   54.01  
1 1 1 9   -1  11 o 7  380.97  40.70  4433.04   876.43   4622.79  1239.36  4243.22   1239.56  377.25  59.17  358.88  62.43  18.38   86.02  
1 1 1 9   -1  12 o 12 378.43  40.59  4388.15   868.01   4741.05  1227.67  4035.39   1227.43  381.86  57.81  347.42  63.90  34.43   86.17  
1 1 1 9   -1  13 o 5  90.52   20.95  248.17    106.72   0.00     0.00     248.17    106.72   ?       ?      90.52   20.95  0.00    20.95  
1 1 1 9   -1  14 o 16 205.66  32.39  1282.80   369.80   0.00     0.00     1282.80   369.80   ?       ?      205.66  32.39  0.00    32.39  
1 1 1 9   -1  15 o 11 412.31  70.56  5762.67   1610.09  0.00     0.00     5762.67   1610.09  ?       ?      412.31  70.56  0.00    70.56  
1 1 1 9   -1  16 o 1  305.43  32.27  2805.88   557.25   2992.23  788.23   2619.66   787.92   308.73  45.87  286.44  49.72  22.29   67.64  
1 1 1 9   -1  17 o 16 96.59   22.39  284.41    121.72   284.41   121.72   0.00      0.00     96.59   22.39  ?       ?      0.00    22.39  
1 1 1 9   -1  18 o 6  126.66  23.41  488.42    163.97   488.42   163.97   0.00      0.00     126.66  23.41  ?       ?      0.00    23.41  
1 1 1 9   -1  19 o 9  365.94  71.91  5207.93   1456.69  5207.93  1456.69  0.00      0.00     365.94  71.91  ?       ?      0.00    71.91  
1 1 1 9   -1  20 o 9  165.31  18.77  814.67    174.93   806.42   246.81   823.00    247.99   161.11  27.68  162.87  27.50  -1.76   39.02  
1 1 1 9   -1  21 f 0  201.45  22.32  1229.27   253.84   1203.88  359.10   1254.62   358.86   193.29  33.58  197.93  32.73  -4.63   46.89  
1 1 1 9   -1  22 o 12 128.85  17.10  499.10    123.36   433.57   172.12   568.32    176.90   116.62  26.33  135.09  23.67  -18.46  35.41  
1 1 1 9   -1  23 o 9  230.51  26.02  1666.98   338.31   1719.00  479.68   1615.50   477.21   223.30  38.83  215.15  40.11  8.15    55.83  
1 1 1 9   -1  24 o 4  108.66  17.91  361.99    107.82   296.73   153.21   426.01    151.76   95.41   26.85  115.65  23.66  -20.24  35.78  
1 1 1 9   -1  25 o 14 142.66  18.38  623.96    147.03   657.84   211.18   592.09    204.83   141.72  26.94  133.90  27.57  7.82    38.54  
1 1 1 9   -1  26 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   -1  27 o 14 106.68  25.81  384.83    156.33   0.00     0.00     384.83    156.33   ?       ?      106.68  25.81  0.00    25.81  
1 1 1 9   0   0  o 12 290.69  30.22  2497.20   496.88   2788.86  703.17   2206.32   702.22   303.77  41.40  267.49  47.47  36.28   62.99  
1 1 1 9   0   1  x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   0   2  o 1  278.96  42.75  2366.69   662.79   0.00     0.00     2366.69   662.79   ?       ?      278.96  42.75  0.00    42.75  
1 1 1 9   0   3  o 3  383.20  60.67  4625.17   1290.21  4625.17  1290.21  0.00      0.00     383.20  60.67  ?       ?      0.00    60.67  
1 1 1 9   0   4  o 2  633.71  121.03 15229.37  4242.41  15229.37 4242.41  0.00      0.00     633.71  121.03 ?       ?      0.00    121.03 
1 1 1 9   0   5  o 4  248.63  37.90  1865.95   523.81   1865.95  523.81   0.00      0.00     248.63  37.90  ?       ?      0.00    37.90  
1 1 1 9   0   6  o 1  211.13  21.91  1306.05   261.74   1374.94  369.76   1236.86   370.56   214.62  30.90  202.81  32.96  11.80   45.18  
1 1 1 9   0   7  f 0  226.46  23.40  1504.92   299.86   1489.93  423.77   1519.95   424.36   222.60  34.26  224.98  33.91  -2.38   48.20  
1 1 1 9   0   8  o 13 279.13  28.94  2302.66   457.07   2366.52  646.23   2238.74   646.54   278.92  41.63  270.62  43.06  8.29    59.89  
1 1 1 9   0   9  o 14 178.65  18.88  934.34    190.69   1041.72  269.60   826.85    269.75   187.28  25.76  165.60  29.46  21.69   39.13  
1 1 1 9   0   10 o 9  177.95  18.78  927.93    188.95   926.07   266.97   929.81    267.45   175.80  27.34  176.17  27.33  -0.37   38.66  
1 1 1 9   0   11 o 1  402.74  43.14  4976.91   981.95   4885.99  1388.73  5067.83   1388.65  383.96  65.34  392.31  63.85  -8.35   91.36  
1 1 1 9   0   12 f 0  455.22  50.19  6527.38   1289.82  6921.72  1824.12  6133.08   1824.05  447.82  73.50  415.37  79.39  32.45   108.19 
1 1 1 9   0   13 o 11 447.09  49.24  6290.13   1242.95  6746.52  1757.62  5833.55   1757.99  443.15  71.52  404.90  78.47  38.25   106.17 
1 1 1 9   0   14 o 3  283.82  45.01  2518.50   708.83   0.00     0.00     2518.50   708.83   ?       ?      283.82  45.01  0.00    45.01  
1 1 1 9   0   15 o 14 390.00  65.63  5069.24   1417.28  0.00     0.00     5069.24   1417.28  ?       ?      390.00  65.63  0.00    65.63  
1 1 1 9   0   16 o 8  295.10  31.20  2611.26   520.62   2782.03  736.69   2440.89   735.83   298.57  44.32  277.50  47.92  21.07   65.28  
1 1 1 9   0   17 o 1  289.82  30.82  2533.43   504.86   2559.70  714.11   2507.17   713.85   283.76  45.37  280.45  45.93  3.31    64.55  
1 1 1 9   0   18 o 4  100.63  22.58  309.85    127.22   309.85   127.22   0.00      0.00     100.63  22.58  ?       ?      0.00    22.58  
1 1 1 9   0   19 o 6  137.49  24.92  579.95    189.47   579.95   189.47   0.00      0.00     137.49  24.92  ?       ?      0.00    24.92  
1 1 1 9   0   20 o 14 223.22  37.33  1607.45   461.46   1607.45  461.46   0.00      0.00     223.22  37.33  ?       ?      0.00    37.33  
1 1 1 9   0   21 o 15 365.35  43.15  4486.37   887.49   4648.52  1255.66  4324.51   1254.53  340.54  66.62  323.63  69.60  16.91   96.34  
1 1 1 9   0   22 o 13 201.76  22.79  1244.73   259.33   1295.83  368.66   1194.67   364.87   199.35  33.40  190.40  34.66  8.95    48.13  
1 1 1 9   0   23 o 17 152.74  19.07  708.74    163.60   663.93   234.34   751.34    228.51   142.56  29.60  153.41  26.93  -10.85  40.02  
1 1 1 9   0   24 o 3  109.25  17.99  366.09    108.90   410.88   162.63   329.67    146.64   112.62  25.72  100.87  25.36  11.75   36.12  
1 1 1 9   0   25 o 12 227.12  45.43  1987.66   571.63   1987.66  571.63   0.00      0.00     227.12  45.43  ?       ?      0.00    45.43  
1 1 1 9   0   26 f 0  71.69   24.93  156.91    125.59   0.00     0.00     156.91    125.59   ?       ?      71.69   24.93  0.00    24.93  
1 1 1 9   0   27 o 19 136.56  19.76  588.94    150.43   537.04   220.01   634.50    206.15   122.34  31.23  136.60  27.24  -14.26  41.44  
1 1 1 9   1   0  o 4  429.81  69.41  5933.62   1654.16  5933.62  1654.16  0.00      0.00     429.81  69.41  ?       ?      0.00    69.41  
1 1 1 9   1   1  x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   1   2  o 2  477.46  79.25  7520.54   2096.03  7520.54  2096.03  0.00      0.00     477.46  79.25  ?       ?      0.00    79.25  
1 1 1 9   1   3  o 18 329.81  51.16  3356.77   937.35   3356.77  937.35   0.00      0.00     329.81  51.16  ?       ?      0.00    51.16  
1 1 1 9   1   4  o 13 352.42  55.11  3863.86   1078.35  3863.86  1078.35  0.00      0.00     352.42  55.11  ?       ?      0.00    55.11  
1 1 1 9   1   5  o 13 306.82  31.78  2787.43   551.64   2824.79  779.93   2750.02   780.35   303.95  46.15  299.53  46.92  4.43    65.81  
1 1 1 9   1   6  o 10 73.32   12.71  159.25    51.55    149.56   69.74    170.94    76.56    70.57   17.34  75.41   17.94  -4.85   24.95  
1 1 1 9   1   7  o 9  551.04  60.04  9489.00   1868.43  9355.02  2642.17  9623.03   2642.54  520.76  91.73  529.83  90.10  -9.06   128.58 
1 1 1 9   1   8  o 18 585.63  64.74  10889.54  2140.32  10423.08 3026.63  11356.14  3027.12  537.66  101.79 567.62  96.34  -29.95  140.15 
1 1 1 9   1   9  o 12 278.56  28.94  2296.92   455.99   2328.00  644.83   2265.82   644.91   276.01  42.02  271.96  42.71  4.05    59.92  
1 1 1 9   1   10 o 5  507.61  55.89  8126.29   1601.62  8085.16  2264.95  8167.43   2265.12  479.69  85.38  482.72  84.83  -3.03   120.36 
1 1 1 9   1   11 f 0  536.22  60.42  9280.81   1827.51  9086.85  2584.24  9474.84   2584.74  494.01  94.57  507.70  92.07  -13.69  131.99 
1 1 1 9   1   12 o 17 197.70  20.82  1150.86   232.72   1131.44  328.21   1170.49   330.04   193.26  30.60  196.77  30.18  -3.51   42.98  
1 1 1 9   1   13 o 13 15.94   8.08   -133.61   37.27    -236.54  42.20    231.45    79.47    ?       ?      88.00   16.33  0.00    16.33  
1 1 1 9   1   14 f 0  163.26  26.62  802.64    240.93   0.00     0.00     802.64    240.93   ?       ?      163.26  26.62  0.00    26.62  
1 1 1 9   1   15 o 2  228.38  36.03  1595.36   456.71   0.00     0.00     1595.36   456.71   ?       ?      228.38  36.03  0.00    36.03  
1 1 1 9   1   16 o 3  61.54   19.09  109.67    74.45    104.42   107.80   114.46    102.95   64.45   23.03  65.51   22.58  -1.06   32.26  
1 1 1 9   1   17 o 1  179.36  19.72  949.21    199.72   947.70   282.42   950.72    282.48   176.59  28.85  176.89  28.81  -0.30   40.77  
1 1 1 9   1   18 o 18 246.31  26.38  1823.91   367.22   1997.22  519.19   1650.41   519.46   252.75  36.87  226.99  41.39  25.75   55.43  
1 1 1 9   1   19 f 0  211.69  35.07  1417.14   411.23   1417.14  411.23   0.00      0.00     211.69  35.07  ?       ?      0.00    35.07  
1 1 1 9   1   20 o 3  321.14  60.07  3801.18   1066.79  3801.18  1066.79  0.00      0.00     321.14  60.07  ?       ?      0.00    60.07  
1 1 1 9   1   21 o 18 47.10   18.21  44.00     69.92    -1.77    102.01   84.57     96.04    47.88   20.58  58.76   21.63  -10.88  29.86  
1 1 1 9   1   22 o 1  243.83  27.32  1857.22   375.83   1888.26  531.64   1826.21   531.38   234.87  40.92  230.15  41.76  4.72    58.46  
1 1 1 9   1   23 o 16 91.50   18.48  258.53    93.70    229.10   132.76   287.75    132.28   85.06   25.31  94.96   24.20  -9.90   35.02  
1 1 1 9   1   24 f 0  100.73  18.21  312.90    101.40   328.20   151.25   300.40    136.66   100.38  26.03  96.47   24.60  3.91    35.82  
1 1 1 9   1   25 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   1   26 o 2  180.63  22.05  1032.69   223.89   1116.56  320.37   952.64    313.01   179.00  32.37  163.01  34.52  15.98   47.33  
1 1 1 9   1   27 o 6  161.15  20.88  826.35    188.61   789.75   269.40   861.55    264.16   147.60  32.66  156.49  30.50  -8.89   44.69  
1 1 1 9   2   0  o 6  337.39  52.40  3518.10   982.01   3518.10  982.01   0.00      0.00     337.39  52.40  ?       ?      0.00    52.40  
1 1 1 9   2   1  x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   2   2  o 8  143.14  22.42  608.02    178.17   608.02   178.17   0.00      0.00     143.14  22.42  ?       ?      0.00    22.42  
1 1 1 9   2   3  o 4  305.51  47.04  2857.59   798.51   2857.59  798.51   0.00      0.00     305.51  47.04  ?       ?      0.00    47.04  
1 1 1 9   2   4  f 0  291.82  30.10  2515.67   496.97   2469.14  702.54   2562.28   703.11   284.47  44.48  290.23  43.54  -5.76   62.24  
1 1 1 9   2   5  o 11 451.99  47.86  6207.17   1223.04  6154.04  1729.48  6260.31   1729.79  435.98  71.58  440.29  70.84  -4.31   100.71 
1 1 1 9   2   6  f 0  217.04  22.48  1380.97   275.99   1412.65  389.97   1349.19   390.64   217.22  32.25  211.94  33.20  5.29    46.28  
1 1 1 9   2   7  o 5  379.52  39.73  4321.71   852.79   4301.81  1205.87  4341.62   1206.18  369.58  58.81  371.48  58.49  -1.91   82.94  
1 1 1 9   2   8  o 11 487.37  52.50  7329.05   1445.59  7386.46  2044.21  7271.63   2044.54  470.37  78.47  465.99  79.26  4.38    111.53 
1 1 1 9   2   9  o 7  135.16  15.04  533.83    114.75   548.26   160.50   518.74    164.13   135.84  21.28  131.80  22.50  4.04    30.97  
1 1 1 9   2   10 o 7  155.85  16.83  710.90    148.18   730.37   207.88   690.79    211.28   156.51  23.89  151.84  25.12  4.68    34.67  
1 1 1 9   2   11 f 0  279.30  29.22  2324.44   461.53   2317.61  652.17   2331.28   653.23   273.31  42.98  274.16  42.91  -0.85   60.74  
1 1 1 9   2   12 o 18 496.89  55.82  7940.28   1564.81  7853.51  2212.42  8027.13   2213.54  461.96  86.61  468.51  85.45  -6.55   121.66 
1 1 1 9   2   13 o 6  74.05   15.40  164.58    63.34    -20.70   75.89    590.28    115.03   39.35   17.32  142.17  14.29  -102.82 22.45  
1 1 1 9   2   14 o 5  239.95  37.75  1770.96   502.84   0.00     0.00     1770.96   502.84   ?       ?      239.95  37.75  0.00    37.75  
1 1 1 9   2   15 o 2  237.65  37.56  1734.63   495.37   0.00     0.00     1734.63   495.37   ?       ?      237.65  37.56  0.00    37.56  
1 1 1 9   2   16 o 3  416.88  45.42  5410.78   1069.46  5373.14  1511.98  5448.47   1512.90  396.67  68.90  399.99  68.34  -3.32   97.04  
1 1 1 9   2   17 o 15 301.72  32.23  2756.48   549.63   2909.74  777.45   2603.33   777.15   302.23  46.28  283.61  49.54  18.62   67.79  
1 1 1 9   2   18 o 8  349.14  38.33  3811.37   755.54   3811.80  1068.49  3810.93   1068.49  332.76  58.04  332.71  58.05  0.05    82.09  
1 1 1 9   2   19 o 9  314.57  56.32  3486.76   979.63   3486.76  979.63   0.00      0.00     314.57  56.32  ?       ?      0.00    56.32  
1 1 1 9   2   20 o 1  289.10  51.57  2927.10   824.52   2927.10  824.52   0.00      0.00     289.10  51.57  ?       ?      0.00    51.57  
1 1 1 9   2   21 o 8  171.69  19.76  885.84    191.20   932.89   270.12   838.59    270.68   172.44  28.27  162.39  30.15  10.05   41.32  
1 1 1 9   2   22 o 11 230.83  25.81  1654.38   336.17   1749.79  476.81   1560.08   474.02   228.37  37.68  213.34  40.18  15.03   55.08  
1 1 1 9   2   23 o 5  161.90  19.63  798.90    178.72   803.71   254.71   794.23    250.83   157.11  29.32  156.35  29.01  0.76    41.25  
1 1 1 9   2   24 o 11 211.57  39.99  1604.76   467.93   1604.76  467.93   0.00      0.00     211.57  39.99  ?       ?      0.00    39.99  
1 1 1 9   2   25 o 18 92.03   25.72  278.85    141.10   0.00     0.00     278.85    141.10   ?       ?      92.03   25.72  0.00    25.72  
1 1 1 9   2   26 o 15 48.75   19.79  38.80     86.54    7.60     124.10   68.32     120.73   52.14   22.56  58.49   23.51  -6.35   32.58  
1 1 1 9   2   27 f 0  268.29  35.88  2680.05   538.76   2739.08  763.13   2621.38   760.71   230.23  57.82  222.42  58.72  7.82    82.41  
1 1 1 9   3   0  x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   3   1  o 7  219.32  33.23  1441.56   405.26   1441.56  405.26   0.00      0.00     219.32  33.23  ?       ?      0.00    33.23  
1 1 1 9   3   2  o 7  395.86  62.92  4955.63   1382.07  4955.63  1382.07  0.00      0.00     395.86  62.92  ?       ?      0.00    62.92  
1 1 1 9   3   3  o 1  253.57  26.01  1890.45   373.30   1785.75  527.76   1995.28   528.08   242.77  39.20  257.68  36.74  -14.91  53.73  
1 1 1 9   3   4  o 1  451.47  47.85  6192.10   1221.40  6216.97  1727.29  6167.21   1727.36  438.68  71.01  436.65  71.37  2.03    100.68 
1 1 1 9   3   5  o 10 331.57  34.40  3268.07   645.21   3232.30  912.53   3303.83   912.40   323.42  50.82  327.34  50.15  -3.92   71.40  
1 1 1 9   3   6  o 17 574.51  63.37  10412.64  2055.41  10606.30 2906.73  10218.97  2906.85  550.82  95.38  538.17  97.69  12.65   136.53 
1 1 1 9   3   7  f 0  657.99  74.78  14160.21  2774.73  13349.23 3923.80  14971.40  3924.34  585.48  120.75 632.45  112.20 -46.96  164.83 
1 1 1 9   3   8  o 11 204.36  21.34  1225.23   246.69   1273.85  348.49   1176.40   349.26   206.24  30.34  197.62  31.87  8.62    44.00  
1 1 1 9   3   9  o 2  402.54  42.89  4938.44   975.83   5014.05  1379.88  4862.80   1380.20  392.96  63.32  386.03  64.56  6.93    90.43  
1 1 1 9   3   10 o 14 274.17  28.69  2235.04   444.91   2331.55  628.94   2138.36   629.46   275.34  41.04  262.53  43.27  12.82   59.64  
1 1 1 9   3   11 o 12 143.66  15.90  604.61    128.90   647.02   180.99   560.96    183.62   147.37  22.07  136.48  24.33  10.88   32.85  
1 1 1 9   3   12 o 8  303.59  30.29  2758.76   520.79   -224.89  732.18   5814.04   740.92   115.56  52.12  442.23  29.35  -326.67 59.82  
1 1 1 9   3   13 o 12 315.86  33.21  3008.82   593.26   2700.65  837.15   3319.72   840.85   289.17  52.36  324.92  46.40  -35.75  69.96  
1 1 1 9   3   14 o 17 325.29  52.83  3394.47   952.71   0.00     0.00     3394.47   952.71   ?       ?      325.29  52.83  0.00    52.83  
1 1 1 9   3   15 o 10 207.55  33.39  1313.15   384.37   0.00     0.00     1313.15   384.37   ?       ?      207.55  33.39  0.00    33.39  
1 1 1 9   3   16 o 19 182.34  20.13  980.09    207.18   1019.84  292.95   940.31    293.06   183.66  28.73  175.77  30.13  7.89    41.63  
1 1 1 9   3   17 o 10 84.52   16.77  214.76    78.48    169.51   109.16   263.18    112.91   75.68   23.05  92.96   21.57  -17.28  31.57  
1 1 1 9   3   18 o 2  294.93  31.97  2668.20   532.68   2735.48  752.56   2600.63   754.10   288.54  47.05  280.01  48.68  8.53    67.70  
1 1 1 9   3   19 f 0  139.33  25.11  597.20    193.44   597.20   193.44   0.00      0.00     139.33  25.11  ?       ?      0.00    25.11  
1 1 1 9   3   20 o 13 252.09  43.36  2131.40   604.81   2131.40  604.81   0.00      0.00     252.09  43.36  ?       ?      0.00    43.36  
1 1 1 9   3   21 o 19 287.60  32.41  2630.26   525.80   2663.25  743.64   2597.27   743.56   273.39  49.19  269.09  49.97  4.31    70.12  
1 1 1 9   3   22 o 2  211.78  23.86  1383.29   285.10   1382.58  403.59   1384.00   402.78   203.43  35.87  203.62  35.76  -0.19   50.65  
1 1 1 9   3   23 o 14 73.52   19.51  168.74    83.70    227.88   119.73   112.22    117.05   84.64   23.70  65.15   23.90  19.49   33.66  
1 1 1 9   3   24 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   3   25 o 16 217.46  25.66  1525.94   314.20   1564.07  445.74   1488.29   442.96   206.36  39.06  200.15  39.95  6.21    55.87  
1 1 1 9   3   26 o 16 116.43  19.42  427.26    125.25   373.92   180.92   476.34    173.55   103.61  29.18  119.12  26.10  -15.51  39.15  
1 1 1 9   3   27 o 16 74.72   21.20  183.02    95.12    143.19   139.15   217.96    130.32   69.45   25.95  80.39   25.31  -10.93  36.25  
1 1 1 9   4   0  x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   4   1  o 14 706.77  81.56  16510.13  3248.39  16364.11 4593.74  16656.16  4594.08  645.94  128.41 653.83  126.98 -7.89   180.58 
1 1 1 9   4   2  o 8  274.82  28.34  2227.42   440.71   2202.04  623.04   2252.84   623.48   269.18  41.66  272.51  41.13  -3.33   58.55  
1 1 1 9   4   3  o 13 169.15  17.62  835.55    168.62   793.54   237.50   878.26    239.43   163.08  26.26  172.04  24.97  -8.96   36.24  
1 1 1 9   4   4  o 2  213.43  22.01  1335.20   265.76   1298.30  375.45   1372.26   376.23   207.93  32.52  214.15  31.55  -6.22   45.31  
1 1 1 9   4   5  o 15 429.85  45.52  5608.35   1106.18  5610.90  1564.20  5605.81   1564.55  417.02  67.66  416.79  67.71  0.23    95.72  
1 1 1 9   4   6  o 9  161.76  17.30  764.91    158.19   785.88   223.81   743.98    223.60   162.50  24.78  157.84  25.55  4.66    35.59  
1 1 1 9   4   7  o 9  334.09  34.96  3337.56   660.52   3377.73  934.02   3297.37   934.23   328.98  51.12  324.59  51.88  4.39    72.83  
1 1 1 9   4   8  o 8  104.87  13.46  322.40    79.17    366.66   113.34   280.23    110.64   111.05  18.42  96.43   20.61  14.62   27.65  
1 1 1 9   4   9  o 13 221.92  23.09  1451.59   289.83   1384.42  409.68   1518.89   410.08   213.26  34.65  224.20  32.83  -10.94  47.74  
1 1 1 9   4   10 o 7  245.33  25.75  1784.18   357.28   1871.33  504.65   1696.61   505.89   247.49  36.62  234.54  38.94  12.96   53.46  
1 1 1 9   4   11 o 3  639.73  79.41  14505.68  2853.66  14271.91 4035.42  14739.51  4035.96  552.53  129.50 566.63  127.20 -14.10  181.52 
1 1 1 9   4   12 o 2  229.79  22.70  1558.91   295.52   -4.20    411.20   3228.68   425.00   95.00   41.09  331.56  22.46  -236.56 46.83  
1 1 1 9   4   13 o 6  187.95  29.93  1069.97   312.12   0.00     0.00     1069.97   312.12   ?       ?      187.95  29.93  0.00    29.93  
1 1 1 9   4   14 o 17 244.69  38.62  1845.02   524.54   0.00     0.00     1845.02   524.54   ?       ?      244.69  38.62  0.00    38.62  
1 1 1 9   4   15 o 14 294.13  47.35  2735.39   772.36   0.00     0.00     2735.39   772.36   ?       ?      294.13  47.35  0.00    47.35  
1 1 1 9   4   16 o 5  61.80   18.71  111.97    72.07    118.21   95.70    103.79    109.54   65.28   21.78  64.50   23.20  0.77    31.82  
1 1 1 9   4   17 o 7  114.08  16.38  386.00    104.21   393.04   140.30   377.32    155.63   113.76  22.28  110.83  25.05  2.93    33.53  
1 1 1 9   4   18 o 10 197.23  21.67  1161.83   241.27   1187.53  338.80   1135.39   343.66   195.52  31.24  190.47  32.60  5.05    45.15  
1 1 1 9   4   19 o 18 86.28   22.76  229.87    114.32   229.87   114.32   0.00      0.00     86.28   22.76  ?       ?      0.00    22.76  
1 1 1 9   4   20 o 1  210.25  35.52  1430.49   413.45   1430.49  413.45   0.00      0.00     210.25  35.52  ?       ?      0.00    35.52  
1 1 1 9   4   21 o 17 238.73  26.61  1768.55   358.44   1794.83  506.65   1742.23   507.19   230.64  39.70  226.50  40.49  4.14    56.71  
1 1 1 9   4   22 o 9  241.94  27.55  1849.47   375.78   1892.46  532.08   1806.69   530.80   232.36  41.41  225.84  42.50  6.51    59.34  
1 1 1 9   4   23 o 7  262.61  55.16  2848.71   805.12   2848.71  805.12   0.00      0.00     262.61  55.16  ?       ?      0.00    55.16  
1 1 1 9   4   24 x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   4   25 o 14 63.69   20.60  124.39    85.91    195.31   122.61   56.00     120.40   77.86   24.55  57.06   23.28  20.80   33.83  
1 1 1 9   4   26 o 12 99.66   20.13  318.49    111.21   222.33   159.14   410.25    155.47   81.90   28.08  110.59  25.07  -28.69  37.64  
1 1 1 9   4   27 o 17 102.83  20.44  343.97    116.43   301.73   163.38   387.57    165.98   92.10   28.23  104.84  27.31  -12.75  39.28  
1 1 1 9   5   0  o 6  266.50  27.67  2098.78   417.20   2153.04  589.68   2044.39   590.33   266.04  39.84  258.64  41.14  7.40    57.26  
1 1 1 9   5   1  o 11 300.66  31.12  2682.99   529.32   2619.42  748.20   2746.68   748.95   291.46  46.26  299.11  45.01  -7.66   64.55  
1 1 1 9   5   2  f 0  114.86  13.30  385.33    86.06    381.48   120.91   389.29    122.53   113.23  19.29  114.40  19.35  -1.17   27.32  
1 1 1 9   5   3  o 10 220.19  22.86  1424.29   284.79   1435.47  402.56   1413.09   402.94   218.40  33.15  216.56  33.49  1.84    47.12  
1 1 1 9   5   4  o 17 441.26  47.11  5960.96   1174.87  5929.55  1661.30  5992.39   1661.73  424.54  70.65  427.15  70.20  -2.61   99.60  
1 1 1 9   5   5  o 4  510.35  55.90  8170.34   1611.08  8190.92  2278.21  8149.75   2278.61  486.16  84.71  484.63  85.00  1.53    120.00 
1 1 1 9   5   6  o 2  245.06  25.43  1772.78   352.56   1759.71  497.83   1785.93   499.35   240.45  37.27  242.34  37.07  -1.89   52.57  
1 1 1 9   5   7  o 8  304.27  31.89  2765.07   548.82   2829.81  775.91   2700.25   776.39   301.68  46.28  293.91  47.65  7.77    66.42  
1 1 1 9   5   8  o 2  214.89  22.51  1360.86   273.53   1395.75  386.43   1325.82   387.23   214.80  32.34  208.90  33.42  5.91    46.50  
1 1 1 9   5   9  o 8  296.02  31.25  2625.17   523.08   2748.31  739.33   2501.75   740.16   296.75  44.79  281.53  47.49  15.22   65.28  
1 1 1 9   5   10 f 0  209.88  22.35  1300.94   265.12   1410.88  374.85   1190.92   375.01   215.97  31.13  196.99  34.41  18.98   46.41  
1 1 1 9   5   11 o 1  457.04  43.89  6469.04   1137.29  -72.36   1604.96  13066.51  1611.82  170.25  76.95  651.22  43.36  -480.97 88.32  
1 1 1 9   5   12 o 3  472.08  88.73  8303.69   2316.32  0.00     0.00     8303.69   2316.32  ?       ?      472.08  88.73  0.00    88.73  
1 1 1 9   5   13 o 13 59.94   21.89  85.56     98.03    0.00     0.00     85.56     98.03    ?       ?      59.94   21.89  0.00    21.89  
1 1 1 9   5   14 o 5  340.79  56.03  3772.25   1058.13  0.00     0.00     3772.25   1058.13  ?       ?      340.79  56.03  0.00    56.03  
1 1 1 9   5   15 o 6  345.12  36.83  3633.26   718.38   3529.83  1015.21  3736.98   1016.67  328.24  55.88  339.23  54.02  -10.99  77.72  
1 1 1 9   5   16 o 9  154.29  17.87  702.33    155.35   734.58   219.48   669.94    219.92   155.81  25.41  148.23  26.83  7.58    36.96  
1 1 1 9   5   17 o 18 321.78  35.22  3213.13   639.97   3347.60  904.74   3078.48   905.38   315.77  51.70  300.19  54.55  15.58   75.15  
1 1 1 9   5   18 f 0  174.35  29.33  945.29    283.15   945.29   283.15   0.00      0.00     174.35  29.33  ?       ?      0.00    29.33  
1 1 1 9   5   19 o 2  143.31  26.09  637.87    206.77   637.87   206.77   0.00      0.00     143.31  26.09  ?       ?      0.00    26.09  
1 1 1 9   5   20 o 13 366.62  100.12 7757.80   2166.18  7757.80  2166.18  0.00      0.00     366.62  100.12 ?       ?      0.00    100.12 
1 1 1 9   5   21 o 2  297.04  34.43  2883.33   576.17   2923.17  813.82   2843.28   815.83   277.91  52.94  272.58  54.05  5.33    75.66  
1 1 1 9   5   22 o 11 170.41  20.30  888.44    194.65   867.73   275.06   909.20    275.48   162.37  30.63  166.80  29.87  -4.43   42.78  
1 1 1 9   5   23 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   5   24 o 19 162.26  20.40  819.27    185.85   978.91   264.19   662.86    261.50   172.40  27.63  137.04  33.52  35.36   43.44  
1 1 1 9   5   25 o 5  124.12  18.97  481.80    130.90   455.04   180.09   511.77    190.59   115.64  27.53  122.70  27.71  -7.06   39.06  
1 1 1 9   5   26 o 11 57.96   21.21  94.00     92.05    96.67    126.65   91.01     134.01   62.25   24.38  62.38   24.87  -0.13   34.83  
1 1 1 9   5   27 o 6  119.12  20.36  460.70    134.22   399.61   189.15   522.66    190.50   103.93  30.02  121.14  27.96  -17.21  41.03  
1 1 1 9   6   0  o 8  321.66  33.70  3098.73   613.14   3129.20  866.72   3068.21   867.50   316.09  49.38  312.60  50.03  3.48    70.29  
1 1 1 9   6   1  o 11 148.21  15.81  642.13    132.44   587.29   185.64   698.99    189.01   140.00  23.96  153.46  22.09  -13.46  32.59  
1 1 1 9   6   2  o 14 400.91  42.66  4902.27   966.66   4868.79  1366.81  4935.77   1367.32  386.23  63.88  389.29  63.36  -3.06   89.97  
1 1 1 9   6   3  o 19 257.15  26.64  1956.83   387.63   1903.44  547.72   2010.41   548.67   249.20  39.61  256.71  38.41  -7.51   55.18  
1 1 1 9   6   4  o 16 370.78  38.94  4164.66   816.51   3922.61  1154.28  4407.08   1155.17  347.86  59.97  371.81  55.84  -23.95  81.94  
1 1 1 9   6   5  o 7  365.34  38.40  4044.11   793.33   3835.49  1121.66  4252.94   1122.20  344.08  58.90  365.03  55.28  -20.96  80.78  
1 1 1 9   6   6  o 8  344.77  36.53  3593.50   711.99   3650.37  1006.88  3536.64   1006.92  338.18  53.65  332.13  54.71  6.05    76.63  
1 1 1 9   6   7  o 14 320.58  33.83  3093.78   613.26   3126.28  867.01   3061.23   867.56   314.25  49.71  310.52  50.39  3.73    70.79  
1 1 1 9   6   8  o 5  378.76  40.73  4398.84   871.78   4496.41  1232.71  4301.23   1233.05  369.93  60.11  360.40  61.82  9.53    86.23  
1 1 1 9   6   9  o 7  607.04  73.18  12702.41  2498.92  12549.63 3533.65  12855.24  3534.36  537.14  117.84 546.81  116.18 -9.68   165.48 
1 1 1 9   6   10 o 19 309.07  49.78  3041.36   853.16   0.00     0.00     3041.36   853.16   ?       ?      309.07  49.78  0.00    49.78  
1 1 1 9   6   11 o 17 257.81  40.68  2058.92   582.17   0.00     0.00     2058.92   582.17   ?       ?      257.81  40.68  0.00    40.68  
1 1 1 9   6   12 o 11 221.29  34.96  1496.10   429.35   0.00     0.00     1496.10   429.35   ?       ?      221.29  34.96  0.00    34.96  
1 1 1 9   6   13 o 5  260.73  41.42  2111.68   599.29   0.00     0.00     2111.68   599.29   ?       ?      260.73  41.42  0.00    41.42  
1 1 1 9   6   14 o 14 159.32  18.38  747.41    165.05   766.72   234.52   728.46    232.32   159.31  26.58  155.05  27.09  4.26    37.95  
1 1 1 9   6   15 o 17 307.34  33.13  2873.84   575.27   3021.30  813.44   2726.29   813.68   306.39  47.81  288.72  50.95  17.67   69.87  
1 1 1 9   6   16 o 16 98.46   17.25  290.68    93.95    301.24   132.95   280.15    132.79   99.01   23.71  95.45   24.20  3.56    33.88  
1 1 1 9   6   17 o 13 345.59  65.05  4440.18   1243.26  4440.18  1243.26  0.00      0.00     345.59  65.05  ?       ?      0.00    65.05  
1 1 1 9   6   18 o 1  302.79  55.38  3297.77   927.11   3297.77  927.11   0.00      0.00     302.79  55.38  ?       ?      0.00    55.38  
1 1 1 9   6   19 o 11 140.10  25.30  610.32    196.01   610.32   196.01   0.00      0.00     140.10  25.30  ?       ?      0.00    25.30  
1 1 1 9   6   20 o 12 231.85  25.71  1663.70   336.48   1528.15  473.54   1801.92   478.21   211.45  40.49  232.97  36.99  -21.52  54.84  
1 1 1 9   6   21 o 7  246.98  28.19  1937.49   392.50   1860.49  552.61   2015.88   557.57   227.45  43.91  238.76  42.22  -11.31  60.92  
1 1 1 9   6   22 o 14 115.01  25.87  429.54    166.65   429.54   166.65   0.00      0.00     115.01  25.87  ?       ?      0.00    25.87  
1 1 1 9   6   23 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   6   24 o 7  168.89  21.27  897.70    201.70   815.25   280.09   986.51    290.69   151.87  33.07  169.36  31.04  -17.49  45.35  
1 1 1 9   6   25 o 6  44.72   19.15  8.87      87.58    31.76    124.08   -13.85    123.63   54.38   23.02  49.68   21.98  4.70    31.83  
1 1 1 9   6   26 o 4  103.62  19.88  347.25    113.92   480.60   160.08   210.42    162.16   119.39  24.19  79.14   28.26  40.25   37.19  
1 1 1 9   6   27 o 6  71.95   22.10  173.16    100.02   198.54   139.79   146.52    143.18   76.21   26.31  69.09   26.22  7.12    37.14  
1 1 1 9   7   0  o 17 205.06  21.47  1237.08   248.95   1134.73  348.96   1343.16   355.26   193.25  32.61  211.41  30.12  -18.16  44.40  
1 1 1 9   7   1  o 16 350.99  37.03  3724.92   734.91   3664.63  1038.90  3785.31   1039.74  338.03  55.46  344.30  54.41  -6.27   77.69  
1 1 1 9   7   2  f 0  98.08   13.33  282.72    73.13    275.41   100.05   291.10    107.16   95.79   18.87  98.41   19.66  -2.62   27.25  
1 1 1 9   7   3  f 0  139.69  15.70  571.50    123.73   622.56   173.32   518.43    176.70   144.68  21.52  131.14  24.37  13.55   32.51  
1 1 1 9   7   4  o 15 216.80  22.89  1386.97   280.60   1490.73  396.00   1282.33   397.67   222.12  31.98  204.67  35.11  17.45   47.49  
1 1 1 9   7   5  o 13 256.92  26.91  1960.46   391.03   1975.56  552.51   1945.31   553.48   253.32  39.26  251.15  39.71  2.17    55.84  
1 1 1 9   7   6  o 6  526.61  60.07  9016.05   1783.68  9267.64  2522.18  8764.33   2522.82  498.65  91.48  480.46  94.84  18.20   131.77 
1 1 1 9   7   7  o 12 564.17  65.68  10573.74  2087.31  10690.48 2951.66  10456.96  2952.16  520.97  102.35 513.01  103.81 7.96    145.78 
1 1 1 9   7   8  o 17 284.97  45.24  2542.48   715.44   0.00     0.00     2542.48   715.44   ?       ?      284.97  45.24  0.00    45.24  
1 1 1 9   7   9  o 10 169.23  27.42  862.72    257.22   0.00     0.00     862.72    257.22   ?       ?      169.23  27.42  0.00    27.42  
1 1 1 9   7   10 o 14 90.67   22.51  249.34    116.62   0.00     0.00     249.34    116.62   ?       ?      90.67   22.51  0.00    22.51  
1 1 1 9   7   11 o 16 160.24  27.01  774.58    239.64   0.00     0.00     774.58    239.64   ?       ?      160.24  27.01  0.00    27.01  
1 1 1 9   7   12 o 13 285.20  29.98  2434.21   483.47   2365.29  682.31   2503.70   685.16   274.45  44.85  283.19  43.54  -8.74   62.51  
1 1 1 9   7   13 o 18 264.67  28.05  2094.25   419.69   2115.93  592.60   2072.44   594.45   260.44  40.99  257.37  41.66  3.07    58.44  
1 1 1 9   7   14 o 4  136.46  16.88  549.52    129.43   621.27   179.77   472.27    186.52   143.82  22.51  123.92  26.98  19.90   35.14  
1 1 1 9   7   15 o 13 285.37  31.03  2486.92   500.22   2642.41  706.28   2330.42   708.55   285.74  44.51  265.47  48.27  20.27   65.66  
1 1 1 9   7   16 o 9  258.29  43.22  2188.32   618.18   2188.32  618.18   0.00      0.00     258.29  43.22  ?       ?      0.00    43.22  
1 1 1 9   7   17 o 3  144.74  26.38  650.12    211.10   650.12   211.10   0.00      0.00     144.74  26.38  ?       ?      0.00    26.38  
1 1 1 9   7   18 o 10 104.91  24.36  344.30    143.90   344.30   143.90   0.00      0.00     104.91  24.36  ?       ?      0.00    24.36  
1 1 1 9   7   19 o 17 148.03  18.53  659.42    153.99   717.49   218.44   602.06    217.11   151.31  26.09  137.27  28.49  14.04   38.63  
1 1 1 9   7   20 o 6  172.62  20.49  908.07    199.13   912.53   281.57   903.60    281.65   167.58  30.39  166.62  30.57  0.95    43.10  
1 1 1 9   7   21 o 10 235.59  27.21  1771.70   361.18   1768.40  511.38   1774.99   510.21   221.35  41.77  222.01  41.56  -0.65   58.93  
1 1 1 9   7   22 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   7   23 o 10 224.41  47.31  2044.30   590.20   0.00     0.00     2044.30   590.20   ?       ?      224.41  47.31  0.00    47.31  
1 1 1 9   7   24 o 9  72.35   21.74  168.34    97.52    173.74   127.00   160.58    152.23   73.99   25.09  73.50   27.21  0.50    37.01  
1 1 1 9   7   25 o 18 53.73   20.91  67.98     92.75    94.69    122.78   32.47     141.56   61.42   24.02  56.82   24.33  4.60    34.19  
1 1 1 9   7   26 o 10 141.29  21.11  652.29    165.98   665.04   227.31   637.74    242.94   134.51  30.18  128.85  32.77  5.66    44.55  
1 1 1 9   8   0  o 18 317.02  33.44  3005.28   599.39   3166.74  846.02   2842.57   849.33   319.29  47.61  300.54  51.05  18.74   69.81  
1 1 1 9   8   1  o 19 415.64  44.53  5291.07   1045.86  5342.45  1478.35  5239.59   1479.79  403.34  66.14  398.72  67.03  4.63    94.16  
1 1 1 9   8   2  o 6  316.85  33.22  3004.50   595.27   2951.35  839.95   3058.14   843.74   306.77  49.37  312.78  48.56  -6.02   69.25  
1 1 1 9   8   3  o 6  138.22  16.06  559.91    125.10   627.36   175.05   489.50    178.84   145.30  21.65  127.22  25.38  18.08   33.36  
1 1 1 9   8   4  o 4  296.55  46.86  2745.27   771.24   0.00     0.00     2745.27   771.24   ?       ?      296.55  46.86  0.00    46.86  
1 1 1 9   8   5  o 10 496.42  91.55  9010.46   2512.85  0.00     0.00     9010.46   2512.85  ?       ?      496.42  91.55  0.00    91.55  
1 1 1 9   8   6  o 18 265.16  41.61  2170.07   612.51   0.00     0.00     2170.07   612.51   ?       ?      265.16  41.61  0.00    41.61  
1 1 1 9   8   7  o 10 166.95  27.56  839.40    254.96   0.00     0.00     839.40    254.96   ?       ?      166.95  27.56  0.00    27.56  
1 1 1 9   8   8  f 0  266.76  42.16  2203.31   624.24   0.00     0.00     2203.31   624.24   ?       ?      266.76  42.16  0.00    42.16  
1 1 1 9   8   9  o 10 185.76  30.22  1044.41   311.17   0.00     0.00     1044.41   311.17   ?       ?      185.76  30.22  0.00    30.22  
1 1 1 9   8   10 o 13 204.45  32.59  1271.78   369.68   0.00     0.00     1271.78   369.68   ?       ?      204.45  32.59  0.00    32.59  
1 1 1 9   8   11 f 0  207.13  22.34  1268.60   261.47   1320.01  367.93   1216.14   371.64   208.37  31.76  199.16  33.71  9.21    46.31  
1 1 1 9   8   12 o 14 50.60   18.21  62.91     67.48    72.37    93.88    52.79     97.06    56.97   21.31  54.49   21.34  2.49    30.16  
1 1 1 9   8   13 o 18 261.95  28.37  2070.39   419.85   2214.93  592.51   1924.62   595.01   264.90  40.23  244.48  44.01  20.41   59.63  
1 1 1 9   8   14 o 19 377.15  72.32  5398.63   1508.78  5398.63  1508.78  0.00      0.00     377.15  72.32  ?       ?      0.00    72.32  
1 1 1 9   8   15 o 17 305.44  54.18  3261.92   915.19   3261.92  915.19   0.00      0.00     305.44  54.18  ?       ?      0.00    54.18  
1 1 1 9   8   16 o 1  112.02  22.04  385.49    136.69   385.49   136.69   0.00      0.00     112.02  22.04  ?       ?      0.00    22.04  
1 1 1 9   8   17 o 14 295.03  54.87  3187.15   895.16   3187.15  895.16   0.00      0.00     295.03  54.87  ?       ?      0.00    54.87  
1 1 1 9   8   18 o 1  170.27  19.96  875.50    191.44   970.72   267.36   775.33    274.23   175.82  27.38  154.40  31.99  21.41   42.11  
1 1 1 9   8   19 f 0  85.32   18.00  224.30    85.40    239.72   116.59   206.45    125.44   87.16   22.98  81.32   24.70  5.84    33.74  
1 1 1 9   8   20 o 11 108.91  17.13  361.50    103.56   286.12   141.49   448.51    152.00   94.08   25.54  119.09  23.07  -25.01  34.42  
1 1 1 9   8   21 o 11 168.31  20.28  874.77    192.01   854.42   269.95   895.61    273.17   159.60  30.58  163.80  30.16  -4.20   42.95  
1 1 1 9   8   22 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   8   23 o 14 264.88  34.17  2495.17   507.56   2649.26  718.71   2341.84   716.90   242.30  53.14  220.46  56.42  21.84   77.50  
1 1 1 9   8   24 o 19 141.19  20.24  634.83    159.34   573.37   226.48   695.06    224.22   125.58  31.48  141.34  28.62  -15.76  42.54  
1 1 1 9   8   25 o 19 165.10  22.35  896.81    206.36   962.57   291.03   830.31    292.65   160.17  32.76  145.14  35.44  15.03   48.26  
1 1 1 9   8   26 o 15 42.70   19.49  -42.45    106.12   -60.68   141.42   -18.95    160.56   48.03   22.13  54.16   24.42  -6.13   32.96  
1 1 1 9   9   0  o 17 338.37  54.39  3641.48   1020.79  0.00     0.00     3641.48   1020.79  ?       ?      338.37  54.39  0.00    54.39  
1 1 1 9   9   1  o 8  299.96  47.60  2808.81   792.24   0.00     0.00     2808.81   792.24   ?       ?      299.96  47.60  0.00    47.60  
1 1 1 9   9   2  o 5  187.89  30.80  1066.73   320.76   0.00     0.00     1066.73   320.76   ?       ?      187.89  30.80  0.00    30.80  
1 1 1 9   9   3  o 11 187.88  30.88  1067.17   321.51   0.00     0.00     1067.17   321.51   ?       ?      187.88  30.88  0.00    30.88  
1 1 1 9   9   4  o 14 297.45  47.33  2767.29   781.09   0.00     0.00     2767.29   781.09   ?       ?      297.45  47.33  0.00    47.33  
1 1 1 9   9   5  o 19 207.99  32.93  1312.35   380.12   0.00     0.00     1312.35   380.12   ?       ?      207.99  32.93  0.00    32.93  
1 1 1 9   9   6  o 15 106.19  15.57  333.01    92.11    342.42   126.22   322.28    134.71   106.60  21.37  103.06  23.32  3.53    31.63  
1 1 1 9   9   7  o 5  264.31  27.90  2079.90   416.93   2135.72  588.85   2023.80   590.40   263.00  40.28  255.25  41.73  7.75    58.00  
1 1 1 9   9   8  o 19 383.96  41.37  4538.08   897.46   4541.17  1268.42  4534.98   1269.97  369.56  61.98  369.19  62.12  0.37    87.76  
1 1 1 9   9   9  o 12 25.49   12.15  -64.62    49.18    -227.73  56.79    424.39    98.34    ?       ?      120.23  14.54  0.00    14.54  
1 1 1 9   9   10 o 1  208.14  20.57  1278.67   242.61   447.81   336.63   2176.57   349.95   122.34  40.85  271.38  22.67  -149.04 46.72  
1 1 1 9   9   11 o 12 393.48  43.47  4908.67   965.61   4738.40  1364.47  5079.49   1366.69  363.65  67.86  379.80  65.02  -16.15  93.98  
1 1 1 9   9   12 o 1  94.90   21.47  275.39    114.21   275.39   114.21   0.00      0.00     94.90   21.47  ?       ?      0.00    21.47  
1 1 1 9   9   13 o 6  221.93  36.27  1563.82   446.17   1563.82  446.17   0.00      0.00     221.93  36.27  ?       ?      0.00    36.27  
1 1 1 9   9   14 o 4  91.45   23.22  258.88    122.09   258.88   122.09   0.00      0.00     91.45   23.22  ?       ?      0.00    23.22  
1 1 1 9   9   15 o 11 229.34  38.64  1720.42   490.68   1720.42  490.68   0.00      0.00     229.34  38.64  ?       ?      0.00    38.64  
1 1 1 9   9   16 o 5  212.14  23.71  1371.17   283.86   1428.87  400.85   1313.14   402.01   210.30  34.39  200.19  36.32  10.11   50.02  
1 1 1 9   9   17 o 9  165.08  19.59  822.96    182.02   865.15   257.37   780.75    257.45   165.23  28.14  155.90  29.85  9.33    41.03  
1 1 1 9   9   18 f 0  401.40  57.51  6442.14   1287.35  6827.78  1820.37  6056.32   1820.81  337.79  91.59  302.96  94.48  34.82   131.59 
1 1 1 9   9   19 o 17 90.64   17.77  253.61    89.14    276.01   120.41   226.44    132.59   93.07   22.74  84.27   25.35  8.79    34.05  
1 1 1 9   9   20 o 3  81.68   18.69  209.14    85.71    174.66   109.61   263.38    137.48   74.57   23.17  89.90   25.48  -15.33  34.44  
1 1 1 9   9   21 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   9   22 o 9  115.91  28.54  462.45    188.64   0.00     0.00     462.45    188.64   ?       ?      115.91  28.54  0.00    28.54  
1 1 1 9   9   23 o 2  179.62  22.22  1039.53   224.25   1015.29  313.02   1065.09   321.41   166.19  33.96  170.19  34.09  -4.00   48.12  
1 1 1 9   9   24 o 1  146.20  20.07  687.04    164.03   672.69   226.77   702.77    237.55   136.30  29.81  138.54  30.68  -2.24   42.78  
1 1 1 9   9   25 o 1  50.68   20.64  50.01     94.40    23.88    123.05   87.38     147.16   52.20   22.53  62.10   25.58  -9.90   34.09  
1 1 1 9   10  0  o 1  204.90  22.05  1242.38   255.31   1285.18  360.43   1199.27   361.71   205.34  31.59  197.70  33.04  7.64    45.71  
1 1 1 9   10  1  o 6  146.50  17.21  631.62    141.95   698.13   198.59   562.15    202.98   152.64  23.41  135.75  27.00  16.90   35.73  
1 1 1 9   10  2  o 13 361.28  39.06  4011.12   797.14   4155.99  1127.04  3866.09   1127.62  355.25  57.21  340.38  59.89  14.87   82.82  
1 1 1 9   10  3  o 8  198.51  21.48  1164.62   240.93   1163.36  337.41   1165.93   344.13   195.44  31.12  195.43  31.76  0.01    44.47  
1 1 1 9   10  4  o 12 134.01  16.39  528.63    123.48   524.73   165.40   533.55    185.60   132.09  22.63  132.55  25.31  -0.46   33.95  
1 1 1 9   10  5  o 17 360.74  38.73  4008.13   789.60   3826.53  1114.67  4191.03   1118.68  337.58  59.70  356.09  56.62  -18.51  82.28  
1 1 1 9   10  6  o 18 354.57  38.07  3875.04   762.84   3667.54  1076.69  4084.18   1080.95  329.93  59.01  351.49  55.40  -21.55  80.95  
1 1 1 9   10  7  o 16 189.53  30.03  1097.39   315.87   1097.39  315.87   0.00      0.00     189.53  30.03  ?       ?      0.00    30.03  
1 1 1 9   10  8  o 17 331.57  56.81  3725.25   1042.42  3725.25  1042.42  0.00      0.00     331.57  56.81  ?       ?      0.00    56.81  
1 1 1 9   10  9  o 11 15.90   6.52   2.30      9.52     2.30     9.52     0.00      0.00     15.90   6.52   ?       ?      0.00    6.52   
1 1 1 9   10  10 o 4  375.14  71.97  5347.20   1493.46  5347.20  1493.46  0.00      0.00     375.14  71.97  ?       ?      0.00    71.97  
1 1 1 9   10  11 o 2  198.71  32.11  1234.72   353.83   1234.72  353.83   0.00      0.00     198.71  32.11  ?       ?      0.00    32.11  
1 1 1 9   10  12 o 4  190.82  31.23  1140.90   330.25   1140.90  330.25   0.00      0.00     190.82  31.23  ?       ?      0.00    31.23  
1 1 1 9   10  13 o 17 253.45  27.64  1972.36   395.70   1945.74  557.90   1999.30   561.33   242.36  41.60  246.04  41.20  -3.68   58.54  
1 1 1 9   10  14 o 7  132.94  16.55  526.59    123.56   499.16   172.00   555.84    177.61   126.76  24.52  134.15  23.94  -7.39   34.27  
1 1 1 9   10  15 o 5  103.41  16.17  321.59    92.87    251.82   126.70   402.60    136.52   89.61   24.11  114.22  21.61  -24.61  32.38  
1 1 1 9   10  16 o 11 107.95  16.37  351.33    98.28    353.52   132.66   348.66    146.32   106.30  22.44  104.83  24.72  1.47    33.39  
1 1 1 9   10  17 o 3  224.64  25.53  1581.58   323.44   1596.50  455.82   1566.44   459.03   215.20  38.30  212.40  39.09  2.80    54.72  
1 1 1 9   10  18 o 6  76.73   19.79  184.93    87.76    217.41   122.27   150.41    126.04   82.58   24.22  71.65   24.97  10.93   34.79  
1 1 1 9   10  19 o 17 224.73  26.45  1624.50   334.70   1694.07  471.55   1553.86   475.16   216.44  39.40  204.26  41.93  12.18   57.54  
1 1 1 9   10  20 o 8  170.88  20.59  910.98    197.93   877.21   276.72   946.36    283.21   159.82  31.28  166.60  30.74  -6.79   43.86  
1 1 1 9   10  21 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   10  22 o 10 76.83   21.34  193.24    97.45    189.04   134.53   197.87    141.34   76.08   25.82  77.59   26.47  -1.51   36.98  
1 1 1 9   10  23 o 16 90.07   20.58  267.15    104.05   235.35   135.65   312.61    162.18   82.46   25.80  93.33   28.03  -10.87  38.09  
1 1 1 9   10  24 o 11 60.14   21.29  111.36    91.90    100.77   119.75   126.53    143.34   60.91   23.75  66.29   25.94  -5.38   35.17  
1 1 1 9   11  0  o 15 162.42  26.82  804.56    241.37   804.56   241.37   0.00      0.00     162.42  26.82  ?       ?      0.00    26.82  
1 1 1 9   11  1  o 7  211.67  34.01  1393.27   399.21   1393.27  399.21   0.00      0.00     211.67  34.01  ?       ?      0.00    34.01  
1 1 1 9   11  2  o 11 122.33  23.34  455.73    157.94   455.73   157.94   0.00      0.00     122.33  23.34  ?       ?      0.00    23.34  
1 1 1 9   11  3  o 14 271.52  44.72  2387.88   672.76   2387.88  672.76   0.00      0.00     271.52  44.72  ?       ?      0.00    44.72  
1 1 1 9   11  4  o 19 58.40   21.59  80.06     95.84    80.06    95.84    0.00      0.00     58.40   21.59  ?       ?      0.00    21.59  
1 1 1 9   11  5  o 13 205.80  33.28  1318.98   379.71   1318.98  379.71   0.00      0.00     205.80  33.28  ?       ?      0.00    33.28  
1 1 1 9   11  6  o 14 253.09  41.44  2062.53   581.27   2062.53  581.27   0.00      0.00     253.09  41.44  ?       ?      0.00    41.44  
1 1 1 9   11  7  o 2  332.30  59.70  3921.12   1096.92  3921.12  1096.92  0.00      0.00     332.30  59.70  ?       ?      0.00    59.70  
1 1 1 9   11  8  x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   11  9  o 5  ?       ?      -258.83   66.26    -387.28  83.06    -34.09    109.87   ?       ?      46.48   20.63  0.00    20.63  
1 1 1 9   11  10 o 17 110.31  15.28  361.60    94.14    368.99   125.56   352.11    142.27   110.03  20.64  106.60  23.85  3.43    31.54  
1 1 1 9   11  11 o 1  84.01   16.42  213.66    76.35    230.86   100.13   189.77    118.00   86.59   20.47  79.05   23.95  7.54    31.50  
1 1 1 9   11  12 o 15 245.48  26.93  1855.85   373.30   1862.00  526.51   1849.64   529.37   236.65  40.19  235.52  40.62  1.14    57.14  
1 1 1 9   11  13 o 18 80.48   17.07  197.90    76.43    210.95   101.10   180.49    116.76   82.43   21.23  77.03   23.91  5.40    31.98  
1 1 1 9   11  14 o 4  140.62  17.17  593.30    135.75   548.33   184.58   646.28    200.35   131.93  25.29  143.52  25.24  -11.60  35.73  
1 1 1 9   11  15 o 2  193.45  22.11  1149.08   241.11   1184.68  338.24   1112.31   343.80   190.00  32.16  182.64  34.04  7.36    46.83  
1 1 1 9   11  16 o 6  56.21   18.87  90.71     71.82    105.80   93.68    69.20     111.85   61.48   21.52  58.19   22.87  3.29    31.41  
1 1 1 9   11  17 o 7  43.05   17.92  17.44     73.23    72.10    91.95    -77.37    121.10   55.32   21.00  44.47   20.49  10.85   29.34  
1 1 1 9   11  18 o 1  201.98  23.84  1292.67   271.08   1336.98  379.06   1246.28   387.83   195.53  35.06  186.14  37.59  9.39    51.40  
1 1 1 9   11  19 o 9  226.98  26.88  1688.25   343.44   1635.49  481.49   1742.90   490.03   206.14  42.11  213.93  41.40  -7.79   59.05  
1 1 1 9   11  20 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   11  21 f 0  139.14  30.47  691.79    236.61   0.00     0.00     691.79    236.61   ?       ?      139.14  30.47  0.00    30.47  
1 1 1 9   11  22 o 18 149.46  21.45  729.41    178.79   841.24   247.98   608.35    258.01   153.24  29.26  123.84  34.84  29.41   45.49  
1 1 1 9   11  23 o 4  103.25  20.52  352.77    117.36   280.87   161.04   434.19    171.37   87.53   28.20  109.49  27.35  -21.96  39.28  
1 1 1 9   12  0  o 8  133.37  16.61  527.41    124.44   464.79   170.54   598.72    181.99   122.70  25.06  140.21  23.44  -17.51  34.31  
1 1 1 9   12  1  o 8  90.98   17.18  249.74    86.43    240.27   112.74   263.24    134.62   88.38   22.24  92.31   24.85  -3.93   33.35  
1 1 1 9   12  2  o 17 283.57  31.10  2478.53   497.92   2597.74  702.98   2358.50   705.37   280.34  45.22  264.57  48.22  15.77   66.10  
1 1 1 9   12  3  o 19 178.92  20.02  954.11    202.08   987.58   283.23   919.41    288.40   178.83  28.55  171.65  30.38  7.18    41.69  
1 1 1 9   12  4  o 5  147.31  17.64  644.52    146.21   684.88   203.36   601.33    210.35   149.73  24.51  139.13  27.31  10.60   36.69  
1 1 1 9   12  5  o 3  88.30   16.62  235.19    81.17    252.83   112.15   215.80    117.62   90.60   21.82  83.85   23.50  6.75    32.07  
1 1 1 9   12  6  o 16 105.64  16.82  334.47    98.61    362.70   133.57   300.66    146.19   108.67  22.16  98.22   25.65  10.45   33.90  
1 1 1 9   12  7  f 0  192.88  21.67  1118.33   235.82   1178.15  329.28   1055.35   337.88   193.94  30.59  181.83  33.61  12.11   45.44  
1 1 1 9   12  8  o 10 102.03  25.26  325.94    147.17   0.00     0.00     325.94    147.17   ?       ?      102.03  25.26  0.00    25.26  
1 1 1 9   12  9  o 3  153.82  18.19  707.29    157.55   783.47   213.73   616.62    233.15   159.78  24.05  138.96  30.10  20.82   38.52  
1 1 1 9   12  10 o 14 166.53  29.09  877.43    268.02   0.00     0.00     877.43    268.02   ?       ?      166.53  29.09  0.00    29.09  
1 1 1 9   12  11 o 13 235.35  26.74  1721.14   354.89   1954.23  499.95   1484.40   503.85   243.06  37.00  205.70  44.00  37.36   57.49  
1 1 1 9   12  12 o 12 227.02  25.36  1599.25   324.91   1632.72  457.03   1565.06   461.99   220.30  37.48  214.35  38.98  5.95    54.08  
1 1 1 9   12  13 o 2  310.51  37.04  3249.18   647.27   3285.42  913.97   3212.72   916.80   284.21  57.98  279.36  59.02  4.85    82.74  
1 1 1 9   12  14 o 9  180.70  21.10  1003.22   214.76   1084.08  299.40   917.52    308.24   182.51  29.59  164.77  33.72  17.74   44.86  
1 1 1 9   12  15 o 17 73.99   18.21  170.81    76.82    183.35   97.87    150.68    123.99   76.25   21.46  71.50   24.77  4.75    32.77  
1 1 1 9   12  16 o 13 93.29   17.72  269.65    91.41    253.83   119.28   292.17    142.29   88.72   23.17  94.43   25.61  -5.71   34.54  
1 1 1 9   12  17 o 9  87.62   18.02  240.15    87.61    244.25   116.19   234.75    133.37   86.76   22.97  84.72   25.41  2.04    34.25  
1 1 1 9   12  18 o 19 92.92   18.33  271.49    94.29    249.19   125.26   300.66    143.23   86.88   24.21  94.76   25.69  -7.88   35.30  
1 1 1 9   12  19 o 9  246.33  31.23  2120.89   431.67   2162.23  606.81   2078.52   614.21   221.82  48.97  213.97  50.77  7.85    70.54  
1 1 1 9   12  20 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   12  21 o 16 184.94  23.48  1141.24   243.71   1104.93  339.37   1179.91   350.21   166.42  36.53  172.15  36.57  -5.72   51.69  
1 1 1 9   12  22 o 16 78.92   27.42  219.81    151.92   0.00     0.00     219.81    151.92   ?       ?      78.92   27.42  0.00    27.42  
1 1 1 9   13  0  o 6  146.13  17.65  637.42    145.03   626.29   199.70   649.84    210.98   142.04  25.42  144.34  26.44  -2.30   36.68  
1 1 1 9   13  1  o 6  170.65  19.83  874.14    190.64   933.26   263.48   809.19    276.18   173.16  27.42  159.17  31.34  13.99   41.64  
1 1 1 9   13  2  o 2  384.12  46.79  5058.49   1010.53  5364.32  1427.64  4751.41   1430.57  359.72  71.65  328.73  77.14  30.99   105.29 
1 1 1 9   13  3  f 0  194.12  21.69  1137.69   237.58   1162.83  333.36   1111.73   338.69   191.38  31.43  186.24  32.88  5.15    45.49  
1 1 1 9   13  4  o 15 217.11  24.27  1437.98   297.28   1567.52  418.89   1306.53   421.96   220.80  34.15  198.47  38.42  22.33   51.41  
1 1 1 9   13  5  o 15 147.59  18.06  652.37    149.85   676.32   208.53   626.80    215.48   147.42  25.57  140.93  27.62  6.49    37.64  
1 1 1 9   13  6  o 11 98.53   17.22  294.09    93.88    304.21   127.13   281.95    139.22   98.70   22.88  94.62   25.19  4.08    34.03  
1 1 1 9   13  7  o 11 129.57  16.82  502.85    122.14   707.84   163.49   243.91    183.74   153.29  18.98  89.67   30.18  63.62   35.65  
1 1 1 9   13  8  o 2  ?       ?      -271.40   58.88    -429.87  65.76    369.96    132.29   ?       ?      109.12  21.88  0.00    21.88  
1 1 1 9   13  9  o 7  310.33  36.28  3189.19   634.10   3135.73  893.91   3243.33   899.61   282.04  57.17  288.03  56.43  -5.98   80.33  
1 1 1 9   13  10 f 0  191.71  22.06  1126.96   238.33   1099.44  330.12   1156.93   344.43   182.77  32.66  187.15  33.28  -4.37   46.63  
1 1 1 9   13  11 o 12 259.76  51.69  2608.47   743.75   0.00     0.00     2608.47   743.75   ?       ?      259.76  51.69  0.00    51.69  
1 1 1 9   13  12 o 5  204.64  23.37  1302.51   269.67   1331.64  378.28   1272.40   384.54   198.59  34.43  192.63  36.10  5.96    49.89  
1 1 1 9   13  13 o 1  225.70  26.31  1622.86   334.52   1759.57  471.01   1483.71   475.19   224.01  37.98  200.64  42.58  23.38   57.06  
1 1 1 9   13  14 o 17 155.65  19.38  745.29    169.40   850.50   234.20   629.86    245.33   162.36  26.01  135.43  32.06  26.93   41.28  
1 1 1 9   13  15 o 6  183.62  21.40  1053.82   221.32   1031.27  308.46   1077.75   317.75   173.28  32.19  176.97  32.47  -3.70   45.73  
1 1 1 9   13  16 o 6  97.41   17.76  295.85    95.67    348.77   122.99   214.78    152.23   104.36  21.25  81.47   27.47  22.90   34.73  
1 1 1 9   13  17 o 7  110.50  17.72  380.66    108.58   387.45   142.04   371.12    168.41   108.47  23.49  103.76  27.74  4.71    36.35  
1 1 1 9   13  18 o 6  102.43  18.61  333.19    105.39   295.91   137.77   385.78    163.62   93.13   25.17  105.41  26.94  -12.28  36.87  
1 1 1 9   13  19 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 9   13  20 o 6  88.20   27.55  280.43    154.72   0.00     0.00     280.43    154.72   ?       ?      88.20   27.55  0.00    27.55  
1 1 1 9   14  0  o 4  197.27  22.18  1184.89   246.89   1190.32  344.66   1179.18   353.82   191.84  32.45  190.15  33.64  1.69    46.74  
1 1 1 9   14  1  o 5  102.20  17.81  317.55    100.70   322.26   132.48   311.10    154.96   101.35  23.26  98.84   26.69  2.50    35.41  
1 1 1 9   14  2  o 2  178.95  20.73  970.77    208.99   996.64   288.50   942.20    303.17   176.84  29.45  170.25  32.20  6.59    43.64  
1 1 1 9   14  3  f 0  141.96  18.06  606.75    143.83   663.39   196.47   541.35    211.13   145.97  24.30  129.50  29.11  16.47   37.92  
1 1 1 9   14  4  o 10 199.00  22.57  1211.43   253.33   1228.49  353.67   1193.45   363.04   194.09  32.92  190.13  34.53  3.95    47.71  
1 1 1 9   14  5  o 12 75.74   18.79  177.57    81.32    216.21   106.32   123.07    126.25   83.10   21.96  68.21   24.86  14.89   33.17  
1 1 1 9   14  6  o 6  69.70   18.82  150.01    77.04    190.54   101.22   94.19     118.78   78.15   21.76  63.03   23.89  15.11   32.31  
1 1 1 9   14  7  o 15 28.39   12.42  -7.84     38.52    -46.48   40.45    368.70    126.28   23.73   11.23  108.91  20.96  -85.18  23.77  
1 1 1 9   14  8  o 7  146.80  18.50  653.87    152.49   744.62   209.26   551.11    222.67   153.89  24.51  128.98  30.55  24.91   39.16  
1 1 1 9   14  9  o 8  110.03  17.72  369.81    108.15   389.99   142.44   342.34    166.19   110.95  23.12  102.32  27.64  8.63    36.04  
1 1 1 9   14  10 o 7  185.78  22.18  1070.52   231.85   1105.67  321.31   1032.35   334.87   182.06  31.91  173.51  34.83  8.55    47.24  
1 1 1 9   14  11 o 13 88.59   19.79  246.79    98.11    269.04   124.18   209.83    160.03   91.41   23.53  82.18   28.16  9.23    36.69  
1 1 1 9   14  12 o 13 162.14  20.52  815.35    186.70   857.94   254.23   765.50    275.06   161.14  28.53  148.69  33.08  12.45   43.68  
1 1 1 9   14  13 o 14 112.84  17.56  392.50    110.07   413.04   143.61   363.25    171.35   113.31  22.87  103.70  28.09  9.60    36.22  
1 1 1 9   14  14 o 2  213.16  43.86  1796.41   518.78   0.00     0.00     1796.41   518.78   ?       ?      213.16  43.86  0.00    43.86  
1 1 1 9   14  15 o 7  149.00  31.08  781.56    257.28   0.00     0.00     781.56    257.28   ?       ?      149.00  31.08  0.00    31.08  
1 1 1 9   14  16 o 16 122.96  29.13  533.99    202.41   0.00     0.00     533.99    202.41   ?       ?      122.96  29.13  0.00    29.13  
1 1 1 9   14  17 o 5  163.85  34.78  1021.06   316.98   0.00     0.00     1021.06   316.98   ?       ?      163.85  34.78  0.00    34.78  
1 1 1 9   14  18 o 8  80.76   27.39  226.79    151.31   0.00     0.00     226.79    151.31   ?       ?      80.76   27.39  0.00    27.39  
1 1 1 9   15  0  o 13 155.70  30.16  792.28    259.88   0.00     0.00     792.28    259.88   ?       ?      155.70  30.16  0.00    30.16  
1 1 1 9   15  1  o 11 97.53   26.27  306.60    150.38   0.00     0.00     306.60    150.38   ?       ?      97.53   26.27  0.00    26.27  
1 1 1 9   15  2  o 19 59.84   24.49  53.43     133.69   0.00     0.00     53.43     133.69   ?       ?      59.84   24.49  0.00    24.49  
1 1 1 9   15  3  o 8  71.75   26.18  140.46    140.14   0.00     0.00     140.46    140.14   ?       ?      71.75   26.18  0.00    26.18  
1 1 1 9   15  4  o 12 118.62  27.50  458.43    183.57   0.00     0.00     458.43    183.57   ?       ?      118.62  27.50  0.00    27.50  
1 1 1 9   15  5  o 16 63.79   25.01  87.84     133.38   0.00     0.00     87.84     133.38   ?       ?      63.79   25.01  0.00    25.01  
1 1 1 9   15  6  o 7  93.11   25.84  280.90    142.97   0.00     0.00     280.90    142.97   ?       ?      93.11   25.84  0.00    25.84  
1 1 1 9   15  7  o 2  90.80   26.69  268.14    148.36   0.00     0.00     268.14    148.36   ?       ?      90.80   26.69  0.00    26.69  
1 1 1 9   15  8  o 6  170.17  32.62  984.93    307.06   0.00     0.00     984.93    307.06   ?       ?      170.17  32.62  0.00    32.62  
1 1 1 9   15  9  o 7  70.12   25.65  138.15    134.67   0.00     0.00     138.15    134.67   ?       ?      70.12   25.65  0.00    25.65  
1 1 1 9   15  10 o 18 177.53  34.90  1113.19   342.97   0.00     0.00     1113.19   342.97   ?       ?      177.53  34.90  0.00    34.90  
1 1 1 9   15  11 o 17 61.92   25.74  59.55     150.94   0.00     0.00     59.55     150.94   ?       ?      61.92   25.74  0.00    25.74  
1 1 1 9   15  12 o 7  83.75   28.99  230.73    169.78   0.00     0.00     230.73    169.78   ?       ?      83.75   28.99  0.00    28.99  
1 1 1 9   15  13 o 8  98.89   29.31  343.94    178.25   0.00     0.00     343.94    178.25   ?       ?      98.89   29.31  0.00    29.31  
1 1 1 9   15  14 o 10 81.39   28.52  221.57    164.56   0.00     0.00     221.57    164.56   ?       ?      81.39   28.52  0.00    28.52  
1 1 1 9   15  15 o 5  87.80   26.95  268.29    148.82   0.00     0.00     268.29    148.82   ?       ?      87.80   26.95  0.00    26.95  
1 1 1 9   16  1  o 4  81.89   19.43  210.71    89.93    233.99   110.64   165.39    154.40   85.62   22.29  75.82   27.51  9.79    35.41  
1 1 1 9   16  2  o 2  135.78  18.66  565.65    141.61   641.16   190.24   471.80    212.08   141.78  24.24  117.74  30.97  24.04   39.33  
1 1 1 9   16  3  o 9  116.76  17.95  418.84    116.46   377.98   152.40   476.20    180.56   107.71  25.11  120.31  26.83  -12.60  36.75  
1 1 1 9   16  4  f 0  80.94   27.99  203.82    158.24   0.00     0.00     203.82    158.24   ?       ?      80.94   27.99  0.00    27.99  
1 1 1 9   16  5  o 1  119.42  18.34  440.27    121.70   451.94   159.17   423.85    188.84   118.13  24.28  111.84  29.13  6.29    37.92  
1 1 1 9   16  6  o 1  27.22   13.10  -86.60    60.26    -223.63  64.59    834.08    167.42   21.08   10.67  165.15  17.95  -144.07 20.88  
1 1 1 9   16  7  o 6  177.09  22.00  988.74    218.86   1078.46  299.94   886.59    320.06   178.31  30.39  156.01  36.41  22.30   47.42  
1 1 1 9   16  8  o 4  167.59  33.98  997.92    315.76   0.00     0.00     997.92    315.76   ?       ?      167.59  33.98  0.00    33.98  
1 1 1 9   16  9  o 6  121.35  19.25  461.80    129.64   603.55   173.19   281.17    195.50   136.89  22.84  90.89   31.12  45.99   38.61  
1 1 1 9   16  10 o 7  60.64   24.62  72.35     133.95   0.00     0.00     72.35     133.95   ?       ?      60.64   24.62  0.00    24.62  
1 1 1 10  -15 0  o 11 122.31  21.08  480.19    142.65   331.69   179.62   733.83    234.74   97.01   29.57  145.51  29.12  -48.49  41.50  
1 1 1 10  -15 1  o 17 61.70   21.70  112.14    95.35    83.15    110.94   194.06    186.48   58.84   22.88  79.47   29.97  -20.62  37.71  
1 1 1 10  -14 0  o 18 152.14  28.65  777.65    241.02   777.65   241.02   0.00      0.00     152.14  28.65  ?       ?      0.00    28.65  
1 1 1 10  -14 1  o 6  138.08  19.94  595.20    153.50   467.37   199.65   779.99    240.06   116.62  29.73  152.63  28.44  -36.01  41.15  
1 1 1 10  -14 2  o 1  120.30  19.84  453.43    132.22   352.06   168.58   615.46    213.14   102.03  27.96  135.30  28.35  -33.27  39.82  
1 1 1 10  -14 3  o 5  89.91   20.32  257.50    102.39   247.25   124.18   279.26    180.93   86.94   24.06  91.28   29.92  -4.34   38.40  
1 1 1 10  -14 4  o 14 228.82  27.26  1715.68   351.03   1619.95  492.75   1814.32   500.18   204.20  43.38  219.28  41.25  -15.08  59.86  
1 1 1 10  -14 5  o 2  164.54  20.40  844.50    188.54   756.41   259.72   942.64    274.14   147.80  31.57  167.08  29.67  -19.28  43.32  
1 1 1 10  -14 6  o 15 93.74   18.70  275.94    97.10    200.43   128.12   377.84    148.83   78.91   25.12  107.22  24.69  -28.31  35.22  
1 1 1 10  -14 7  o 11 120.97  18.14  452.56    122.06   378.11   163.12   547.31    184.01   106.25  26.76  128.99  25.75  -22.74  37.14  
1 1 1 10  -13 0  x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 10  -13 1  o 11 239.88  47.34  2208.94   628.80   2208.94  628.80   0.00      0.00     239.88  47.34  ?       ?      0.00    47.34  
1 1 1 10  -13 2  o 9  179.22  32.49  1080.28   321.95   1080.28  321.95   0.00      0.00     179.22  32.49  ?       ?      0.00    32.49  
1 1 1 10  -13 3  o 19 67.64   19.88  141.76    82.26    153.55   120.42   131.44    112.64   71.73   24.43  67.54   23.60  4.19    33.97  
1 1 1 10  -13 4  o 16 222.38  25.27  1563.23   316.86   1619.09  446.66   1506.65   449.56   215.35  37.49  205.57  39.53  9.78    54.48  
1 1 1 10  -13 5  o 18 51.16   18.57  67.43     70.42    38.14    91.67    109.58    109.98   50.15   20.37  63.74   23.20  -13.59  30.87  
1 1 1 10  -13 6  o 3  59.52   21.60  94.57     95.21    94.57    95.21    0.00      0.00     59.52   21.60  ?       ?      0.00    21.60  
1 1 1 10  -13 7  o 13 248.79  29.11  2020.66   407.88   2007.90  575.64   2033.53   578.02   229.90  45.23  231.56  45.10  -1.66   63.87  
1 1 1 10  -13 8  o 10 138.23  18.86  587.72    145.73   452.12   200.06   740.99    212.71   115.51  29.93  151.78  25.30  -36.26  39.19  
1 1 1 10  -13 9  f 0  83.91   23.21  227.00    115.57   227.00   115.57   0.00      0.00     83.91   23.21  ?       ?      0.00    23.21  
1 1 1 10  -13 10 o 17 272.08  73.52  4184.60   1175.42  0.00     0.00     4184.60   1175.42  ?       ?      272.08  73.52  0.00    73.52  
1 1 1 10  -12 0  o 15 255.06  49.38  2450.19   696.91   0.00     0.00     2450.19   696.91   ?       ?      255.06  49.38  0.00    49.38  
1 1 1 10  -12 1  o 15 173.23  20.51  915.63    200.04   901.78   277.05   930.72    289.13   166.56  30.08  168.68  31.00  -2.12   43.20  
1 1 1 10  -12 2  o 4  151.50  18.81  695.72    160.11   715.11   220.93   674.27    232.38   149.86  26.66  144.13  29.09  5.74    39.46  
1 1 1 10  -12 3  o 7  67.86   21.26  139.42    92.07    139.42   92.07    0.00      0.00     67.86   21.26  ?       ?      0.00    21.26  
1 1 1 10  -12 4  f 0  74.96   21.77  174.61    99.19    174.61   99.19    0.00      0.00     74.96   21.77  ?       ?      0.00    21.77  
1 1 1 10  -12 5  o 11 128.45  16.87  497.24    121.41   497.88   165.87   496.52    178.19   125.73  23.85  124.72  25.74  1.02    35.09  
1 1 1 10  -12 6  o 15 100.05  16.68  304.27    92.46    239.41   124.20   384.90    138.47   86.85   24.08  110.66  22.56  -23.81  33.00  
1 1 1 10  -12 7  f 0  134.46  16.97  545.13    128.11   616.20   177.77   468.35    184.77   140.55  22.81  120.15  27.40  20.40   35.65  
1 1 1 10  -12 8  o 17 125.86  16.86  478.64    118.78   475.46   162.81   482.26    173.69   122.50  24.01  122.72  25.49  -0.22   35.02  
1 1 1 10  -12 9  x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 10  -12 10 o 4  77.56   18.29  187.45    80.08    152.03   108.06   230.58    119.26   70.77   23.12  84.98   23.60  -14.21  33.04  
1 1 1 10  -12 11 o 2  108.83  25.98  386.69    160.06   0.00     0.00     386.69    160.06   ?       ?      108.83  25.98  0.00    25.98  
1 1 1 10  -12 12 o 7  255.61  55.42  2792.71   789.75   0.00     0.00     2792.71   789.75   ?       ?      255.61  55.42  0.00    55.42  
1 1 1 10  -12 13 o 9  175.92  32.84  1059.25   319.49   0.00     0.00     1059.25   319.49   ?       ?      175.92  32.84  0.00    32.84  
1 1 1 10  -11 0  o 11 221.72  38.78  1643.56   475.62   0.00     0.00     1643.56   475.62   ?       ?      221.72  38.78  0.00    38.78  
1 1 1 10  -11 1  o 3  138.95  26.94  609.30    207.16   0.00     0.00     609.30    207.16   ?       ?      138.95  26.94  0.00    26.94  
1 1 1 10  -11 2  o 7  167.19  19.20  840.44    180.93   785.98   256.46   894.41    255.29   156.98  29.54  168.89  27.26  -11.90  40.20  
1 1 1 10  -11 3  o 12 338.60  40.19  3834.38   766.07   3535.58  1082.89  4133.73   1083.88  291.81  66.17  325.49  60.22  -33.68  89.47  
1 1 1 10  -11 4  o 8  163.46  27.76  842.76    251.21   842.76   251.21   0.00      0.00     163.46  27.76  ?       ?      0.00    27.76  
1 1 1 10  -11 5  o 14 268.74  49.64  2620.24   737.63   2620.24  737.63   0.00      0.00     268.74  49.64  ?       ?      0.00    49.64  
1 1 1 10  -11 6  f 0  77.25   21.21  185.11    96.92    185.11   96.92    0.00      0.00     77.25   21.21  ?       ?      0.00    21.21  
1 1 1 10  -11 7  o 12 166.16  19.42  834.00    181.76   718.53   255.85   951.66    258.26   148.60  31.00  174.04  26.70  -25.44  40.91  
1 1 1 10  -11 8  o 6  167.99  29.05  902.96    269.98   902.96   269.98   0.00      0.00     167.99  29.05  ?       ?      0.00    29.05  
1 1 1 10  -11 9  f 0  133.05  24.82  557.53    182.61   0.00     0.00     557.53    182.61   ?       ?      133.05  24.82  0.00    24.82  
1 1 1 10  -11 10 o 13 131.98  16.85  524.04    124.75   537.86   174.72   509.67    178.17   130.77  24.16  126.68  25.39  4.09    35.05  
1 1 1 10  -11 11 o 2  205.92  23.39  1311.89   271.62   1248.18  383.35   1376.12   384.92   191.80  36.14  203.17  34.22  -11.37  49.77  
1 1 1 10  -11 12 o 4  147.03  17.95  654.67    148.35   706.83   208.50   601.19    211.13   149.32  25.22  136.03  27.97  13.29   37.66  
1 1 1 10  -11 13 o 10 220.60  40.96  1743.81   499.61   0.00     0.00     1743.81   499.61   ?       ?      220.60  40.96  0.00    40.96  
1 1 1 10  -11 14 o 10 176.60  32.15  1051.54   313.89   0.00     0.00     1051.54   313.89   ?       ?      176.60  32.15  0.00    32.15  
1 1 1 10  -11 15 o 18 79.15   18.87  196.81    84.55    199.77   121.09   193.99    118.10   79.21   24.31  78.16   24.01  1.05    34.17  
1 1 1 10  -10 0  o 17 473.85  62.59  8402.97   1660.98  8185.67  2349.20  8620.19   2348.77  388.89  103.44 406.43  101.09 -17.54  144.63 
1 1 1 10  -10 1  o 2  243.00  26.44  1802.24   362.89   1768.39  512.95   1836.16   513.47   232.37  39.89  237.48  39.02  -5.10   55.80  
1 1 1 10  -10 2  o 8  143.22  24.54  630.50    194.53   0.00     0.00     630.50    194.53   ?       ?      143.22  24.54  0.00    24.54  
1 1 1 10  -10 3  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 10  -10 4  o 16 148.44  25.45  680.12    209.04   0.00     0.00     680.12    209.04   ?       ?      148.44  25.45  0.00    25.45  
1 1 1 10  -10 5  o 13 161.80  27.28  813.82    244.38   0.00     0.00     813.82    244.38   ?       ?      161.80  27.28  0.00    27.28  
1 1 1 10  -10 6  o 18 127.12  23.10  497.35    162.38   497.35   162.38   0.00      0.00     127.12  23.10  ?       ?      0.00    23.10  
1 1 1 10  -10 7  o 2  149.29  25.67  692.15    212.06   692.15   212.06   0.00      0.00     149.29  25.67  ?       ?      0.00    25.67  
1 1 1 10  -10 8  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 10  -10 9  o 19 133.49  16.31  531.81    122.43   596.41   171.94   465.39    174.37   139.36  22.24  121.46  25.80  17.90   34.07  
1 1 1 10  -10 10 o 16 107.48  15.56  346.18    93.21    410.20   132.24   282.98    131.39   115.51  20.70  94.76   24.10  20.76   31.77  
1 1 1 10  -10 11 o 5  246.62  44.49  2140.62   606.77   0.00     0.00     2140.62   606.77   ?       ?      246.62  44.49  0.00    44.49  
1 1 1 10  -10 12 o 8  199.34  22.28  1216.11   250.65   1219.72  354.86   1212.51   354.08   192.74  33.27  192.13  33.31  0.61    47.08  
1 1 1 10  -10 13 o 3  184.02  20.98  1033.61   217.68   1036.47  307.34   1030.73   308.36   178.27  31.17  177.62  31.39  0.65    44.23  
1 1 1 10  -10 14 o 3  103.16  23.54  338.19    136.34   0.00     0.00     338.19    136.34   ?       ?      103.16  23.54  0.00    23.54  
1 1 1 10  -10 15 o 7  203.97  37.10  1440.09   418.37   0.00     0.00     1440.09   418.37   ?       ?      203.97  37.10  0.00    37.10  
1 1 1 10  -10 16 o 16 152.63  28.22  763.90    238.19   0.00     0.00     763.90    238.19   ?       ?      152.63  28.22  0.00    28.22  
1 1 1 10  -10 17 o 12 203.16  23.48  1299.43   268.86   1355.41  381.81   1244.37   378.65   197.76  34.91  187.90  36.42  9.86    50.45  
1 1 1 10  -9  0  o 7  252.03  27.22  1927.46   387.58   1955.30  546.12   1899.22   550.14   246.62  39.94  242.31  41.01  4.31    57.25  
1 1 1 10  -9  1  o 2  417.13  48.67  5782.01   1143.54  5653.69  1617.61  5910.20   1616.81  376.23  77.48  388.07  75.29  -11.84  108.03 
1 1 1 10  -9  2  o 9  103.13  14.39  314.97    82.89    330.85   116.96   298.96    117.48   104.35  20.26  98.85   21.33  5.50    29.42  
1 1 1 10  -9  3  o 11 380.32  75.94  5729.52   1599.92  0.00     0.00     5729.52   1599.92  ?       ?      380.32  75.94  0.00    75.94  
1 1 1 10  -9  4  o 16 177.73  29.06  976.77    286.30   0.00     0.00     976.77    286.30   ?       ?      177.73  29.06  0.00    29.06  
1 1 1 10  -9  5  o 4  135.84  16.25  546.09    124.22   489.48   174.06   604.86    177.33   126.04  24.94  141.21  22.64  -15.17  33.68  
1 1 1 10  -9  6  o 3  191.39  20.81  1093.67   224.92   1067.64  317.23   1119.97   318.94   184.93  30.98  189.82  30.29  -4.89   43.32  
1 1 1 10  -9  7  o 3  144.74  24.67  642.11    197.62   642.11   197.62   0.00      0.00     144.74  24.67  ?       ?      0.00    24.67  
1 1 1 10  -9  8  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 10  -9  9  o 2  105.43  21.59  341.69    126.28   341.69   126.28   0.00      0.00     105.43  21.59  ?       ?      0.00    21.59  
1 1 1 10  -9  10 o 8  82.16   16.20  204.57    73.69    232.97   100.73   171.86    108.08   86.89   20.52  75.33   22.94  11.56   30.78  
1 1 1 10  -9  11 o 9  244.33  26.89  1843.86   370.88   1849.64  524.24   1838.06   524.76   235.04  40.30  234.12  40.51  0.92    57.14  
1 1 1 10  -9  12 o 14 235.12  25.95  1707.56   344.42   1754.01  486.71   1660.97   487.45   229.40  38.31  222.01  39.70  7.39    55.17  
1 1 1 10  -9  13 f 0  239.45  26.84  1785.49   362.59   1684.33  513.46   1886.12   512.11   220.75  42.05  236.54  39.08  -15.79  57.41  
1 1 1 10  -9  14 o 5  172.11  19.75  896.84    191.57   899.44   270.08   894.20    271.76   167.53  29.14  166.86  29.45  0.68    41.43  
1 1 1 10  -9  15 o 12 166.31  19.47  839.15    182.37   778.58   258.33   899.33    257.48   154.57  30.20  167.92  27.67  -13.35  40.96  
1 1 1 10  -9  16 o 9  71.22   22.97  153.81    106.87   0.00     0.00     153.81    106.87   ?       ?      71.22   22.97  0.00    22.97  
1 1 1 10  -9  17 o 19 236.03  45.46  2087.11   593.68   0.00     0.00     2087.11   593.68   ?       ?      236.03  45.46  0.00    45.46  
1 1 1 10  -9  18 o 3  223.69  25.98  1599.60   327.44   1573.32  463.80   1625.71   462.35   208.01  40.30  212.58  39.34  -4.57   56.31  
1 1 1 10  -8  0  o 4  72.47   18.60  159.01    77.78    145.54   101.78   177.92    120.58   70.77   22.38  77.81   24.32  -7.04   33.05  
1 1 1 10  -8  1  o 11 294.89  31.48  2638.49   524.63   2538.56  741.66   2738.57   742.21   279.80  47.90  292.23  45.74  -12.43  66.23  
1 1 1 10  -8  2  o 14 156.39  17.28  720.34    152.53   696.72   216.31   743.70    215.11   151.48  25.80  156.95  24.69  -5.47   35.71  
1 1 1 10  -8  3  o 3  331.32  35.83  3381.26   670.71   3267.59  948.64   3494.87   948.40   312.19  54.94  324.91  52.65  -12.72  76.09  
1 1 1 10  -8  4  o 15 248.49  26.34  1853.45   370.08   1884.94  523.55   1822.00   523.20   244.83  38.52  240.22  39.30  4.61    55.03  
1 1 1 10  -8  5  o 18 268.76  44.02  2329.66   655.74   0.00     0.00     2329.66   655.74   ?       ?      268.76  44.02  0.00    44.02  
1 1 1 10  -8  6  x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 10  -8  7  x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 10  -8  8  o 4  195.37  21.41  1139.11   236.22   984.07   333.09   1296.00   335.07   176.39  34.13  205.36  29.25  -28.97  44.95  
1 1 1 10  -8  9  f 0  413.16  93.77  7785.58   2173.00  7785.58  2173.00  0.00      0.00     413.16  93.77  ?       ?      0.00    93.77  
1 1 1 10  -8  10 o 9  349.99  67.53  4672.84   1307.64  4672.84  1307.64  0.00      0.00     349.99  67.53  ?       ?      0.00    67.53  
1 1 1 10  -8  11 o 16 183.55  20.00  1006.79   207.30   1131.82  293.10   881.65    293.24   191.61  27.43  166.77  31.79  24.84   41.99  
1 1 1 10  -8  12 f 0  146.75  17.66  642.44    145.81   493.85   206.73   789.52    205.68   124.52  29.40  161.00  22.90  -36.49  37.26  
1 1 1 10  -8  13 o 17 222.31  24.61  1511.40   308.79   1429.98  437.28   1592.39   436.11   207.82  38.06  221.36  35.52  -13.55  52.06  
1 1 1 10  -8  14 o 10 155.66  27.12  762.59    233.55   0.00     0.00     762.59    233.55   ?       ?      155.66  27.12  0.00    27.12  
1 1 1 10  -8  15 o 12 350.30  42.97  4233.23   846.00   3934.61  1196.79  4531.48   1196.06  296.07  71.28  328.91  65.65  -32.84  96.90  
1 1 1 10  -8  16 o 5  213.76  23.81  1409.77   287.25   1465.92  406.80   1353.93   405.67   210.14  34.95  200.54  36.59  9.61    50.60  
1 1 1 10  -8  17 o 19 236.70  43.74  2012.40   572.47   0.00     0.00     2012.40   572.47   ?       ?      236.70  43.74  0.00    43.74  
1 1 1 10  -8  18 o 18 195.19  35.15  1297.93   379.38   0.00     0.00     1297.93   379.38   ?       ?      195.19  35.15  0.00    35.15  
1 1 1 10  -8  19 o 13 75.84   20.71  181.74    92.69    -125.08  114.52   764.52    157.82   39.53   18.75  158.67  17.62  -119.14 25.74  
1 1 1 10  -8  20 f 0  259.90  30.87  2254.40   451.62   2304.65  639.12   2204.28   638.26   241.10  47.87  233.83  49.11  7.27    68.58  
1 1 1 10  -7  0  o 12 223.53  35.38  1531.14   438.96   1531.14  438.96   0.00      0.00     223.53  35.38  ?       ?      0.00    35.38  
1 1 1 10  -7  1  o 8  298.38  31.46  2673.45   530.82   2806.03  751.84   2541.67   749.55   299.13  45.19  283.03  47.83  16.09   65.81  
1 1 1 10  -7  2  o 11 482.38  53.89  7448.45   1466.74  7834.74  2074.72  7062.48   2073.86  467.90  80.12  437.72  85.60  30.18   117.25 
1 1 1 10  -7  3  o 18 336.20  35.79  3430.49   680.10   3420.96  962.39   3440.00   961.24   325.56  53.34  326.65  53.08  -1.09   75.25  
1 1 1 10  -7  4  o 14 152.51  17.41  683.82    149.73   632.30   214.50   732.78    209.12   144.28  26.89  156.36  24.07  -12.08  36.09  
1 1 1 10  -7  5  o 3  204.62  21.92  1238.54   253.48   1224.78  360.33   1252.01   356.66   200.06  32.49  202.61  31.70  -2.54   45.39  
1 1 1 10  -7  6  x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 10  -7  7  o 4  199.19  31.95  1218.95   352.95   0.00     0.00     1218.95   352.95   ?       ?      199.19  31.95  0.00    31.95  
1 1 1 10  -7  8  o 14 313.20  34.00  3012.19   601.45   2770.06  850.90   3253.95   850.26   287.11  53.60  315.71  48.46  -28.60  72.26  
1 1 1 10  -7  9  o 8  563.32  75.18  12032.43  2370.46  12179.94 3352.59  11884.96  3352.09  472.73  122.54 462.84  123.77 9.89    174.17 
1 1 1 10  -7  10 o 17 208.00  34.25  1356.85   394.72   1356.85  394.72   0.00      0.00     208.00  34.25  ?       ?      0.00    34.25  
1 1 1 10  -7  11 o 13 285.64  48.97  2742.92   774.05   2742.92  774.05   0.00      0.00     285.64  48.97  ?       ?      0.00    48.97  
1 1 1 10  -7  12 o 6  271.41  29.61  2263.93   453.80   2206.28  642.99   2321.14   640.56   257.31  45.18  265.29  43.57  -7.98   62.76  
1 1 1 10  -7  13 o 10 177.72  20.09  945.18    201.40   880.37   284.98   1009.84   284.66   167.02  30.86  180.31  28.44  -13.28  41.97  
1 1 1 10  -7  14 o 3  83.74   17.02  213.24    79.02    167.17   114.01   255.83    109.63   74.79   23.69  90.93   21.37  -16.14  31.90  
1 1 1 10  -7  15 o 17 117.78  16.48  415.63    108.40   387.40   154.93   442.70    151.73   110.97  24.93  119.48  22.95  -8.51   33.89  
1 1 1 10  -7  16 o 7  262.93  29.64  2183.04   439.62   2128.68  621.89   2237.34   621.55   245.17  45.87  252.94  44.43  -7.77   63.86  
1 1 1 10  -7  17 o 9  74.45   18.56  171.48    79.02    182.72   110.96   159.92    112.55   76.89   23.20  72.92   23.58  3.98    33.08  
1 1 1 10  -7  18 o 12 186.39  20.46  1058.42   215.31   1298.82  303.66   815.35    305.34   202.79  26.73  154.89  35.15  47.89   44.16  
1 1 1 10  -7  19 o 17 127.87  25.43  524.03    180.09   0.00     0.00     524.03    180.09   ?       ?      127.87  25.43  0.00    25.43  
1 1 1 10  -7  20 o 4  180.98  33.16  1115.27   331.79   0.00     0.00     1115.27   331.79   ?       ?      180.98  33.16  0.00    33.16  
1 1 1 10  -7  21 o 5  215.49  41.88  1736.77   499.38   0.00     0.00     1736.77   499.38   ?       ?      215.49  41.88  0.00    41.88  
1 1 1 10  -6  0  o 13 266.39  41.86  2200.01   619.03   2200.01  619.03   0.00      0.00     266.39  41.86  ?       ?      0.00    41.86  
1 1 1 10  -6  1  o 19 547.71  62.72  9822.79   1936.40  9830.25  2738.37  9815.32   2738.59  507.08  97.61  506.55  97.72  0.53    138.12 
1 1 1 10  -6  2  o 10 219.41  23.12  1421.07   286.84   1452.78  404.61   1389.02   406.72   218.78  33.26  213.46  34.36  5.32    47.82  
1 1 1 10  -6  3  o 15 517.61  58.21  8619.55   1699.58  8739.08  2403.41  8500.00   2403.73  488.89  88.91  480.13  90.53  8.76    126.89 
1 1 1 10  -6  4  o 12 297.04  31.24  2639.94   524.79   2792.70  741.94   2487.00   742.40   299.69  44.47  280.92  47.74  18.78   65.25  
1 1 1 10  -6  5  o 6  169.17  18.83  841.00    179.78   859.95   255.50   822.41    253.02   169.03  27.26  165.11  27.67  3.92    38.84  
1 1 1 10  -6  6  x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 10  -6  7  o 5  186.41  29.67  1052.25   306.91   0.00     0.00     1052.25   306.91   ?       ?      186.41  29.67  0.00    29.67  
1 1 1 10  -6  8  o 14 358.08  60.60  4293.35   1201.25  0.00     0.00     4293.35   1201.25  ?       ?      358.08  60.60  0.00    60.60  
1 1 1 10  -6  9  o 2  252.49  26.97  1909.06   384.83   1773.61  545.85   2042.90   542.62   236.74  41.69  256.33  38.03  -19.59  56.43  
1 1 1 10  -6  10 f 0  405.80  45.32  5261.72   1037.67  5576.42  1468.14  4947.59   1466.82  395.89  66.99  366.75  72.24  29.14   98.52  
1 1 1 10  -6  11 o 15 413.42  84.48  6935.55   1937.05  6935.55  1937.05  0.00      0.00     413.42  84.48  ?       ?      0.00    84.48  
1 1 1 10  -6  12 o 12 421.61  93.60  7900.85   2206.26  7900.85  2206.26  0.00      0.00     421.61  93.60  ?       ?      0.00    93.60  
1 1 1 10  -6  13 o 6  267.38  28.74  2184.18   434.22   2501.03  615.97   1871.19   612.21   279.24  39.53  236.02  46.84  43.22   61.29  
1 1 1 10  -6  14 o 7  225.03  24.60  1532.99   312.56   1546.12  443.79   1520.07   440.28   219.55  36.49  217.64  36.53  1.92    51.64  
1 1 1 10  -6  15 o 1  182.54  20.63  1001.01   212.40   970.62   303.60   1030.15   297.24   174.86  31.40  181.18  29.60  -6.32   43.15  
1 1 1 10  -6  16 o 2  229.58  25.34  1618.40   328.43   1697.42  467.29   1541.26   461.71   227.26  37.10  215.10  38.82  12.16   53.69  
1 1 1 10  -6  17 o 13 462.27  70.27  9189.06   1806.12  9570.94  2555.01  8807.64   2553.46  361.69  111.78 334.10  112.51 27.59   158.60 
1 1 1 10  -6  18 o 16 20.83   10.31  -104.34   45.74    -181.43  50.80    225.32    105.06   18.56   9.41   84.83   21.54  -66.27  23.50  
1 1 1 10  -6  19 o 13 123.17  17.10  458.67    117.66   770.43   171.62   182.19    161.62   159.30  19.15  79.33   28.22  79.97   34.11  
1 1 1 10  -6  20 f 0  100.83  24.21  326.35    138.37   0.00     0.00     326.35    138.37   ?       ?      100.83  24.21  0.00    24.21  
1 1 1 10  -6  21 o 4  162.66  30.04  882.14    270.15   0.00     0.00     882.14    270.15   ?       ?      162.66  30.04  0.00    30.04  
1 1 1 10  -6  22 o 17 133.34  18.93  549.91    140.85   621.47   213.86   495.09    187.19   136.39  28.24  121.87  27.42  14.53   39.37  
1 1 1 10  -5  0  o 6  518.24  104.26 10742.89  2994.16  10742.89 2994.16  0.00      0.00     518.24  104.26 ?       ?      0.00    104.26 
1 1 1 10  -5  1  o 11 481.24  53.59  7373.12   1455.45  6895.59  2058.09  7850.86   2058.55  434.51  85.56  471.86  78.77  -37.35  116.29 
1 1 1 10  -5  2  o 11 557.36  64.43  10258.82  2023.50  9708.09  2861.53  10809.65  2861.79  493.71  104.24 531.46  97.39  -37.75  142.66 
1 1 1 10  -5  3  o 9  144.04  16.24  608.20    131.96   584.57   184.66   632.87    188.65   139.53  23.91  145.44  23.39  -5.91   33.45  
1 1 1 10  -5  4  o 2  580.67  67.53  11202.38  2209.00  10736.23 3123.84  11668.62  3124.16  516.56  108.79 547.29  103.22 -30.73  149.96 
1 1 1 10  -5  5  o 6  352.45  57.43  4011.39   1122.00  4011.39  1122.00  0.00      0.00     352.45  57.43  ?       ?      0.00    57.43  
1 1 1 10  -5  6  o 11 232.44  36.54  1650.41   471.50   0.00     0.00     1650.41   471.50   ?       ?      232.44  36.54  0.00    36.54  
1 1 1 10  -5  7  o 12 254.88  26.83  1927.36   386.72   1818.38  545.31   2037.63   548.51   242.57  40.59  258.07  38.17  -15.50  55.72  
1 1 1 10  -5  8  o 16 240.28  37.75  1771.06   503.55   0.00     0.00     1771.06   503.55   ?       ?      240.28  37.75  0.00    37.75  
1 1 1 10  -5  9  o 6  63.49   21.47  109.78    93.01    0.00     0.00     109.78    93.01    ?       ?      63.49   21.47  0.00    21.47  
1 1 1 10  -5  10 o 11 334.71  35.89  3417.44   678.82   3113.23  959.34   3722.50   960.67   306.57  56.60  340.05  50.76  -33.48  76.03  
1 1 1 10  -5  11 o 6  166.03  18.39  813.04    172.36   784.60   242.14   842.25    245.40   160.57  27.24  166.72  26.53  -6.15   38.02  
1 1 1 10  -5  12 o 14 84.91   21.70  220.11    106.14   220.11   106.14   0.00      0.00     84.91   21.70  ?       ?      0.00    21.70  
1 1 1 10  -5  13 o 1  157.02  26.42  754.62    229.73   754.62   229.73   0.00      0.00     157.02  26.42  ?       ?      0.00    26.42  
1 1 1 10  -5  14 o 13 143.44  16.76  608.99    135.37   656.47   190.04   560.07    192.89   147.06  23.28  134.78  25.87  12.29   34.81  
1 1 1 10  -5  15 o 19 290.07  31.76  2613.94   520.25   2692.77  735.77   2535.11   735.71   282.54  47.01  272.44  48.84  10.10   67.79  
1 1 1 10  -5  16 o 13 173.66  19.53  902.63    191.37   931.85   270.57   873.38    270.69   172.84  28.24  166.70  29.36  6.14    40.74  
1 1 1 10  -5  17 o 19 373.27  44.85  4776.52   941.77   5018.14  1331.79  4534.85   1331.93  346.97  69.29  321.98  73.66  24.99   101.13 
1 1 1 10  -5  18 o 12 186.96  25.13  1084.13   262.94   -391.43  364.71   2681.11   379.42   68.47   32.75  297.24  22.40  -228.78 39.68  
1 1 1 10  -5  19 o 17 205.31  22.88  1294.93   265.11   1472.61  376.77   1120.70   373.10   213.02  31.78  181.67  37.03  31.35   48.80  
1 1 1 10  -5  20 o 11 87.71   18.32  237.91    89.27    272.10   132.77   209.70    120.60   92.23   24.62  81.58   24.09  10.66   34.44  
1 1 1 10  -5  21 o 2  127.02  25.59  519.77    180.14   0.00     0.00     519.77    180.14   ?       ?      127.02  25.59  0.00    25.59  
1 1 1 10  -5  22 o 18 204.09  38.95  1507.70   439.68   0.00     0.00     1507.70   439.68   ?       ?      204.09  38.95  0.00    38.95  
1 1 1 10  -5  23 o 18 60.66   22.99  92.74     110.10   0.00     0.00     92.74     110.10   ?       ?      60.66   22.99  0.00    22.99  
1 1 1 10  -4  0  o 9  375.60  63.24  4710.33   1315.26  4710.33  1315.26  0.00      0.00     375.60  63.24  ?       ?      0.00    63.24  
1 1 1 10  -4  1  o 1  351.84  37.46  3768.44   744.95   3794.42  1053.39  3742.43   1053.65  342.04  55.55  339.31  56.05  2.73    78.91  
1 1 1 10  -4  2  o 2  348.00  57.24  3948.51   1103.88  0.00     0.00     3948.51   1103.88  ?       ?      348.00  57.24  0.00    57.24  
1 1 1 10  -4  3  o 8  154.85  16.86  703.11    147.43   796.57   207.36   607.57    209.65   163.64  22.68  141.53  26.78  22.11   35.10  
1 1 1 10  -4  4  o 8  265.70  27.85  2101.79   418.54   2000.71  591.25   2203.30   592.55   253.54  42.10  267.35  39.82  -13.81  57.95  
1 1 1 10  -4  5  x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 10  -4  6  o 19 109.34  14.52  351.43    88.88    315.66   121.85   392.10    129.93   102.25  21.44  114.42  20.54  -12.17  29.69  
1 1 1 10  -4  7  o 6  217.05  22.88  1389.16   280.82   1452.90  397.07   1325.37   397.22   219.18  32.54  208.55  34.38  10.63   47.34  
1 1 1 10  -4  8  o 4  232.70  24.60  1600.59   323.69   1447.92  456.84   1754.51   458.70   216.91  38.08  240.71  34.15  -23.80  51.15  
1 1 1 10  -4  9  o 8  350.89  57.23  3974.60   1113.05  0.00     0.00     3974.60   1113.05  ?       ?      350.89  57.23  0.00    57.23  
1 1 1 10  -4  10 o 17 462.76  84.32  7732.02   2157.49  0.00     0.00     7732.02   2157.49  ?       ?      462.76  84.32  0.00    84.32  
1 1 1 10  -4  11 o 4  101.05  14.95  301.85    84.13    333.83   116.00   266.37    122.19   105.37  19.91  93.56   22.93  11.82   30.37  
1 1 1 10  -4  12 f 0  352.29  60.43  4210.29   1178.23  4210.29  1178.23  0.00      0.00     352.29  60.43  ?       ?      0.00    60.43  
1 1 1 10  -4  13 o 19 289.83  48.16  2750.47   773.21   2750.47  773.21   0.00      0.00     289.83  48.16  ?       ?      0.00    48.16  
1 1 1 10  -4  14 o 18 341.59  61.67  4160.47   1164.82  4160.47  1164.82  0.00      0.00     341.59  61.67  ?       ?      0.00    61.67  
1 1 1 10  -4  15 o 5  70.18   17.11  149.72    68.29    164.22   92.38    132.25    101.39   73.61   20.89  68.02   22.41  5.59    30.64  
1 1 1 10  -4  16 o 6  206.62  22.51  1283.99   262.73   1282.95  370.43   1285.05   372.70   201.43  33.19  201.49  33.39  -0.06   47.08  
1 1 1 10  -4  17 o 9  17.76   8.94   -126.49   41.14    -207.91  45.11    276.36    100.33   ?       ?      95.12   19.04  0.00    19.04  
1 1 1 10  -4  18 f 0  357.46  42.49  4332.24   854.84   4567.35  1208.18  4096.55   1209.66  335.57  65.07  310.05  69.67  25.52   95.33  
1 1 1 10  -4  19 o 10 178.67  20.45  968.25    206.02   915.91   290.08   1021.53   292.66   168.04  31.22  178.69  29.56  -10.65  43.00  
1 1 1 10  -4  20 o 4  147.98  18.08  661.48    150.38   681.09   212.12   641.65    213.23   146.44  26.19  141.51  27.24  4.93    37.79  
1 1 1 10  -4  21 o 1  107.49  17.38  352.53    103.60   277.19   145.86   429.21    147.17   92.64   26.24  116.65  22.79  -24.01  34.76  
1 1 1 10  -4  22 o 10 64.68   23.33  115.46    110.91   0.00     0.00     115.46    110.91   ?       ?      64.68   23.33  0.00    23.33  
1 1 1 10  -4  23 o 6  74.79   25.02  174.36    126.34   0.00     0.00     174.36    126.34   ?       ?      74.79   25.02  0.00    25.02  
1 1 1 10  -4  24 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 10  -3  0  o 2  411.12  71.03  5792.88   1615.86  5792.88  1615.86  0.00      0.00     411.12  71.03  ?       ?      0.00    71.03  
1 1 1 10  -3  1  o 12 416.17  72.17  5957.61   1661.84  5957.61  1661.84  0.00      0.00     416.17  72.17  ?       ?      0.00    72.17  
1 1 1 10  -3  2  o 4  683.47  87.60  17061.78  3358.00  16632.78 4748.80  17490.83  4749.05  572.26  144.54 596.42  140.95 -24.17  201.89 
1 1 1 10  -3  3  o 12 274.40  28.80  2245.91   446.85   2386.08  632.08   2105.87   631.81   277.90  40.84  259.32  44.01  18.58   60.04  
1 1 1 10  -3  4  o 2  368.07  61.26  4471.01   1248.86  4471.01  1248.86  0.00      0.00     368.07  61.26  ?       ?      0.00    61.26  
1 1 1 10  -3  5  o 9  116.22  21.29  405.66    136.80   0.00     0.00     405.66    136.80   ?       ?      116.22  21.29  0.00    21.29  
1 1 1 10  -3  6  o 18 141.39  16.08  586.23    128.24   631.00   180.23   540.32    182.51   145.44  22.30  133.80  24.67  11.63   33.25  
1 1 1 10  -3  7  o 12 168.65  27.02  855.63    252.79   855.63   252.79   0.00      0.00     168.65  27.02  ?       ?      0.00    27.02  
1 1 1 10  -3  8  o 15 602.24  70.75  12170.14  2399.29  11829.19 3392.89  12511.18  3393.33  537.16  113.58 558.89  109.68 -21.73  157.90 
1 1 1 10  -3  9  o 16 148.50  25.56  663.21    210.07   0.00     0.00     663.21    210.07   ?       ?      148.50  25.56  0.00    25.56  
1 1 1 10  -3  10 o 10 143.88  25.51  623.52    203.00   0.00     0.00     623.52    203.00   ?       ?      143.88  25.51  0.00    25.51  
1 1 1 10  -3  11 o 14 444.82  79.20  6978.42   1948.28  0.00     0.00     6978.42   1948.28  ?       ?      444.82  79.20  0.00    79.20  
1 1 1 10  -3  12 o 9  304.78  32.24  2800.59   555.57   2949.04  785.22   2651.78   786.17   305.56  46.21  287.66  49.39  17.89   67.63  
1 1 1 10  -3  13 o 3  52.81   20.15  57.34     84.84    57.34    84.84    0.00      0.00     52.81   20.15  ?       ?      0.00    20.15  
1 1 1 10  -3  14 o 15 88.85   21.41  241.22    107.93   241.22   107.93   0.00      0.00     88.85   21.41  ?       ?      0.00    21.41  
1 1 1 10  -3  15 o 10 140.40  24.27  601.09    188.50   601.09   188.50   0.00      0.00     140.40  24.27  ?       ?      0.00    24.27  
1 1 1 10  -3  16 o 2  209.02  22.43  1309.87   264.90   1439.77  372.84   1177.47   376.43   215.27  31.07  192.17  35.43  23.10   47.12  
1 1 1 10  -3  17 o 3  95.81   22.76  284.30    123.29   0.00     0.00     284.30    123.29   ?       ?      95.81   22.76  0.00    22.76  
1 1 1 10  -3  18 o 11 218.68  37.06  1566.39   448.62   1566.39  448.62   0.00      0.00     218.68  37.06  ?       ?      0.00    37.06  
1 1 1 10  -3  19 o 10 152.06  18.08  694.45    154.75   702.00   218.04   686.79    219.68   149.38  26.39  147.46  26.94  1.92    37.71  
1 1 1 10  -3  20 o 5  234.18  42.38  1922.93   548.82   0.00     0.00     1922.93   548.82   ?       ?      234.18  42.38  0.00    42.38  
1 1 1 10  -3  21 o 15 160.00  19.39  779.39    174.46   713.32   246.74   845.45    246.71   147.30  30.19  162.39  27.44  -15.09  40.80  
1 1 1 10  -3  22 o 5  144.19  18.52  634.49    149.79   599.71   211.41   669.55    212.25   135.17  28.16  143.90  26.68  -8.73   38.79  
1 1 1 10  -3  23 o 6  119.74  25.93  470.21    173.09   0.00     0.00     470.21    173.09   ?       ?      119.74  25.93  0.00    25.93  
1 1 1 10  -3  24 o 17 55.29   22.44  53.87     111.17   0.00     0.00     53.87     111.17   ?       ?      55.29   22.44  0.00    22.44  
1 1 1 10  -2  0  o 2  286.15  45.06  2555.92   715.70   2555.92  715.70   0.00      0.00     286.15  45.06  ?       ?      0.00    45.06  
1 1 1 10  -2  1  o 4  331.37  53.33  3507.60   980.12   3507.60  980.12   0.00      0.00     331.37  53.33  ?       ?      0.00    53.33  
1 1 1 10  -2  2  o 19 223.68  23.34  1476.88   295.30   1485.12  417.31   1468.61   417.92   221.03  33.97  219.68  34.26  1.35    48.25  
1 1 1 10  -2  3  o 13 331.81  35.00  3320.67   656.58   3296.00  928.39   3345.35   928.70   321.63  52.06  324.34  51.61  -2.71   73.30  
1 1 1 10  -2  4  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 10  -2  5  o 3  231.29  24.23  1582.64   316.99   1616.02  448.04   1549.20   448.53   230.19  35.01  224.94  35.94  5.25    50.18  
1 1 1 10  -2  6  o 8  262.23  27.52  2046.13   408.06   2123.15  576.93   1969.02   577.25   262.48  39.51  251.79  41.37  10.69   57.21  
1 1 1 10  -2  7  o 11 93.32   14.30  257.42    74.18    291.66   102.92   220.41    107.01   98.60   18.87  85.31   21.78  13.28   28.82  
1 1 1 10  -2  8  o 13 85.34   15.13  216.82    71.40    184.34   102.42   247.52    99.58    78.38   21.91  90.56   19.72  -12.18  29.48  
1 1 1 10  -2  9  o 13 238.76  25.07  1686.70   338.48   1598.18  478.47   1775.38   478.90   228.10  37.87  241.53  35.61  -13.43  51.98  
1 1 1 10  -2  10 o 12 349.33  56.84  3929.91   1100.74  0.00     0.00     3929.91   1100.74  ?       ?      349.33  56.84  0.00    56.84  
1 1 1 10  -2  11 o 14 469.07  84.80  7881.87   2199.50  0.00     0.00     7881.87   2199.50  ?       ?      469.07  84.80  0.00    84.80  
1 1 1 10  -2  12 o 12 354.55  37.82  3824.06   757.83   3936.40  1072.16  3711.90   1071.31  349.20  55.33  337.58  57.33  11.61   79.67  
1 1 1 10  -2  13 o 17 337.34  36.09  3472.12   688.05   3667.08  973.43   3277.47   972.66   336.68  52.04  315.43  55.75  21.25   76.27  
1 1 1 10  -2  14 o 3  345.00  59.57  4060.02   1137.22  4060.02  1137.22  0.00      0.00     345.00  59.57  ?       ?      0.00    59.57  
1 1 1 10  -2  15 o 17 93.39   20.93  266.26    109.45   266.26   109.45   0.00      0.00     93.39   20.93  ?       ?      0.00    20.93  
1 1 1 10  -2  16 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 10  -2  17 o 6  212.35  22.60  1355.18   271.28   1679.09  382.03   1025.73   385.28   233.35  29.15  176.78  39.01  56.57   48.70  
1 1 1 10  -2  18 o 6  303.59  33.98  2923.22   582.01   2923.69  822.82   2922.75   823.36   286.84  51.88  286.74  51.93  0.10    73.40  
1 1 1 10  -2  19 o 12 221.85  24.72  1510.61   309.51   1430.36  436.48   1591.77   438.95   207.12  38.11  220.37  35.94  -13.25  52.38  
1 1 1 10  -2  20 o 10 201.52  22.52  1243.56   256.07   1326.34  362.57   1161.19   361.70   201.89  32.38  186.85  35.01  15.04   47.68  
1 1 1 10  -2  21 o 4  161.71  19.43  795.05    176.75   707.18   250.02   882.85    249.91   146.58  30.70  166.43  27.09  -19.86  40.94  
1 1 1 10  -2  22 o 12 51.57   19.20  64.53     76.04    2.40     106.90   128.16    108.18   48.88   21.04  66.69   23.14  -17.81  31.28  
1 1 1 10  -2  23 o 18 139.65  27.82  643.06    215.23   643.06   215.23   0.00      0.00     139.65  27.82  ?       ?      0.00    27.82  
1 1 1 10  -2  24 o 6  110.76  25.73  407.19    160.48   0.00     0.00     407.19    160.48   ?       ?      110.76  25.73  0.00    25.73  
1 1 1 10  -2  25 o 8  92.99   26.55  292.69    148.77   0.00     0.00     292.69    148.77   ?       ?      92.99   26.55  0.00    26.55  
1 1 1 10  -1  0  o 17 327.97  52.46  3416.04   954.42   3416.04  954.42   0.00      0.00     327.97  52.46  ?       ?      0.00    52.46  
1 1 1 10  -1  1  o 16 117.44  19.75  411.24    128.43   411.24   128.43   0.00      0.00     117.44  19.75  ?       ?      0.00    19.75  
1 1 1 10  -1  2  o 2  650.01  78.28  14543.56  2862.18  14338.31 4047.56  14748.84  4047.91  574.85  126.13 587.03  124.01 -12.18  176.88 
1 1 1 10  -1  3  o 1  477.74  86.63  8208.89   2288.42  8208.89  2288.42  0.00      0.00     477.74  86.63  ?       ?      0.00    86.63  
1 1 1 10  -1  4  o 11 288.49  45.45  2597.37   727.91   0.00     0.00     2597.37   727.91   ?       ?      288.49  45.45  0.00    45.45  
1 1 1 10  -1  5  o 15 111.76  20.16  374.12    124.60   374.12   124.60   0.00      0.00     111.76  20.16  ?       ?      0.00    20.16  
1 1 1 10  -1  6  o 15 292.15  30.63  2553.48   506.05   2490.39  715.18   2616.73   716.16   281.74  45.79  289.59  44.50  -7.85   63.85  
1 1 1 10  -1  7  o 12 171.56  18.43  864.32    178.66   797.70   252.96   930.62    252.36   162.33  28.17  176.33  25.69  -14.00  38.12  
1 1 1 10  -1  8  o 9  496.82  55.59  7909.59   1558.40  7645.95  2203.77  8173.31   2204.04  456.16  87.34  476.19  83.68  -20.04  120.95 
1 1 1 10  -1  9  o 14 478.21  53.03  7246.04   1431.45  7597.72  2024.51  6894.45   2024.26  465.63  78.53  438.02  83.55  27.62   114.66 
1 1 1 10  -1  10 o 19 468.19  84.48  7838.15   2187.03  0.00     0.00     7838.15   2187.03  ?       ?      468.19  84.48  0.00    84.48  
1 1 1 10  -1  11 o 18 420.93  72.31  6028.91   1684.40  0.00     0.00     6028.91   1684.40  ?       ?      420.93  72.31  0.00    72.31  
1 1 1 10  -1  12 o 10 116.56  16.15  400.68    105.15   290.88   141.82   534.74    156.71   97.80   25.13  133.95  21.07  -36.15  32.80  
1 1 1 10  -1  13 o 18 273.56  28.91  2237.04   447.21   2233.08  632.42   2241.01   632.49   267.37  42.63  267.90  42.55  -0.53   60.23  
1 1 1 10  -1  14 o 10 108.90  15.57  350.76    94.55    373.25   133.13   327.86    134.31   111.07  21.66  103.69  23.15  7.38    31.70  
1 1 1 10  -1  15 o 6  255.95  41.60  2091.32   590.23   2091.32  590.23   0.00      0.00     255.95  41.60  ?       ?      0.00    41.60  
1 1 1 10  -1  16 o 6  22.20   11.06  -145.66   56.43    -145.66  56.43    0.00      0.00     22.20   11.06  ?       ?      0.00    11.06  
1 1 1 10  -1  17 o 3  337.40  37.68  3621.09   717.47   3877.53  1014.85  3364.86   1014.45  332.16  55.16  303.60  60.33  28.56   81.75  
1 1 1 10  -1  18 o 8  272.98  30.04  2313.07   463.03   2374.66  654.75   2251.45   654.88   265.48  44.54  257.08  46.07  8.40    64.08  
1 1 1 10  -1  19 o 10 232.65  25.79  1665.22   338.71   1639.85  479.72   1690.44   478.29   221.82  39.10  225.95  38.24  -4.13   54.69  
1 1 1 10  -1  20 o 13 214.56  24.01  1417.32   290.63   1544.00  412.01   1291.86   410.02   216.99  34.21  195.42  37.92  21.57   51.07  
1 1 1 10  -1  21 o 15 134.36  18.35  547.91    137.86   609.57   198.77   490.77    191.35   138.39  25.97  123.05  27.75  15.34   38.01  
1 1 1 10  -1  22 o 4  267.00  31.15  2335.03   468.44   2498.66  664.43   2173.32   660.54   258.28  46.52  235.59  50.37  22.69   68.57  
1 1 1 10  -1  23 o 6  241.96  49.99  2348.09   671.32   2348.09  671.32   0.00      0.00     241.96  49.99  ?       ?      0.00    49.99  
1 1 1 10  -1  24 o 13 46.95   20.80  -20.46    111.09   0.00     0.00     -20.46    111.09   ?       ?      46.95   20.80  0.00    20.80  
1 1 1 10  -1  25 o 7  67.93   24.30  137.13    120.04   0.00     0.00     137.13    120.04   ?       ?      67.93   24.30  0.00    24.30  
1 1 1 10  0   0  o 1  298.66  46.99  2785.04   779.02   2785.04  779.02   0.00      0.00     298.66  46.99  ?       ?      0.00    46.99  
1 1 1 10  0   1  o 4  234.50  36.14  1674.18   470.95   1674.18  470.95   0.00      0.00     234.50  36.14  ?       ?      0.00    36.14  
1 1 1 10  0   2  o 19 193.77  20.22  1102.45   221.59   1011.02  311.98   1195.55   314.80   182.76  30.83  199.86  28.22  -17.10  41.80  
1 1 1 10  0   3  x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 10  0   4  o 19 260.75  27.18  2017.25   400.91   1996.94  566.33   2037.65   567.62   254.76  40.04  257.55  39.66  -2.79   56.36  
1 1 1 10  0   5  o 15 664.84  81.97  15556.43  3062.39  15384.72 4330.75  15728.17  4331.01  579.64  132.98 589.62  131.32 -9.98   186.89 
1 1 1 10  0   6  o 14 264.89  27.73  2086.97   415.48   2119.27  587.01   2054.56   588.13   262.09  40.30  257.61  41.15  4.48    57.60  
1 1 1 10  0   7  o 4  250.54  26.08  1862.57   369.63   1686.60  522.60   2038.73   522.88   233.03  40.54  258.53  36.22  -25.50  54.36  
1 1 1 10  0   8  o 9  210.68  22.21  1309.56   264.59   1289.51  373.80   1329.70   374.58   205.88  32.72  209.30  32.21  -3.42   45.91  
1 1 1 10  0   9  o 14 178.39  19.30  935.43    194.45   907.81   273.62   963.61    276.39   173.36  28.48  178.91  27.81  -5.56   39.81  
1 1 1 10  0   10 o 11 422.35  72.95  6103.84   1704.77  0.00     0.00     6103.84   1704.77  ?       ?      422.35  72.95  0.00    72.95  
1 1 1 10  0   11 o 16 594.21  138.42 16627.60  4633.59  0.00     0.00     16627.60  4633.59  ?       ?      594.21  138.42 0.00    138.42 
1 1 1 10  0   12 o 18 410.28  70.24  5706.74   1594.92  0.00     0.00     5706.74   1594.92  ?       ?      410.28  70.24  0.00    70.24  
1 1 1 10  0   13 o 8  216.26  23.08  1382.70   282.12   1379.99  398.78   1385.42   399.17   212.63  33.80  213.07  33.76  -0.44   47.77  
1 1 1 10  0   14 o 10 58.14   18.33  97.24     68.32    153.03   91.71    27.67     102.41   71.66   20.97  52.08   21.38  19.59   29.95  
1 1 1 10  0   15 o 5  27.90   14.04  -315.44   102.19   -315.44  102.19   0.00      0.00     27.90   14.04  ?       ?      0.00    14.04  
1 1 1 10  0   16 o 17 376.44  72.77  5425.56   1515.69  5425.56  1515.69  0.00      0.00     376.44  72.77  ?       ?      0.00    72.77  
1 1 1 10  0   17 o 14 128.16  24.18  504.69    171.38   504.69   171.38   0.00      0.00     128.16  24.18  ?       ?      0.00    24.18  
1 1 1 10  0   18 o 14 459.45  59.32  7741.11   1528.17  7960.38  2161.36  7521.91   2160.96  400.80  95.33  382.51  97.99  18.29   136.71 
1 1 1 10  0   19 o 19 196.34  22.02  1167.10   243.89   1085.17  344.97   1248.97   344.86   182.93  34.10  198.23  31.35  -15.29  46.32  
1 1 1 10  0   20 o 12 70.14   19.99  151.15    84.38    197.42   122.37   109.20    116.51   79.95   24.42  65.11   23.85  14.83   34.14  
1 1 1 10  0   21 o 9  358.81  45.82  4655.38   922.28   4839.87  1305.01  4471.30   1303.60  319.00  72.86  299.43  75.78  19.57   105.13 
1 1 1 10  0   22 o 8  200.60  23.31  1252.99   263.42   1120.06  373.62   1384.39   371.44   178.99  37.56  203.63  32.90  -24.64  49.93  
1 1 1 10  0   23 o 10 128.08  18.61  504.39    132.82   443.55   188.96   563.80    186.74   115.16  28.69  131.98  25.57  -16.81  38.43  
1 1 1 10  0   24 f 0  212.08  25.40  1450.88   303.15   1401.20  430.07   1499.95   427.38   193.68  40.00  202.78  38.11  -9.10   55.25  
1 1 1 10  0   25 o 18 108.94  26.87  403.94    166.95   0.00     0.00     403.94    166.95   ?       ?      108.94  26.87  0.00    26.87  
1 1 1 10  1   0  o 17 413.05  69.78  5720.57   1595.65  5720.57  1595.65  0.00      0.00     413.05  69.78  ?       ?      0.00    69.78  
1 1 1 10  1   1  o 4  716.66  90.34  18496.28  3634.08  17976.46 5139.18  19016.18  5139.54  605.29  148.93 633.31  144.56 -28.02  207.55 
1 1 1 10  1   2  o 4  145.61  23.10  632.92    186.62   632.92   186.62   0.00      0.00     145.61  23.10  ?       ?      0.00    23.10  
1 1 1 10  1   3  o 11 383.87  63.48  4836.06   1350.06  0.00     0.00     4836.06   1350.06  ?       ?      383.87  63.48  0.00    63.48  
1 1 1 10  1   4  o 6  340.90  35.91  3505.13   692.14   3426.84  978.16   3583.65   979.52   327.63  53.88  336.00  52.50  -8.37   75.23  
1 1 1 10  1   5  o 15 206.40  21.64  1254.39   252.63   1232.96  356.44   1276.01   358.12   201.73  31.83  205.45  31.36  -3.72   44.68  
1 1 1 10  1   6  o 13 314.77  33.10  2977.74   589.18   2910.86  832.42   3044.87   834.03   303.14  49.54  310.86  48.30  -7.72   69.19  
1 1 1 10  1   7  o 1  505.62  56.97  8230.80   1624.92  8384.15  2297.82  8077.40   2298.14  478.82  86.79  467.32  88.91  11.50   124.25 
1 1 1 10  1   8  o 9  251.84  26.43  1883.99   376.38   1838.59  531.63   1929.62   532.94   243.97  39.29  250.49  38.28  -6.52   54.85  
1 1 1 10  1   9  o 10 441.94  48.29  6112.55   1205.28  6018.33  1704.30  6206.82   1704.76  416.96  73.91  424.90  72.49  -7.94   103.52 
1 1 1 10  1   10 o 3  262.43  41.32  2130.63   602.01   0.00     0.00     2130.63   602.01   ?       ?      262.43  41.32  0.00    41.32  
1 1 1 10  1   11 o 9  233.86  36.85  1673.51   478.39   0.00     0.00     1673.51   478.39   ?       ?      233.86  36.85  0.00    36.85  
1 1 1 10  1   12 o 4  111.94  23.82  379.89    148.37   0.00     0.00     379.89    148.37   ?       ?      111.94  23.82  0.00    23.82  
1 1 1 10  1   13 f 0  162.02  18.36  772.02    167.77   770.09   236.04   774.00    238.51   159.77  26.67  160.13  26.90  -0.35   37.88  
1 1 1 10  1   14 o 13 636.27  83.31  15067.70  2970.06  15148.71 4200.09  14986.68  4200.51  538.62  135.87 533.70  136.56 4.91    192.64 
1 1 1 10  1   15 o 17 19.68   9.73   -91.24    40.31    -91.24   40.31    0.00      0.00     19.68   9.73   ?       ?      0.00    9.73   
1 1 1 10  1   16 o 17 313.47  54.65  3376.13   947.79   3376.13  947.79   0.00      0.00     313.47  54.65  ?       ?      0.00    54.65  
1 1 1 10  1   17 o 8  224.40  37.23  1613.56   462.76   1613.56  462.76   0.00      0.00     224.40  37.23  ?       ?      0.00    37.23  
1 1 1 10  1   18 o 12 219.33  24.12  1458.05   298.66   1387.62  423.30   1527.87   421.46   206.89  37.00  218.74  34.72  -11.84  50.74  
1 1 1 10  1   19 o 12 280.17  31.33  2474.11   495.33   2488.26  700.96   2459.99   700.04   266.61  47.54  264.80  47.81  1.81    67.42  
1 1 1 10  1   20 o 5  81.06   19.18  203.35    87.83    238.31   124.52   168.73    123.91   87.06   24.10  75.21   24.77  11.85   34.56  
1 1 1 10  1   21 o 1  136.75  18.04  566.47    138.20   560.27   197.79   572.40    193.17   132.00  27.01  133.92  26.07  -1.92   37.54  
1 1 1 10  1   22 o 2  52.66   19.66  67.04     79.81    12.28    117.50   113.93    108.74   52.13   22.25  64.42   23.12  -12.29  32.09  
1 1 1 10  1   23 f 0  159.63  20.14  787.31    180.50   688.54   255.52   885.70    255.02   141.76  32.14  164.39  28.03  -22.63  42.65  
1 1 1 10  1   24 o 15 154.00  20.06  738.73    173.12   785.02   246.49   693.66    243.21   152.58  29.20  142.08  30.72  10.50   42.38  
1 1 1 10  1   25 o 10 143.82  29.62  716.92    236.39   0.00     0.00     716.92    236.39   ?       ?      143.82  29.62  0.00    29.62  
1 1 1 10  1   26 x 0  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 10  2   0  o 2  332.91  34.88  3335.53   656.79   3211.98  928.57   3459.23   929.12   317.61  52.78  331.17  50.46  -13.56  73.02  
1 1 1 10  2   1  o 3  244.15  25.38  1763.20   350.54   1735.65  495.62   1790.77   495.87   238.20  37.48  242.28  36.81  -4.08   52.53  
1 1 1 10  2   2  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 10  2   3  o 17 337.60  35.68  3436.82   681.06   3508.02  963.05   3365.59   963.28   332.50  52.17  324.77  53.53  7.73    74.75  
1 1 1 10  2   4  o 5  276.31  28.80  2272.63   450.12   2227.38  636.21   2317.98   636.92   267.97  42.80  273.90  41.83  -5.93   59.84  
1 1 1 10  2   5  o 1  156.01  16.96  713.35    149.45   746.92   209.92   678.84    212.82   158.15  23.86  150.19  25.60  7.96    35.00  
1 1 1 10  2   6  o 5  410.77  44.48  5217.84   1032.05  5363.33  1459.40  5072.30   1459.68  400.61  65.74  387.44  68.11  13.16   94.66  
1 1 1 10  2   7  o 19 133.19  15.47  520.17    116.09   579.20   163.80   460.59    164.55   139.48  21.12  123.41  24.09  16.06   32.04  
1 1 1 10  2   8  o 3  477.27  53.09  7245.07   1430.05  7311.81  2022.07  7178.29   2022.73  452.68  80.77  447.38  81.77  5.30    114.94 
1 1 1 10  2   9  o 16 106.17  15.06  332.41    89.20    336.94   122.03   327.21    130.70   105.79  20.84  103.92  22.56  1.86    30.71  
1 1 1 10  2   10 o 6  121.68  23.69  447.03    159.54   0.00     0.00     447.03    159.54   ?       ?      121.68  23.69  0.00    23.69  
1 1 1 10  2   11 o 19 415.51  71.39  5872.75   1641.49  0.00     0.00     5872.75   1641.49  ?       ?      415.51  71.39  0.00    71.39  
1 1 1 10  2   12 o 5  278.14  44.31  2414.49   683.84   0.00     0.00     2414.49   683.84   ?       ?      278.14  44.31  0.00    44.31  
1 1 1 10  2   13 o 17 337.02  35.97  3448.35   685.19   3540.85  968.49   3355.65   969.52   331.87  52.59  321.73  54.43  10.14   75.69  
1 1 1 10  2   14 o 9  255.49  25.83  1945.74   373.70   -361.48  521.92   4373.00   535.32   90.52   42.00  384.67  24.37  -294.15 48.56  
1 1 1 10  2   15 o 11 420.54  83.56  6974.66   1946.25  6974.66  1946.25  0.00      0.00     420.54  83.56  ?       ?      0.00    83.56  
1 1 1 10  2   16 o 8  196.24  32.06  1199.68   348.68   1199.68  348.68   0.00      0.00     196.24  32.06  ?       ?      0.00    32.06  
1 1 1 10  2   17 o 9  278.74  48.20  2635.30   743.29   2635.30  743.29   0.00      0.00     278.74  48.20  ?       ?      0.00    48.20  
1 1 1 10  2   18 o 3  206.80  22.80  1291.55   266.16   1284.20  375.96   1298.94   376.85   200.53  33.86  201.79  33.72  -1.25   47.79  
1 1 1 10  2   19 o 16 173.31  19.97  904.13    195.09   896.34   275.97   911.92    275.84   168.09  29.68  169.74  29.37  -1.65   41.76  
1 1 1 10  2   20 o 11 293.72  33.87  2805.55   560.58   2898.54  793.12   2712.73   792.45   278.98  51.42  267.05  53.56  11.94   74.24  
1 1 1 10  2   21 o 8  206.98  23.73  1329.65   276.85   1310.53  391.31   1348.81   391.73   196.47  36.02  199.86  35.44  -3.39   50.53  
1 1 1 10  2   22 o 11 50.86   19.89  52.03     84.25    93.72    119.44   10.75     118.86   62.59   23.90  52.19   22.32  10.41   32.70  
1 1 1 10  2   23 o 19 140.00  18.84  603.02    147.54   581.92   211.44   623.04    205.96   132.00  28.72  137.79  27.00  -5.79   39.42  
1 1 1 10  2   24 o 16 127.08  18.85  501.92    133.35   573.03   193.10   437.10    184.38   131.43  26.51  113.31  28.40  18.12   38.85  
1 1 1 10  2   25 o 11 110.18  27.90  420.01    176.66   0.00     0.00     420.01    176.66   ?       ?      110.18  27.90  0.00    27.90  
1 1 1 10  2   26 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 10  3   0  o 2  199.22  20.64  1166.80   232.62   1063.97  328.02   1270.85   329.95   187.16  31.66  205.85  28.70  -18.69  42.73  
1 1 1 10  3   1  o 12 593.96  138.86 16689.99  4649.39  16689.99 4649.39  0.00      0.00     593.96  138.86 ?       ?      0.00    138.86 
1 1 1 10  3   2  o 1  413.55  70.64  5794.56   1616.96  0.00     0.00     5794.56   1616.96  ?       ?      413.55  70.64  0.00    70.64  
1 1 1 10  3   3  o 15 377.93  62.81  4708.34   1314.93  0.00     0.00     4708.34   1314.93  ?       ?      377.93  62.81  0.00    62.81  
1 1 1 10  3   4  o 18 159.53  17.48  746.50    157.46   794.44   222.81   698.68    222.55   163.02  24.57  152.20  26.43  10.81   36.09  
1 1 1 10  3   5  o 14 398.61  42.72  4888.35   962.30   4739.69  1360.75  5037.09   1361.05  376.63  65.30  390.42  62.86  -13.80  90.64  
1 1 1 10  3   6  o 17 456.33  50.03  6550.93   1289.19  6391.72  1822.91  6710.25   1823.46  426.70  77.26  439.74  74.92  -13.04  107.62 
1 1 1 10  3   7  o 4  174.39  18.79  893.46    185.11   858.94   261.31   928.23    262.25   168.64  27.97  175.78  26.84  -7.14   38.76  
1 1 1 10  3   8  o 15 515.11  101.90 10426.43  2906.59  10426.43 2906.59  0.00      0.00     515.11  101.90 ?       ?      0.00    101.90 
1 1 1 10  3   9  f 0  438.88  77.36  6727.46   1877.88  0.00     0.00     6727.46   1877.88  ?       ?      438.88  77.36  0.00    77.36  
1 1 1 10  3   10 o 15 493.18  92.53  9046.97   2523.51  0.00     0.00     9046.97   2523.51  ?       ?      493.18  92.53  0.00    92.53  
1 1 1 10  3   11 o 5  277.02  44.13  2391.62   678.20   0.00     0.00     2391.62   678.20   ?       ?      277.02  44.13  0.00    44.13  
1 1 1 10  3   12 o 6  480.74  53.54  7359.71   1452.50  7329.25  2053.59  7390.19   2054.69  451.81  82.20  454.13  81.82  -2.33   115.99 
1 1 1 10  3   13 o 1  271.86  28.80  2211.36   442.61   2237.54  623.98   2184.84   627.93   267.66  41.99  263.97  42.91  3.69    60.04  
1 1 1 10  3   14 o 10 276.54  28.11  2295.78   440.13   -32.60   614.92   4741.67   630.25   111.91  49.28  398.57  27.72  -286.66 56.54  
1 1 1 10  3   15 o 15 259.33  42.48  2160.20   610.55   2160.20  610.55   0.00      0.00     259.33  42.48  ?       ?      0.00    42.48  
1 1 1 10  3   16 o 1  154.31  26.38  731.58    225.32   731.58   225.32   0.00      0.00     154.31  26.38  ?       ?      0.00    26.38  
1 1 1 10  3   17 o 13 373.71  79.45  5909.62   1651.91  5909.62  1651.91  0.00      0.00     373.71  79.45  ?       ?      0.00    79.45  
1 1 1 10  3   18 f 0  247.30  27.25  1881.37   380.45   1897.93  536.85   1864.65   539.23   239.33  40.52  236.68  41.18  2.65    57.77  
1 1 1 10  3   19 o 5  194.41  21.91  1147.03   240.27   1177.26  339.30   1116.62   340.28   191.46  32.00  185.67  33.14  5.79    46.07  
1 1 1 10  3   20 o 18 139.26  18.02  585.43    140.66   606.87   198.17   563.66    199.69   138.45  25.88  132.75  27.12  5.71    37.49  
1 1 1 10  3   21 o 10 290.57  34.51  2819.81   564.46   2873.60  798.45   2766.08   798.07   268.86  53.61  261.83  54.85  7.03    76.70  
1 1 1 10  3   22 o 14 201.44  23.46  1271.03   266.22   1323.82  377.08   1218.57   375.90   196.58  34.68  186.98  36.33  9.60    50.23  
1 1 1 10  3   23 o 7  65.45   20.80  131.60    87.82    171.81   125.11   92.55     123.30   74.45   24.90  62.48   24.17  11.97   34.70  
1 1 1 10  3   24 o 5  59.85   21.59  100.03    94.93    146.87   137.13   56.93     131.55   70.91   25.89  58.76   24.19  12.15   35.44  
1 1 1 10  3   25 o 13 145.34  31.06  752.03    251.28   752.03   251.28   0.00      0.00     145.34  31.06  ?       ?      0.00    31.06  
1 1 1 10  3   26 o 12 75.95   26.76  189.28    145.03   0.00     0.00     189.28    145.03   ?       ?      75.95   26.76  0.00    26.76  
1 1 1 10  4   0  o 9  203.35  21.68  1217.98   249.14   1299.79  352.76   1136.57   351.91   207.69  30.50  193.21  32.91  14.48   44.86  
1 1 1 10  4   1  x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 10  4   2  o 9  351.31  36.86  3736.67   732.31   3501.43  1035.29  3972.23   1035.99  328.73  56.92  353.30  52.69  -24.57  77.56  
1 1 1 10  4   3  o 17 436.96  47.16  5940.08   1164.16  5629.47  1645.98  6250.97   1646.75  404.28  73.63  430.73  68.92  -26.45  100.86 
1 1 1 10  4   4  o 12 257.58  26.81  1970.04   390.70   1876.46  551.66   2064.22   553.42   246.29  40.42  259.46  38.31  -13.17  55.69  
1 1 1 10  4   5  f 0  422.53  45.62  5535.47   1089.02  5372.24  1539.78  5698.84   1540.43  397.50  70.04  411.83  67.49  -14.34  97.26  
1 1 1 10  4   6  o 18 122.06  22.12  447.54    149.27   0.00     0.00     447.54    149.27   ?       ?      122.06  22.12  0.00    22.12  
1 1 1 10  4   7  o 6  353.69  37.70  3798.29   753.73   3880.79  1066.07  3715.83   1065.80  347.24  55.34  338.68  56.83  8.56    79.32  
1 1 1 10  4   8  f 0  381.10  63.58  4800.28   1341.94  0.00     0.00     4800.28   1341.94  ?       ?      381.10  63.58  0.00    63.58  
1 1 1 10  4   9  o 4  471.96  85.87  8030.26   2240.73  0.00     0.00     8030.26   2240.73  ?       ?      471.96  85.87  0.00    85.87  
1 1 1 10  4   10 o 10 485.06  90.07  8658.41   2415.76  0.00     0.00     8658.41   2415.76  ?       ?      485.06  90.07  0.00    90.07  
1 1 1 10  4   11 o 3  264.90  27.91  2088.95   418.07   2007.02  590.00   2171.58   592.49   254.12  41.90  265.32  40.15  -11.20  58.04  
1 1 1 10  4   12 o 10 307.95  32.62  2857.22   567.83   2829.54  802.07   2885.03   803.99   298.34  48.50  301.56  48.05  -3.22   68.27  
1 1 1 10  4   13 o 13 193.65  20.14  1106.26   220.63   -306.52  303.41   2691.38   321.39   65.85   31.02  303.43  18.54  -237.58 36.14  
1 1 1 10  4   14 o 19 190.73  30.28  1115.56   320.48   1115.56  320.48   0.00      0.00     190.73  30.28  ?       ?      0.00    30.28  
1 1 1 10  4   15 o 12 327.05  57.95  3740.20   1048.24  3740.20  1048.24  0.00      0.00     327.05  57.95  ?       ?      0.00    57.95  
1 1 1 10  4   16 o 18 304.45  54.15  3245.87   911.73   3245.87  911.73   0.00      0.00     304.45  54.15  ?       ?      0.00    54.15  
1 1 1 10  4   17 o 17 314.17  35.08  3129.89   621.92   3006.85  878.22   3253.66   880.85   289.49  54.85  304.04  52.36  -14.55  75.83  
1 1 1 10  4   18 o 17 286.56  32.06  2593.50   518.40   2496.47  732.23   2691.00   734.04   265.10  49.95  277.67  47.77  -12.57  69.12  
1 1 1 10  4   19 o 1  137.77  18.01  571.40    139.02   658.80   197.04   484.76    196.17   145.46  24.46  122.79  28.40  22.67   37.48  
1 1 1 10  4   20 o 12 146.86  18.43  653.06    151.97   646.05   213.77   660.23    216.08   141.97  27.22  143.56  27.21  -1.59   38.49  
1 1 1 10  4   21 o 2  59.27   20.17  100.63    82.12    74.70    114.63   127.98    117.71   59.33   23.20  67.56   24.08  -8.23   33.44  
1 1 1 10  4   22 o 14 78.94   20.06  196.95    91.10    171.26   127.05   224.13    130.70   74.72   25.10  83.46   25.18  -8.74   35.55  
1 1 1 10  4   23 o 6  138.09  19.34  591.92    149.10   730.15   213.32   459.89    208.48   149.60  25.77  115.15  30.90  34.45   40.23  
1 1 1 10  4   24 o 5  82.64   21.08  221.22    100.33   212.63   144.85   229.14    139.09   80.58   26.79  83.08   26.14  -2.50   37.43  
1 1 1 10  4   25 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 10  4   26 o 6  115.27  30.01  485.57    200.46   0.00     0.00     485.57    200.46   ?       ?      115.27  30.01  0.00    30.01  
1 1 1 10  5   0  o 6  215.18  33.35  1402.25   398.67   1402.25  398.67   0.00      0.00     215.18  33.35  ?       ?      0.00    33.35  
1 1 1 10  5   1  o 4  524.84  100.45 10460.97  2916.16  0.00     0.00     10460.97  2916.16  ?       ?      524.84  100.45 0.00    100.45 
1 1 1 10  5   2  o 18 514.67  57.19  8451.92   1661.15  8260.66  2349.06  8643.24   2349.39  477.29  89.01  491.29  86.46  -14.00  124.08 
1 1 1 10  5   3  o 3  536.98  106.19 11328.07  3157.29  11328.07 3157.29  0.00      0.00     536.98  106.19 ?       ?      0.00    106.19 
1 1 1 10  5   4  o 3  322.33  34.17  3123.86   622.74   3232.45  880.55   3015.21   880.82   320.43  49.46  308.10  51.63  12.33   71.50  
1 1 1 10  5   5  o 10 238.03  24.88  1675.37   335.01   1637.23  473.07   1713.74   474.49   231.37  36.85  237.14  35.98  -5.78   51.51  
1 1 1 10  5   6  o 2  298.91  31.22  2670.09   527.88   2571.57  745.99   2768.90   747.09   286.42  47.00  298.41  45.01  -11.99  65.07  
1 1 1 10  5   7  o 18 302.74  48.22  2879.37   809.97   0.00     0.00     2879.37   809.97   ?       ?      302.74  48.22  0.00    48.22  
1 1 1 10  5   8  o 16 266.57  42.03  2198.36   621.95   0.00     0.00     2198.36   621.95   ?       ?      266.57  42.03  0.00    42.03  
1 1 1 10  5   9  o 9  167.07  27.79  841.77    257.16   0.00     0.00     841.77    257.16   ?       ?      167.07  27.79  0.00    27.79  
1 1 1 10  5   10 o 2  530.35  59.98  9142.04   1794.14  8753.76  2537.17  9530.40   2537.44  479.09  95.60  506.92  90.52  -27.83  131.66 
1 1 1 10  5   11 o 6  286.99  30.40  2469.35   493.17   2474.43  697.55   2464.27   697.33   280.62  44.81  279.98  44.90  0.64    63.43  
1 1 1 10  5   12 o 12 423.68  47.17  5686.24   1127.75  5855.65  1594.60  5516.71   1595.15  408.02  70.64  392.96  73.41  15.06   101.88 
1 1 1 10  5   13 o 1  209.35  20.92  1296.94   248.07   -5.23    340.14   2776.65   362.59   86.03   37.29  307.15  20.68  -221.11 42.64  
1 1 1 10  5   14 o 19 136.17  24.39  565.49    183.68   565.49   183.68   0.00      0.00     136.17  24.39  ?       ?      0.00    24.39  
1 1 1 10  5   15 o 6  176.80  29.40  969.83    287.96   969.83   287.96   0.00      0.00     176.80  29.40  ?       ?      0.00    29.40  
1 1 1 10  5   16 o 15 209.85  35.00  1406.12   406.83   1406.12  406.83   0.00      0.00     209.85  35.00  ?       ?      0.00    35.00  
1 1 1 10  5   17 o 15 234.49  25.78  1682.37   341.28   1659.45  481.03   1705.61   484.27   224.69  38.69  228.10  38.34  -3.41   54.47  
1 1 1 10  5   18 o 19 187.36  21.43  1063.83   226.38   1049.36  317.89   1078.73   322.45   180.64  31.82  183.20  31.81  -2.57   44.99  
1 1 1 10  5   19 o 6  252.83  28.61  2020.91   407.93   1953.71  574.73   2089.14   579.11   234.51  44.31  244.14  42.88  -9.62   61.67  
1 1 1 10  5   20 o 11 324.30  40.04  3668.61   729.56   3572.12  1029.93  3765.79   1033.59  281.64  65.02  292.64  63.36  -11.00  90.79  
1 1 1 10  5   21 o 19 252.75  29.62  2085.53   421.58   1949.31  594.14   2223.66   598.29   224.28  47.62  244.35  44.28  -20.07  65.03  
1 1 1 10  5   22 o 14 308.60  39.89  3463.95   690.08   3336.84  974.66   3591.71   977.19   257.14  65.77  272.55  63.62  -15.41  91.51  
1 1 1 10  5   23 f 0  272.12  34.28  2606.75   523.67   2538.02  739.95   2675.73   741.23   234.65  55.76  244.16  54.29  -9.51   77.82  
1 1 1 10  5   24 o 3  80.34   26.06  214.40    137.37   214.40   137.37   0.00      0.00     80.34   26.06  ?       ?      0.00    26.06  
1 1 1 10  5   25 o 7  50.93   22.68  -15.75    133.93   0.00     0.00     -15.75    133.93   ?       ?      50.93   22.68  0.00    22.68  
1 1 1 10  6   0  x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 10  6   1  o 16 245.30  25.77  1778.67   357.46   1785.25  504.86   1772.05   506.20   241.96  37.56  240.95  37.84  1.01    53.32  
1 1 1 10  6   2  o 18 566.50  64.42  10421.35  2057.81  10556.61 2909.89  10286.05  2910.47  531.63  98.99  522.53  100.68 9.10    141.19 
1 1 1 10  6   3  o 13 370.51  39.34  4161.97   823.96   4179.24  1164.68  4144.68   1165.83  360.47  58.27  358.72  58.64  1.76    82.67  
1 1 1 10  6   4  o 15 248.20  26.31  1824.15   369.20   1909.75  521.60   1738.22   522.64   250.27  37.45  237.71  39.70  12.56   54.58  
1 1 1 10  6   5  o 10 460.53  81.37  7424.90   2072.47  0.00     0.00     7424.90   2072.47  ?       ?      460.53  81.37  0.00    81.37  
1 1 1 10  6   6  o 6  478.65  86.70  8223.94   2294.65  0.00     0.00     8223.94   2294.65  ?       ?      478.65  86.70  0.00    86.70  
1 1 1 10  6   7  o 10 183.06  29.66  1011.99   301.01   0.00     0.00     1011.99   301.01   ?       ?      183.06  29.66  0.00    29.66  
1 1 1 10  6   8  o 19 323.55  52.25  3337.88   937.40   0.00     0.00     3337.88   937.40   ?       ?      323.55  52.25  0.00    52.25  
1 1 1 10  6   9  o 5  323.13  34.29  3152.12   626.46   3173.74  885.35   3130.45   886.54   315.62  50.57  313.12  51.08  2.50    71.88  
1 1 1 10  6   10 o 15 381.85  41.60  4506.42   897.12   4721.62  1268.23  4290.89   1269.20  376.82  60.69  355.85  64.50  20.97   88.57  
1 1 1 10  6   11 o 15 164.45  18.34  797.04    170.23   775.04   238.25   819.99    243.32   159.81  26.93  164.56  26.67  -4.75   37.90  
1 1 1 10  6   12 o 12 26.43   13.25  -250.81   86.93    -250.81  86.93    0.00      0.00     26.43   13.25  ?       ?      0.00    13.25  
1 1 1 10  6   13 o 18 220.29  35.46  1523.50   433.22   1523.50  433.22   0.00      0.00     220.29  35.46  ?       ?      0.00    35.46  
1 1 1 10  6   14 o 18 424.51  105.72 9199.52   2566.59  9199.52  2566.59  0.00      0.00     424.51  105.72 ?       ?      0.00    105.72 
1 1 1 10  6   15 o 15 75.49   23.20  171.03    110.26   171.03   110.26   0.00      0.00     75.49   23.20  ?       ?      0.00    23.20  
1 1 1 10  6   16 o 4  312.92  35.36  3124.45   624.09   3201.47  882.22   3047.31   882.98   299.13  53.33  289.78  55.09  9.34    76.68  
1 1 1 10  6   17 o 18 221.81  25.02  1509.63   313.09   1654.10  441.96   1364.11   443.58   225.57  35.29  201.33  39.79  24.24   53.18  
1 1 1 10  6   18 o 8  207.75  23.35  1324.83   273.68   1280.80  386.10   1369.30   388.00   196.34  35.56  204.06  34.34  -7.71   49.44  
1 1 1 10  6   19 o 2  179.25  20.92  983.30    211.26   1042.02  297.06   923.21    300.51   179.15  29.94  166.69  32.57  12.47   44.24  
1 1 1 10  6   20 o 6  241.41  28.13  1875.59   382.49   1870.06  538.29   1881.23   543.59   225.85  43.09  226.12  43.45  -0.27   61.20  
1 1 1 10  6   21 o 15 347.87  48.56  4768.41   943.36   4514.89  1332.42  5023.23   1335.81  267.28  80.35  293.61  77.96  -26.32  111.95 
1 1 1 10  6   22 o 8  236.46  28.49  1851.94   379.00   1783.65  533.97   1921.26   538.02   211.99  45.25  222.48  43.69  -10.49  62.90  
1 1 1 10  6   23 o 8  106.55  20.42  362.54    120.33   353.70   165.34   372.49    175.44   101.50  27.64  103.68  28.57  -2.18   39.75  
1 1 1 10  6   24 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 10  6   25 o 4  181.46  40.73  1379.98   413.81   0.00     0.00     1379.98   413.81   ?       ?      181.46  40.73  0.00    40.73  
1 1 1 10  7   0  o 12 388.73  64.75  4988.23   1394.15  0.00     0.00     4988.23   1394.15  ?       ?      388.73  64.75  0.00    64.75  
1 1 1 10  7   1  o 4  416.89  70.87  5855.36   1635.41  0.00     0.00     5855.36   1635.41  ?       ?      416.89  70.87  0.00    70.87  
1 1 1 10  7   2  o 19 334.89  53.94  3573.52   1001.84  0.00     0.00     3573.52   1001.84  ?       ?      334.89  53.94  0.00    53.94  
1 1 1 10  7   3  o 5  302.08  48.00  2861.72   804.64   0.00     0.00     2861.72   804.64   ?       ?      302.08  48.00  0.00    48.00  
1 1 1 10  7   4  o 13 609.67  149.52 18634.89  5192.37  0.00     0.00     18634.89  5192.37  ?       ?      609.67  149.52 0.00    149.52 
1 1 1 10  7   5  o 7  171.69  28.29  889.39    269.14   0.00     0.00     889.39    269.14   ?       ?      171.69  28.29  0.00    28.29  
1 1 1 10  7   6  o 7  428.53  47.00  5722.22   1137.16  5957.17  1607.68  5486.97   1608.71  419.38  69.19  398.89  72.94  20.49   100.53 
1 1 1 10  7   7  o 15 247.46  26.07  1819.27   364.74   1787.76  515.34   1850.90   516.29   240.62  38.61  245.22  37.90  -4.60   54.10  
1 1 1 10  7   8  o 15 197.64  21.55  1154.34   240.50   1197.07  339.42   1111.25   340.83   198.48  30.78  190.57  32.31  7.91    44.63  
1 1 1 10  7   9  o 1  326.02  34.89  3242.16   642.93   3223.96  908.64   3260.40   909.84   314.32  52.19  316.32  51.90  -2.00   73.60  
1 1 1 10  7   10 o 5  324.37  35.22  3230.23   645.34   3351.88  912.03   3108.25   913.27   319.42  51.49  305.47  54.06  13.95   74.65  
1 1 1 10  7   11 o 9  394.72  75.48  5902.88   1648.01  5902.88  1648.01  0.00      0.00     394.72  75.48  ?       ?      0.00    75.48  
1 1 1 10  7   12 o 10 18.44   7.09   6.45      10.55    6.45     10.55    0.00      0.00     18.44   7.09   ?       ?      0.00    7.09   
1 1 1 10  7   13 o 6  352.66  67.76  4729.11   1322.04  4729.11  1322.04  0.00      0.00     352.66  67.76  ?       ?      0.00    67.76  
1 1 1 10  7   14 o 4  176.83  29.46  975.75    288.50   975.75   288.50   0.00      0.00     176.83  29.46  ?       ?      0.00    29.46  
1 1 1 10  7   15 o 19 319.76  36.39  3281.14   656.06   3418.30  927.04   3143.51   928.60   307.91  54.44  291.55  57.53  16.36   79.20  
1 1 1 10  7   16 o 19 353.48  42.76  4222.97   850.07   4665.89  1201.96  3779.74   1202.39  343.68  63.25  295.72  71.60  47.96   95.54  
1 1 1 10  7   17 o 5  96.69   18.48  286.41    98.82    328.19   141.21   246.30    138.35   101.84  24.46  88.42   25.72  13.42   35.49  
1 1 1 10  7   18 o 6  171.74  20.72  901.54    200.16   961.95   282.00   840.22    284.15   172.40  29.56  159.25  32.19  13.15   43.70  
1 1 1 10  7   19 o 12 55.25   20.42  76.63     85.66    90.31    124.09   64.17     118.40   62.78   24.26  58.48   23.36  4.30    33.68  
1 1 1 10  7   20 o 18 230.24  27.30  1711.40   353.88   1798.85  499.80   1623.49   501.11   222.28  40.67  207.77  43.41  14.50   59.49  
1 1 1 10  7   21 o 12 73.34   21.41  170.96    95.76    156.36   138.35   184.38    132.67   72.73   26.08  76.60   25.64  -3.87   36.58  
1 1 1 10  7   22 o 9  132.35  19.10  547.13    140.95   497.73   198.85   597.02    199.82   120.02  29.15  133.32  27.04  -13.30  39.76  
1 1 1 10  7   23 o 11 106.77  28.77  402.26    180.32   402.26   180.32   0.00      0.00     106.77  28.77  ?       ?      0.00    28.77  
1 1 1 10  7   24 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 10  8   0  o 4  270.90  43.52  2312.05   653.93   0.00     0.00     2312.05   653.93   ?       ?      270.90  43.52  0.00    43.52  
1 1 1 10  8   1  o 17 141.91  24.41  607.29    191.68   0.00     0.00     607.29    191.68   ?       ?      141.91  24.41  0.00    24.41  
1 1 1 10  8   2  o 7  320.40  34.05  3110.98   616.75   3103.15  871.42   3118.83   873.00   310.62  50.61  311.45  50.56  -0.83   71.54  
1 1 1 10  8   3  o 1  127.05  15.62  474.61    111.56   463.66   154.20   486.63    161.59   124.05  22.48  127.04  23.00  -2.98   32.17  
1 1 1 10  8   4  o 5  407.61  44.59  5198.65   1026.41  5172.81  1451.09  5224.52   1452.03  387.14  67.76  389.45  67.39  -2.32   95.56  
1 1 1 10  8   5  o 12 121.01  15.37  431.10    104.34   429.87   142.86   432.50    152.75   119.47  21.63  119.51  23.10  -0.03   31.64  
1 1 1 10  8   6  o 5  347.13  37.45  3706.64   734.57   3716.92  1037.96  3696.33   1039.74  334.67  56.00  333.49  56.31  1.19    79.42  
1 1 1 10  8   7  o 1  110.24  15.67  359.62    96.39    356.50   132.28   363.15    140.76   108.36  22.02  109.15  23.18  -0.79   31.97  
1 1 1 10  8   8  f 0  354.51  62.38  4373.45   1223.26  4373.45  1223.26  0.00      0.00     354.51  62.38  ?       ?      0.00    62.38  
1 1 1 10  8   9  o 16 304.05  51.49  3087.64   866.67   3087.64  866.67   0.00      0.00     304.05  51.49  ?       ?      0.00    51.49  
1 1 1 10  8   10 f 0  416.82  89.31  7425.78   2072.59  7425.78  2072.59  0.00      0.00     416.82  89.31  ?       ?      0.00    89.31  
1 1 1 10  8   11 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 10  8   12 o 7  168.21  27.26  872.93    254.18   872.93   254.18   0.00      0.00     168.21  27.26  ?       ?      0.00    27.26  
1 1 1 10  8   13 o 5  162.17  18.73  784.58    171.20   776.40   241.07   792.90    243.17   157.99  27.58  159.73  27.51  -1.74   38.96  
1 1 1 10  8   14 o 16 120.38  16.81  433.45    112.99   468.30   157.98   396.95    161.68   123.18  23.19  112.46  25.62  10.71   34.56  
1 1 1 10  8   15 o 2  113.16  16.73  384.75    105.41   287.07   141.91   504.99    157.45   95.40   25.45  128.07  22.22  -32.67  33.78  
1 1 1 10  8   16 o 17 298.81  34.75  2920.47   584.92   2996.95  825.00   2843.17   829.42   281.82  52.94  271.56  55.09  10.26   76.40  
1 1 1 10  8   17 o 7  300.31  35.79  3018.18   604.94   3104.64  853.73   2930.99   857.32   279.58  55.15  268.07  57.44  11.51   79.63  
1 1 1 10  8   18 o 15 216.60  24.88  1475.68   303.76   1501.23  426.63   1449.42   432.58   208.19  37.06  203.12  38.51  5.07    53.44  
1 1 1 10  8   19 o 9  312.31  40.63  3523.05   711.19   3823.72  1004.75  3221.17   1006.79  288.03  62.56  250.92  68.15  37.10   92.51  
1 1 1 10  8   20 o 14 64.70   20.74  128.30    87.22    86.22    118.05   178.87    129.42   60.84   23.62  75.65   25.33  -14.81  34.63  
1 1 1 10  8   21 o 7  163.33  21.14  841.49    193.60   894.07   273.81   788.93    273.78   160.90  30.76  149.08  32.88  11.83   45.03  
1 1 1 10  8   22 o 15 227.93  29.05  1780.26   371.47   1911.94  524.39   1647.63   526.27   215.69  43.85  193.37  47.71  22.33   64.80  
1 1 1 10  8   23 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 10  8   24 o 18 47.15   21.90  -79.26    142.43   0.00     0.00     -79.26    142.43   ?       ?      47.15   21.90  0.00    21.90  
1 1 1 10  9   0  o 7  411.50  46.46  5450.79   1078.38  5502.84  1524.25  5398.63   1525.87  387.51  71.14  382.61  72.12  4.91    101.30 
1 1 1 10  9   1  o 8  141.69  16.96  592.73    135.22   596.86   182.95   587.76    200.75   140.47  23.52  138.59  26.19  1.88    35.20  
1 1 1 10  9   2  f 0  461.72  53.44  7069.01   1390.26  6856.32  1965.03  7282.16   1967.21  414.84  85.36  432.34  82.27  -17.49  118.55 
1 1 1 10  9   3  o 8  179.95  19.64  958.52    199.55   967.87   280.21   948.91    284.24   178.02  28.37  175.95  29.16  2.07    40.68  
1 1 1 10  9   4  o 1  381.29  70.59  5327.91   1488.12  5327.91  1488.12  0.00      0.00     381.29  70.59  ?       ?      0.00    70.59  
1 1 1 10  9   5  o 19 431.09  90.44  7766.33   2166.55  7766.33  2166.55  0.00      0.00     431.09  90.44  ?       ?      0.00    90.44  
1 1 1 10  9   6  o 16 288.85  48.43  2757.61   774.64   2757.61  774.64   0.00      0.00     288.85  48.43  ?       ?      0.00    48.43  
1 1 1 10  9   7  o 8  363.49  67.93  4885.19   1365.32  4885.19  1365.32  0.00      0.00     363.49  67.93  ?       ?      0.00    67.93  
1 1 1 10  9   8  o 3  124.70  23.19  474.77    159.88   474.77   159.88   0.00      0.00     124.70  23.19  ?       ?      0.00    23.19  
1 1 1 10  9   9  o 6  348.73  65.79  4536.31   1268.88  4536.31  1268.88  0.00      0.00     348.73  65.79  ?       ?      0.00    65.79  
1 1 1 10  9   10 o 18 198.25  21.84  1178.39   244.45   1246.55  343.88   1108.77   347.55   199.90  30.97  187.02  33.61  12.87   45.70  
1 1 1 10  9   11 f 0  92.07   15.44  254.03    78.73    0.68     94.88    814.22    141.08   46.63   19.95  166.40  14.93  -119.77 24.91  
1 1 1 10  9   12 o 12 73.59   17.67  165.60    73.68    156.96   97.70    177.00    112.20   72.12   21.78  76.49   23.38  -4.37   31.95  
1 1 1 10  9   13 o 3  221.25  24.14  1493.69   301.61   1392.68  425.47   1595.73   427.62   205.45  37.46  222.20  34.65  -16.75  51.03  
1 1 1 10  9   14 o 14 115.34  17.21  401.03    110.49   420.99   154.89   380.36    157.66   115.88  24.07  109.56  25.54  6.32    35.10  
1 1 1 10  9   15 o 2  101.77  17.73  315.80    99.84    318.41   140.49   313.14    141.90   100.07  24.63  99.15   24.95  0.91    35.06  
1 1 1 10  9   16 o 14 231.76  26.97  1700.25   352.11   1852.70  495.97   1545.33   499.96   231.46  38.69  206.27  43.59  25.19   58.28  
1 1 1 10  9   17 o 2  215.64  25.03  1466.12   304.06   1498.87  429.50   1433.22   430.50   207.39  37.45  201.60  38.60  5.79    53.79  
1 1 1 10  9   18 o 13 57.15   20.14  90.63     82.18    99.11    109.95   79.90     123.72   61.94   23.09  61.05   24.04  0.90    33.33  
1 1 1 10  9   19 o 1  109.25  18.34  370.52    110.94   381.71   150.88   357.34    163.71   107.86  24.87  103.25  27.23  4.62    36.88  
1 1 1 10  9   20 o 5  174.84  21.55  966.30    211.77   990.55   295.39   940.66    303.77   168.69  31.67  162.40  33.69  6.29    46.23  
1 1 1 10  9   21 o 8  141.16  19.79  629.63    155.95   642.59   212.00   614.34    230.22   136.77  27.95  131.06  31.07  5.71    41.79  
1 1 1 10  9   22 x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 10  9   23 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 10  10  0  o 17 339.46  61.34  4114.06   1151.40  4114.06  1151.40  0.00      0.00     339.46  61.34  ?       ?      0.00    61.34  
1 1 1 10  10  1  o 11 157.39  26.46  758.61    230.63   758.61   230.63   0.00      0.00     157.39  26.46  ?       ?      0.00    26.46  
1 1 1 10  10  2  o 12 288.52  48.93  2779.90   781.45   2779.90  781.45   0.00      0.00     288.52  48.93  ?       ?      0.00    48.93  
1 1 1 10  10  3  o 5  432.16  101.21 8845.05   2466.62  8845.05  2466.62  0.00      0.00     432.16  101.21 ?       ?      0.00    101.21 
1 1 1 10  10  4  o 19 218.47  35.35  1505.52   428.18   1505.52  428.18   0.00      0.00     218.47  35.35  ?       ?      0.00    35.35  
1 1 1 10  10  5  o 6  135.91  16.43  546.78    125.57   581.62   172.70   507.71    182.91   138.51  22.49  128.22  25.74  10.28   34.18  
1 1 1 10  10  6  o 4  274.27  29.93  2310.16   463.60   2391.82  654.28   2227.82   656.98   269.75  43.75  258.53  45.95  11.22   63.45  
1 1 1 10  10  7  o 7  228.85  24.89  1584.16   321.78   1646.77  453.56   1520.70   456.59   227.46  35.93  217.19  38.00  10.27   52.30  
1 1 1 10  10  8  f 0  376.37  44.21  4685.36   937.06   5017.10  1324.56  4352.98   1325.84  362.58  66.07  328.81  72.22  33.77   97.88  
1 1 1 10  10  9  o 9  204.13  22.47  1256.31   258.97   1311.13  362.67   1199.27   369.91   203.81  32.05  193.36  34.60  10.45   47.16  
1 1 1 10  10  10 o 19 160.60  17.89  768.75    162.12   640.55   220.19   920.52    239.58   142.73  27.87  173.18  24.81  -30.46  37.31  
1 1 1 10  10  11 o 19 231.87  40.24  1799.46   516.18   0.00     0.00     1799.46   516.18   ?       ?      231.87  40.24  0.00    40.24  
1 1 1 10  10  12 o 3  82.82   23.93  213.46    120.16   0.00     0.00     213.46    120.16   ?       ?      82.82   23.93  0.00    23.93  
1 1 1 10  10  13 o 5  244.41  27.66  1876.11   381.25   1963.93  537.15   1786.97   541.21   239.12  40.58  225.23  43.43  13.89   59.44  
1 1 1 10  10  14 o 13 185.23  33.47  1139.98   342.78   0.00     0.00     1139.98   342.78   ?       ?      185.23  33.47  0.00    33.47  
1 1 1 10  10  15 o 6  102.17  17.80  320.11    100.60   360.53   133.42   266.85    153.17   106.81  22.47  90.95   27.22  15.86   35.30  
1 1 1 10  10  16 o 7  123.13  18.35  464.76    125.77   498.16   175.50   429.50    180.34   124.21  25.47  114.04  27.80  10.16   37.70  
1 1 1 10  10  17 o 6  111.56  18.15  384.06    112.27   381.81   153.85   386.63    164.19   108.07  25.25  108.13  26.63  -0.06   36.70  
1 1 1 10  10  18 o 18 105.01  19.17  345.56    111.29   378.09   154.87   310.83    160.04   106.87  25.58  96.15   27.57  10.72   37.61  
1 1 1 10  10  19 f 0  179.61  22.06  1025.31   222.70   986.57   309.47   1066.93   320.73   166.22  33.59  173.14  33.48  -6.92   47.43  
1 1 1 10  10  20 o 17 126.17  19.97  506.24    139.83   493.03   192.75   520.93    203.16   118.69  28.62  121.46  29.45  -2.77   41.07  
1 1 1 10  10  21 o 5  67.33   25.89  128.88    140.81   0.00     0.00     128.88    140.81   ?       ?      67.33   25.89  0.00    25.89  
1 1 1 10  10  22 x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 10  11  0  o 11 298.25  33.61  2796.62   565.44   3094.63  798.70   2497.19   800.60   301.53  47.73  263.96  54.64  37.56   72.55  
1 1 1 10  11  1  o 15 101.42  16.45  308.47    92.51    361.71   126.35   246.97    135.81   108.78  20.99  89.35   25.32  19.43   32.89  
1 1 1 10  11  2  o 8  152.68  18.24  694.78    156.72   686.90   218.26   703.16    225.17   148.91  26.50  150.48  27.06  -1.57   37.88  
1 1 1 10  11  3  o 16 247.33  26.97  1870.75   376.72   1817.92  531.17   1924.22   534.37   235.00  40.86  242.72  39.72  -7.72   56.99  
1 1 1 10  11  4  o 4  296.51  32.87  2758.61   550.18   2741.07  776.68   2776.28   779.47   280.98  49.98  282.99  49.80  -2.01   70.56  
1 1 1 10  11  5  o 12 187.40  20.91  1054.55   221.13   1009.06  305.07   1104.91   320.99   178.86  30.82  187.27  30.94  -8.42   43.67  
1 1 1 10  11  6  o 15 336.29  38.61  3674.89   731.94   3766.93  1033.46  3582.25   1036.78  318.10  58.76  307.37  60.91  10.73   84.63  
1 1 1 10  11  7  o 15 204.26  22.86  1265.05   263.47   1420.61  369.78   1104.67   375.48   211.94  31.34  183.19  36.98  28.75   48.47  
1 1 1 10  11  8  o 15 271.60  30.67  2320.30   469.77   2508.45  662.69   2130.25   666.03   270.72  44.16  244.42  49.17  26.30   66.09  
1 1 1 10  11  9  o 1  132.67  16.96  526.96    126.20   608.49   172.78   433.73    184.77   140.84  22.10  116.43  27.99  24.42   35.66  
1 1 1 10  11  10 o 14 60.64   16.36  112.15    58.26    -0.74    65.21    558.45    129.67   38.51   16.51  136.52  16.91  -98.01  23.63  
1 1 1 10  11  11 o 16 72.05   17.81  160.19    73.23    207.84   93.46    84.40     117.86   81.70   20.07  61.56   23.68  20.15   31.04  
1 1 1 10  11  12 o 19 149.34  18.22  674.41    153.01   705.65   210.26   639.24    223.09   149.45  25.42  140.42  28.65  9.03    38.30  
1 1 1 10  11  13 o 15 102.88  25.96  342.36    153.26   0.00     0.00     342.36    153.26   ?       ?      102.88  25.96  0.00    25.96  
1 1 1 10  11  14 o 3  178.82  20.89  984.57    210.38   957.69   292.12   1013.54   303.22   169.73  31.13  174.49  31.43  -4.76   44.23  
1 1 1 10  11  15 o 3  216.14  25.59  1489.28   311.35   1627.74  436.30   1345.60   444.45   215.77  36.53  190.41  41.81  25.35   55.52  
1 1 1 10  11  16 o 9  200.76  23.84  1279.40   269.45   1319.79  375.31   1236.44   387.08   194.02  34.98  184.90  37.75  9.12    51.46  
1 1 1 10  11  17 o 19 166.03  20.58  862.64    191.92   825.86   264.36   903.63    279.08   154.92  30.81  161.93  31.15  -7.01   43.82  
1 1 1 10  11  18 o 6  117.57  29.13  481.23    195.60   0.00     0.00     481.23    195.60   ?       ?      117.57  29.13  0.00    29.13  
1 1 1 10  11  19 f 0  52.49   23.37  -16.86    142.12   0.00     0.00     -16.86    142.12   ?       ?      52.49   23.37  0.00    23.37  
1 1 1 10  11  20 o 17 93.31   29.18  315.22    173.51   0.00     0.00     315.22    173.51   ?       ?      93.31   29.18  0.00    29.18  
1 1 1 10  11  21 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 10  12  0  o 15 53.89   18.60  78.98     69.83    83.88    93.72    72.88     104.71   58.25   21.38  58.21   22.34  0.04    30.92  
1 1 1 10  12  1  o 7  201.42  22.67  1232.44   257.64   1326.82  361.60   1135.12   367.17   203.90  31.94  186.05  35.68  17.85   47.88  
1 1 1 10  12  2  o 10 196.42  22.06  1169.64   244.39   1209.01  342.92   1128.99   348.40   194.47  31.82  186.64  33.76  7.83    46.39  
1 1 1 10  12  3  o 13 257.12  29.23  2069.58   423.75   2337.47  597.88   1799.19   600.67   263.75  40.80  224.53  48.05  39.22   63.04  
1 1 1 10  12  4  o 11 172.02  31.20  949.74    296.79   0.00     0.00     949.74    296.79   ?       ?      172.02  31.20  0.00    31.20  
1 1 1 10  12  5  o 3  132.27  17.94  526.60    132.71   456.81   180.26   609.19    196.09   119.86  26.86  139.49  25.42  -19.63  36.99  
1 1 1 10  12  6  o 5  154.81  18.90  722.31    164.48   701.65   228.18   744.65    237.30   148.69  27.75  153.14  28.02  -4.46   39.44  
1 1 1 10  12  7  o 17 254.40  28.53  2036.64   409.44   1974.50  573.43   2101.28   584.81   237.40  43.69  245.70  43.03  -8.30   61.32  
1 1 1 10  12  8  o 15 117.47  16.26  414.71    106.69   448.83   143.13   372.06    160.04   120.43  21.49  107.83  26.13  12.60   33.83  
1 1 1 10  12  9  o 5  136.41  16.97  559.58    129.99   766.48   176.41   313.81    192.27   158.76  19.78  98.52   30.70  60.24   36.52  
1 1 1 10  12  10 o 2  ?       ?      -240.84   63.22    -342.00  73.50    46.95     123.97   ?       ?      57.49   23.56  0.00    23.56  
1 1 1 10  12  11 o 1  246.13  28.87  1946.55   400.19   2155.35  563.23   1733.65   568.72   246.48  41.26  213.67  47.59  32.81   62.98  
1 1 1 10  12  12 o 1  208.16  23.52  1353.32   276.13   1254.81  385.85   1456.73   395.33   190.01  36.70  207.12  34.46  -17.11  50.34  
1 1 1 10  12  13 o 16 40.49   17.50  -2.79     74.42    42.18    94.10    -77.88    121.60   51.12   20.68  44.51   20.52  6.61    29.13  
1 1 1 10  12  14 f 0  94.63   17.83  277.95    93.32    190.27   120.32   410.35    147.84   77.39   24.31  112.81  23.59  -35.43  33.87  
1 1 1 10  12  15 o 19 104.51  27.61  368.90    168.10   0.00     0.00     368.90    168.10   ?       ?      104.51  27.61  0.00    27.61  
1 1 1 10  12  16 o 18 236.36  56.46  2653.23   755.62   0.00     0.00     2653.23   755.62   ?       ?      236.36  56.46  0.00    56.46  
1 1 1 10  12  17 o 7  110.43  27.94  424.08    177.21   0.00     0.00     424.08    177.21   ?       ?      110.43  27.94  0.00    27.94  
1 1 1 10  12  18 o 16 144.43  31.89  763.61    257.32   0.00     0.00     763.61    257.32   ?       ?      144.43  31.89  0.00    31.89  
1 1 1 10  12  19 o 14 71.40   27.37  154.06    157.02   0.00     0.00     154.06    157.02   ?       ?      71.40   27.37  0.00    27.37  
1 1 1 10  13  0  o 11 83.02   18.47  212.54    85.75    192.96   109.89   243.02    137.13   78.83   22.92  87.86   25.62  -9.02   34.37  
1 1 1 10  13  1  o 7  127.68  17.52  491.36    125.05   561.99   170.91   409.99    183.44   134.60  22.94  112.65  28.38  21.96   36.50  
1 1 1 10  13  2  o 5  262.37  30.44  2194.26   449.98   2460.55  634.95   1925.57   637.80   265.71  43.10  227.20  50.24  38.51   66.19  
1 1 1 10  13  3  o 1  204.70  23.36  1288.38   269.63   1383.32  379.03   1191.11   383.63   205.65  33.24  187.96  36.87  17.70   49.64  
1 1 1 10  13  4  f 0  170.82  19.99  885.48    192.35   907.31   269.47   862.80    274.65   168.26  28.94  163.11  30.45  5.15    42.01  
1 1 1 10  13  5  o 8  258.97  29.83  2142.48   435.32   2260.57  613.48   2022.72   617.81   252.22  43.97  234.51  47.52  17.71   64.74  
1 1 1 10  13  6  o 2  259.60  30.24  2165.60   442.27   2334.09  621.74   1993.01   629.26   255.61  43.95  230.09  49.13  25.53   65.93  
1 1 1 10  13  7  o 6  166.82  20.39  850.64    191.24   877.46   262.55   820.34    279.13   164.78  28.80  157.20  32.02  7.58    43.07  
1 1 1 10  13  8  o 17 128.63  18.43  504.56    132.20   535.44   178.81   467.33    196.35   129.66  24.93  119.07  29.00  10.59   38.24  
1 1 1 10  13  9  o 1  68.05   19.56  143.60    80.47    -25.38   90.25    798.82    177.72   41.99   18.67  161.63  19.55  -119.64 27.03  
1 1 1 10  13  10 o 4  169.27  20.39  882.30    194.18   1045.19  270.77   709.80    278.64   180.12  27.02  143.05  34.36  37.07   43.71  
1 1 1 10  13  11 o 1  180.12  33.89  1116.38   337.55   0.00     0.00     1116.38   337.55   ?       ?      180.12  33.89  0.00    33.89  
1 1 1 10  13  12 o 11 85.56   26.52  238.85    143.68   0.00     0.00     238.85    143.68   ?       ?      85.56   26.52  0.00    26.52  
1 1 1 10  13  13 o 11 96.24   26.34  309.64    149.77   0.00     0.00     309.64    149.77   ?       ?      96.24   26.34  0.00    26.34  
1 1 1 10  13  14 o 14 121.73  28.57  509.03    196.23   0.00     0.00     509.03    196.23   ?       ?      121.73  28.57  0.00    28.57  
1 1 1 10  13  15 o 13 206.47  45.15  1784.49   520.25   0.00     0.00     1784.49   520.25   ?       ?      206.47  45.15  0.00    45.15  
1 1 1 10  13  16 o 6  155.29  32.82  883.63    283.43   0.00     0.00     883.63    283.43   ?       ?      155.29  32.82  0.00    32.82  
1 1 1 10  13  17 o 2  83.56   20.33  228.99    96.58    173.73   120.99   326.06    160.35   72.78   24.49  95.89   27.63  -23.12  36.92  
1 1 1 10  14  0  o 18 68.34   26.13  113.26    142.90   0.00     0.00     113.26    142.90   ?       ?      68.34   26.13  0.00    26.13  
1 1 1 10  14  1  o 3  130.17  29.00  556.10    211.15   0.00     0.00     556.10    211.15   ?       ?      130.17  29.00  0.00    29.00  
1 1 1 10  14  2  o 16 137.43  27.62  612.05    210.38   0.00     0.00     612.05    210.38   ?       ?      137.43  27.62  0.00    27.62  
1 1 1 10  14  3  o 4  186.73  34.46  1179.20   355.80   0.00     0.00     1179.20   355.80   ?       ?      186.73  34.46  0.00    34.46  
1 1 1 10  14  4  o 6  158.35  30.02  825.41    262.86   0.00     0.00     825.41    262.86   ?       ?      158.35  30.02  0.00    30.02  
1 1 1 10  14  5  f 0  58.16   23.95  47.78     128.95   0.00     0.00     47.78     128.95   ?       ?      58.16   23.95  0.00    23.95  
1 1 1 10  14  6  o 19 143.17  29.40  678.85    233.53   0.00     0.00     678.85    233.53   ?       ?      143.17  29.40  0.00    29.40  
1 1 1 10  14  7  o 10 146.40  31.10  723.08    253.29   0.00     0.00     723.08    253.29   ?       ?      146.40  31.10  0.00    31.10  
1 1 1 10  14  8  o 1  145.48  31.36  720.35    254.16   0.00     0.00     720.35    254.16   ?       ?      145.48  31.36  0.00    31.36  
1 1 1 10  14  9  o 1  111.40  28.78  419.88    185.37   0.00     0.00     419.88    185.37   ?       ?      111.40  28.78  0.00    28.78  
1 1 1 10  14  10 o 13 96.64   28.85  316.90    172.24   0.00     0.00     316.90    172.24   ?       ?      96.64   28.85  0.00    28.85  
1 1 1 10  14  11 o 18 68.02   26.25  119.89    145.12   0.00     0.00     119.89    145.12   ?       ?      68.02   26.25  0.00    26.25  
1 1 1 10  14  12 o 19 52.61   19.39  72.50     77.22    75.99    95.88    66.06     130.25   55.85   21.39  59.40   24.22  -3.55   32.31  
1 1 1 10  14  13 o 1  118.04  28.83  486.80    193.65   0.00     0.00     486.80    193.65   ?       ?      118.04  28.83  0.00    28.83  
1 1 1 10  14  14 o 9  57.20   20.21  94.97     82.77    65.76    102.44   149.90    140.48   54.94   21.80  70.65   26.14  -15.71  34.04  
1 1 1 10  15  2  o 18 84.20   20.24  224.12    96.59    264.47   120.32   150.96    162.01   90.69   23.06  74.45   27.97  16.24   36.25  
1 1 1 10  15  3  o 6  143.67  19.46  636.79    156.39   705.92   209.86   550.46    234.53   147.85  25.66  126.26  32.25  21.59   41.21  
1 1 1 10  15  4  o 17 113.50  18.62  398.80    117.14   433.04   155.73   354.18    177.76   115.72  24.22  102.54  28.94  13.18   37.74  
1 1 1 10  15  5  o 19 49.40   19.52  47.39     81.79    -45.21   106.79   178.74    127.19   43.77   19.81  75.64   25.10  -31.87  31.98  
1 1 1 10  15  6  o 15 65.70   20.88  133.11    88.49    200.05   112.29   23.45     143.72   78.85   23.24  57.42   24.55  21.43   33.81  
1 1 1 10  15  7  o 12 180.51  22.41  1030.31   227.22   1204.29  315.50   842.80    327.53   188.80  30.12  150.46  37.94  38.35   48.44  
1 1 1 10  15  8  o 12 ?       ?      -175.71   41.00    -211.55  42.56    286.52    152.87   ?       ?      92.32   27.09  0.00    27.09  
1 1 1 11  -13 0  o 12 197.49  39.75  1490.30   435.05   1490.30  435.05   0.00      0.00     197.49  39.75  ?       ?      0.00    39.75  
1 1 1 11  -13 1  f 0  145.52  19.28  660.95    157.11   732.96   217.38   582.21    227.31   148.44  26.48  128.53  31.14  19.91   40.88  
1 1 1 11  -13 2  o 9  188.26  23.49  1138.12   248.37   1027.63  347.89   1252.98   354.70   165.91  37.42  187.32  34.25  -21.41  50.73  
1 1 1 11  -13 3  o 3  98.41   20.71  310.21    113.31   242.01   153.24   392.47    168.30   85.30   27.51  107.51  27.24  -22.21  38.72  
1 1 1 11  -13 4  o 7  181.65  22.71  1051.67   231.61   973.11   322.84   1134.98   332.45   163.65  35.40  179.01  33.58  -15.36  48.79  
1 1 1 11  -13 5  o 2  79.48   19.46  201.49    88.06    103.14   119.30   319.22    130.52   63.03   23.93  98.69   23.40  -35.66  33.46  
1 1 1 11  -12 0  o 6  141.49  19.33  618.50    152.91   538.23   209.34   710.31    223.89   126.26  29.43  146.84  27.57  -20.58  40.33  
1 1 1 11  -12 1  o 1  204.43  38.69  1506.99   437.46   1506.99  437.46   0.00      0.00     204.43  38.69  ?       ?      0.00    38.69  
1 1 1 11  -12 2  o 15 120.86  25.68  476.72    172.70   476.72   172.70   0.00      0.00     120.86  25.68  ?       ?      0.00    25.68  
1 1 1 11  -12 3  o 6  121.02  19.72  455.53    132.31   316.01   178.52   625.56    197.08   97.13   29.46  138.93  25.66  -41.80  39.06  
1 1 1 11  -12 4  o 19 237.48  27.78  1833.48   371.55   1869.49  526.84   1797.84   524.08   223.54  42.61  218.17  43.37  5.37    60.80  
1 1 1 11  -12 5  o 16 122.66  17.17  459.83    117.59   476.29   163.40   442.15    169.35   121.46  24.28  116.00  26.07  5.46    35.63  
1 1 1 11  -12 6  f 0  122.11  16.73  454.84    114.18   525.96   157.59   376.25    165.66   128.85  22.10  106.26  27.08  22.59   34.96  
1 1 1 11  -12 7  o 18 79.31   18.66  198.20    83.53    197.52   111.23   199.09    126.49   78.45   23.13  78.87   24.95  -0.43   34.02  
1 1 1 11  -12 8  o 18 44.32   18.34  22.52     76.14    26.56    103.66   17.79     112.19   50.66   21.22  51.26   21.80  -0.61   30.42  
1 1 1 11  -12 9  o 13 93.68   25.58  290.42    141.42   0.00     0.00     290.42    141.42   ?       ?      93.68   25.58  0.00    25.58  
1 1 1 11  -11 0  o 7  170.75  19.90  892.07    191.41   891.58   271.98   892.55    269.42   164.73  29.86  165.06  29.52  -0.32   41.99  
1 1 1 11  -11 1  o 16 94.61   16.74  273.67    87.58    242.91   125.87   302.55    121.94   87.14   24.27  97.70   22.24  -10.56  32.92  
1 1 1 11  -11 2  o 7  192.39  34.50  1252.76   366.99   1252.76  366.99   0.00      0.00     192.39  34.50  ?       ?      0.00    34.50  
1 1 1 11  -11 3  o 18 95.54   24.09  292.64    132.05   292.64   132.05   0.00      0.00     95.54   24.09  ?       ?      0.00    24.09  
1 1 1 11  -11 4  o 10 128.93  16.77  502.43    121.19   417.30   171.21   587.92    171.56   113.24  26.76  137.05  22.59  -23.81  35.02  
1 1 1 11  -11 5  o 5  90.39   16.29  249.57    81.44    261.08   113.83   237.49    116.56   90.72   22.07  86.35   23.07  4.38    31.93  
1 1 1 11  -11 6  o 11 105.41  16.36  337.47    95.76    318.01   136.00   356.61    134.87   99.54   24.07  105.97  22.84  -6.43   33.18  
1 1 1 11  -11 7  o 15 166.70  19.14  847.80    179.80   971.26   256.51   728.54    252.10   174.16  26.49  147.81  30.71  26.35   40.56  
1 1 1 11  -11 8  o 12 149.44  18.48  681.22    155.13   641.99   219.97   720.05    218.81   139.72  28.39  149.36  26.49  -9.63   38.83  
1 1 1 11  -11 9  o 7  71.02   18.24  157.64    74.77    173.30   110.85   144.57    101.27   74.44   23.33  68.85   22.38  5.59    32.32  
1 1 1 11  -11 10 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 11  -11 11 o 9  56.54   21.62  75.49     97.84    0.00     0.00     75.49     97.84    ?       ?      56.54   21.62  0.00    21.62  
1 1 1 11  -11 12 o 4  167.63  31.11  954.87    288.37   0.00     0.00     954.87    288.37   ?       ?      167.63  31.11  0.00    31.11  
1 1 1 11  -10 0  o 4  294.71  62.70  3666.59   1028.14  0.00     0.00     3666.59   1028.14  ?       ?      294.71  62.70  0.00    62.70  
1 1 1 11  -10 1  o 11 137.79  25.74  601.46    196.14   0.00     0.00     601.46    196.14   ?       ?      137.79  25.74  0.00    25.74  
1 1 1 11  -10 2  o 8  124.06  16.91  463.75    117.33   472.48   167.08   455.26    164.79   122.25  24.66  119.91  24.76  2.34    34.95  
1 1 1 11  -10 3  o 7  158.92  18.48  762.14    165.48   865.13   239.13   667.49    229.24   165.77  25.98  143.80  28.77  21.97   38.77  
1 1 1 11  -10 4  x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 11  -10 5  o 11 166.86  29.09  895.81    268.52   895.81   268.52   0.00      0.00     166.86  29.09  ?       ?      0.00    29.09  
1 1 1 11  -10 6  o 2  146.86  17.66  649.97    145.88   649.49   206.54   650.44    206.08   143.01  26.12  143.16  26.03  -0.15   36.88  
1 1 1 11  -10 7  o 7  203.12  22.92  1272.07   262.62   1196.28  372.32   1347.11   370.49   188.14  35.78  202.03  33.09  -13.89  48.73  
1 1 1 11  -10 8  o 17 240.23  27.28  1825.87   369.59   1780.68  522.99   1870.97   522.38   223.73  42.27  230.83  40.92  -7.10   58.83  
1 1 1 11  -10 9  f 0  71.84   23.02  157.19    107.43   157.19   107.43   0.00      0.00     71.84   23.02  ?       ?      0.00    23.02  
1 1 1 11  -10 10 o 5  99.93   22.99  317.63    129.17   0.00     0.00     317.63    129.17   ?       ?      99.93   22.99  0.00    22.99  
1 1 1 11  -10 11 o 6  170.28  19.80  887.67    189.91   885.56   269.14   889.77    268.01   164.09  29.66  164.64  29.44  -0.55   41.79  
1 1 1 11  -10 12 o 11 140.69  26.96  644.76    209.79   0.00     0.00     644.76    209.79   ?       ?      140.69  26.96  0.00    26.96  
1 1 1 11  -10 13 o 15 220.15  42.73  1815.06   520.53   0.00     0.00     1815.06   520.53   ?       ?      220.15  42.73  0.00    42.73  
1 1 1 11  -10 14 o 3  128.86  17.47  508.16    125.90   492.99   180.44   522.56    175.77   122.31  26.47  126.85  25.03  -4.53   36.43  
1 1 1 11  -9  0  o 9  91.94   17.66  257.49    89.81    321.40   119.12   173.29    136.72   102.00  21.04  77.05   26.03  24.95   33.47  
1 1 1 11  -9  1  o 19 271.56  49.76  2640.31   747.16   0.00     0.00     2640.31   747.16   ?       ?      271.56  49.76  0.00    49.76  
1 1 1 11  -9  2  f 0  149.98  28.07  711.14    232.78   0.00     0.00     711.14    232.78   ?       ?      149.98  28.07  0.00    28.07  
1 1 1 11  -9  3  o 11 100.98  15.24  305.34    85.62    375.09   123.24   240.26    119.04   110.66  20.14  87.69   23.27  22.97   30.77  
1 1 1 11  -9  4  o 18 295.55  33.52  2801.75   558.75   2734.52  790.47   2868.87   789.91   272.87  52.37  281.50  50.75  -8.63   72.92  
1 1 1 11  -9  5  o 4  63.39   21.23  115.12    90.91    115.12   90.91    0.00      0.00     63.39   21.23  ?       ?      0.00    21.23  
1 1 1 11  -9  6  o 14 115.09  22.97  412.87    146.44   412.87   146.44   0.00      0.00     115.09  22.97  ?       ?      0.00    22.97  
1 1 1 11  -9  7  o 6  109.80  15.82  361.80    96.84    405.62   136.72   317.67    137.18   114.46  21.60  100.29  24.12  14.16   32.38  
1 1 1 11  -9  8  o 2  221.43  24.49  1513.36   306.16   1573.19  434.01   1454.10   431.94   217.56  36.01  207.76  37.60  9.79    52.06  
1 1 1 11  -9  9  x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 11  -9  10 o 19 113.25  16.31  386.51    103.00   346.40   147.19   424.99    144.18   104.21  24.94  116.66  22.34  -12.44  33.48  
1 1 1 11  -9  11 o 8  186.93  21.20  1069.08   223.44   1098.60  315.19   1039.26   316.80   183.45  31.04  177.47  32.28  5.98    44.78  
1 1 1 11  -9  12 o 12 148.44  18.11  667.48    151.13   672.25   215.76   662.88    211.76   144.65  26.97  143.81  26.63  0.85    37.91  
1 1 1 11  -9  13 o 15 275.02  31.94  2492.09   494.86   2669.45  701.29   2316.20   698.40   265.37  47.79  241.24  51.97  24.14   70.60  
1 1 1 11  -9  14 o 2  160.27  29.33  847.48    259.92   0.00     0.00     847.48    259.92   ?       ?      160.27  29.33  0.00    29.33  
1 1 1 11  -9  15 o 8  124.90  25.48  507.38    176.53   0.00     0.00     507.38    176.53   ?       ?      124.90  25.48  0.00    25.48  
1 1 1 11  -9  16 o 5  120.63  17.82  447.44    119.72   432.41   174.99   460.66    164.16   114.01  27.13  119.00  24.83  -4.99   36.78  
1 1 1 11  -8  0  o 8  289.00  32.04  2612.77   522.60   2569.25  738.18   2656.50   739.96   272.60  48.97  278.10  48.09  -5.50   68.63  
1 1 1 11  -8  1  o 10 306.22  34.28  2961.79   592.24   2789.45  836.76   3134.79   838.35   279.38  54.13  300.40  50.40  -21.01  73.96  
1 1 1 11  -8  2  o 10 273.34  47.54  2554.77   718.93   0.00     0.00     2554.77   718.93   ?       ?      273.34  47.54  0.00    47.54  
1 1 1 11  -8  3  o 15 76.03   21.38  176.74    97.17    0.00     0.00     176.74    97.17    ?       ?      76.03   21.38  0.00    21.38  
1 1 1 11  -8  4  o 16 349.53  39.68  3973.98   782.07   4362.71  1107.28  3587.03   1104.74  345.34  57.90  303.41  65.36  41.93   87.32  
1 1 1 11  -8  5  o 13 368.75  42.84  4516.83   890.00   4816.29  1259.84  4218.49   1257.46  353.12  64.53  322.32  69.97  30.80   95.18  
1 1 1 11  -8  6  o 14 242.40  41.88  1966.11   561.64   1966.11  561.64   0.00      0.00     242.40  41.88  ?       ?      0.00    41.88  
1 1 1 11  -8  7  o 17 267.53  48.00  2505.41   710.13   2505.41  710.13   0.00      0.00     267.53  48.00  ?       ?      0.00    48.00  
1 1 1 11  -8  8  o 7  325.45  67.77  4368.62   1225.04  4368.62  1225.04  0.00      0.00     325.45  67.77  ?       ?      0.00    67.77  
1 1 1 11  -8  9  o 13 74.54   22.74  169.36    106.18   0.00     0.00     169.36    106.18   ?       ?      74.54   22.74  0.00    22.74  
1 1 1 11  -8  10 o 13 191.13  21.56  1110.72   232.49   1171.27  333.75   1053.64   324.03   190.61  31.61  180.01  32.55  10.60   45.37  
1 1 1 11  -8  11 o 3  203.91  22.92  1274.25   263.66   1335.88  376.95   1215.21   368.92   201.89  33.71  191.60  34.82  10.29   48.47  
1 1 1 11  -8  12 o 4  207.12  23.18  1319.78   270.90   1517.01  387.76   1131.72   378.63   215.89  32.28  182.30  37.44  33.59   49.43  
1 1 1 11  -8  13 o 4  270.79  31.01  2368.50   473.30   2511.26  671.00   2227.14   667.70   262.51  46.21  243.01  49.55  19.50   67.75  
1 1 1 11  -8  14 o 8  284.72  33.41  2680.84   535.75   2736.30  760.24   2626.12   755.11   265.15  51.80  258.38  52.70  6.76    73.89  
1 1 1 11  -8  15 o 6  89.90   23.62  258.89    123.50   0.00     0.00     258.89    123.50   ?       ?      89.90   23.62  0.00    23.62  
1 1 1 11  -8  16 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 11  -8  17 o 18 112.86  18.64  394.67    116.56   445.25   180.48   358.48    152.68   115.57  27.59  104.39  25.66  11.18   37.68  
1 1 1 11  -7  0  o 5  130.53  17.49  507.47    127.80   500.45   185.01   513.88    176.74   127.01  26.24  129.21  24.73  -2.21   36.06  
1 1 1 11  -7  1  o 13 171.32  20.04  875.86    193.34   925.21   277.72   829.46    269.31   172.75  29.03  163.02  29.88  9.72    41.66  
1 1 1 11  -7  2  o 18 344.59  38.59  3780.10   750.37   3559.77  1060.80  4000.76   1061.57  312.57  61.31  336.60  56.97  -24.03  83.69  
1 1 1 11  -7  3  o 14 289.09  49.94  2841.42   798.86   0.00     0.00     2841.42   798.86   ?       ?      289.09  49.94  0.00    49.94  
1 1 1 11  -7  4  o 3  170.81  28.27  902.08    267.51   0.00     0.00     902.08    267.51   ?       ?      170.81  28.27  0.00    28.27  
1 1 1 11  -7  5  o 11 77.49   17.93  182.98    78.17    279.06   121.65   115.40    102.03   95.11   22.61  65.04   22.48  30.07   31.88  
1 1 1 11  -7  6  o 8  266.83  28.96  2185.76   436.49   2336.09  619.04   2037.11   615.55   267.22  41.72  246.73  45.12  20.49   61.45  
1 1 1 11  -7  7  o 3  378.03  82.15  6194.65   1731.81  6194.65  1731.81  0.00      0.00     378.03  82.15  ?       ?      0.00    82.15  
1 1 1 11  -7  8  x 7  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 11  -7  9  o 10 206.51  35.28  1375.96   403.24   1375.96  403.24   0.00      0.00     206.51  35.28  ?       ?      0.00    35.28  
1 1 1 11  -7  10 o 7  259.59  28.87  2096.99   423.02   2029.72  600.73   2163.16   595.78   243.07  44.70  253.01  42.53  -9.94   61.70  
1 1 1 11  -7  11 o 10 323.34  37.27  3426.75   679.21   3600.09  962.28   3254.64   958.83   308.94  56.33  288.94  59.78  20.00   82.14  
1 1 1 11  -7  12 o 13 188.42  21.46  1078.74   227.95   1077.15  326.21   1080.26   318.66   182.24  32.37  183.07  31.45  -0.83   45.13  
1 1 1 11  -7  13 o 18 245.40  27.76  1890.58   384.18   1820.10  545.99   1959.71   540.69   227.65  43.36  238.75  40.92  -11.10  59.62  
1 1 1 11  -7  14 o 16 389.15  51.39  5692.20   1120.08  6005.97  1585.55  5379.62   1582.52  340.48  82.08  310.28  85.91  30.20   118.82 
1 1 1 11  -7  15 o 9  249.99  28.37  1990.37   399.90   2166.32  569.20   1818.87   561.97   248.11  41.42  222.73  45.49  25.38   61.52  
1 1 1 11  -7  16 o 16 188.50  33.74  1195.91   351.65   0.00     0.00     1195.91   351.65   ?       ?      188.50  33.74  0.00    33.74  
1 1 1 11  -7  17 o 14 134.41  26.88  588.81    200.14   0.00     0.00     588.81    200.14   ?       ?      134.41  26.88  0.00    26.88  
1 1 1 11  -7  18 o 16 146.54  19.50  663.56    159.99   889.79   240.42   483.75    214.33   165.75  26.13  118.62  31.10  47.13   40.62  
1 1 1 11  -7  19 o 7  123.15  18.82  470.03    128.80   628.42   195.25   348.01    171.38   138.96  25.41  101.54  28.33  37.41   38.06  
1 1 1 11  -6  0  o 6  331.58  36.22  3420.30   678.20   3581.75  958.65   3258.53   959.58   325.96  53.06  307.75  56.39  18.20   77.43  
1 1 1 11  -6  1  o 6  446.13  51.93  6625.40   1305.19  7207.90  1846.98  6044.37   1844.66  432.64  77.20  382.90  86.03  49.74   115.58 
1 1 1 11  -6  2  o 15 333.57  36.41  3463.59   685.83   3530.51  969.61   3396.60   970.20   322.49  54.30  314.98  55.69  7.51    77.78  
1 1 1 11  -6  3  o 13 337.60  36.95  3558.09   704.41   3613.91  995.69   3502.16   996.68   325.15  55.32  318.91  56.51  6.24    79.08  
1 1 1 11  -6  4  o 14 358.91  66.25  4701.67   1314.81  0.00     0.00     4701.67   1314.81  ?       ?      358.91  66.25  0.00    66.25  
1 1 1 11  -6  5  o 11 240.31  39.30  1846.36   523.48   0.00     0.00     1846.36   523.48   ?       ?      240.31  39.30  0.00    39.30  
1 1 1 11  -6  6  o 5  136.83  16.11  553.30    124.10   553.67   174.18   552.93    176.86   134.85  23.35  134.63  23.75  0.22    33.30  
1 1 1 11  -6  7  o 4  202.80  32.91  1288.36   370.02   1288.36  370.02   0.00      0.00     202.80  32.91  ?       ?      0.00    32.91  
1 1 1 11  -6  8  x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 11  -6  9  o 19 141.23  24.42  611.62    190.86   611.62   190.86   0.00      0.00     141.23  24.42  ?       ?      0.00    24.42  
1 1 1 11  -6  10 o 4  212.08  35.12  1438.59   412.57   1438.59  412.57   0.00      0.00     212.08  35.12  ?       ?      0.00    35.12  
1 1 1 11  -6  11 o 6  121.54  16.32  440.52    111.02   389.08   156.75   492.30    157.27   111.55  25.09  126.69  22.45  -15.14  33.66  
1 1 1 11  -6  12 o 14 343.54  40.10  3906.97   775.92   3843.40  1097.34  3970.54   1097.30  312.04  63.42  319.12  62.13  -7.08   88.79  
1 1 1 11  -6  13 o 14 163.62  19.10  805.63    176.07   715.85   247.50   897.62    250.53   149.34  29.91  169.38  26.64  -20.05  40.06  
1 1 1 11  -6  14 o 3  130.84  25.13  538.63    181.92   0.00     0.00     538.63    181.92   ?       ?      130.84  25.13  0.00    25.13  
1 1 1 11  -6  15 o 12 333.85  40.33  3813.51   757.21   3851.49  1071.65  3775.65   1070.08  301.82  63.85  297.65  64.49  4.18    90.75  
1 1 1 11  -6  16 o 8  176.82  20.65  954.92    205.68   984.17   292.81   926.42    288.98   173.79  30.46  168.09  31.09  5.69    43.53  
1 1 1 11  -6  17 o 15 245.87  47.86  2287.86   651.18   0.00     0.00     2287.86   651.18   ?       ?      245.87  47.86  0.00    47.86  
1 1 1 11  -6  18 o 19 90.47   25.15  265.21    135.35   0.00     0.00     265.21    135.35   ?       ?      90.47   25.15  0.00    25.15  
1 1 1 11  -6  19 o 12 116.27  17.21  414.21    111.43   710.22   162.72   152.85    152.90   151.86  19.09  73.62   27.26  78.24   33.28  
1 1 1 11  -6  20 o 11 167.80  27.35  927.52    254.40   -460.41  351.49   2454.50   368.68   62.26   30.35  278.88  23.24  -216.62 38.23  
1 1 1 11  -5  0  o 1  366.02  39.93  4165.38   825.36   4177.00  1166.87  4153.74   1167.61  350.63  60.13  349.41  60.39  1.22    85.23  
1 1 1 11  -5  1  o 15 221.74  23.45  1461.60   293.94   1703.45  415.37   1219.01   416.01   236.57  31.36  196.80  38.20  39.77   49.42  
1 1 1 11  -5  2  o 4  184.65  19.90  1007.40   207.59   1047.32  293.43   967.40    293.72   185.69  28.43  177.85  29.82  7.85    41.20  
1 1 1 11  -5  3  o 18 217.09  23.09  1401.05   283.38   1364.19  400.12   1438.14   401.40   209.95  34.39  216.09  33.44  -6.13   47.96  
1 1 1 11  -5  4  o 9  348.89  37.83  3771.26   745.53   3911.80  1054.05  3630.56   1054.63  341.77  55.63  326.77  58.36  15.01   80.63  
1 1 1 11  -5  5  o 16 181.99  29.35  1013.97   296.25   0.00     0.00     1013.97   296.25   ?       ?      181.99  29.35  0.00    29.35  
1 1 1 11  -5  6  x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 11  -5  7  x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 11  -5  8  o 11 362.46  40.35  4180.04   825.47   4446.21  1167.10  3913.60   1167.69  355.33  59.31  327.63  64.38  27.70   87.53  
1 1 1 11  -5  9  o 15 187.59  30.55  1092.48   317.67   1092.48  317.67   0.00      0.00     187.59  30.55  ?       ?      0.00    30.55  
1 1 1 11  -5  10 o 11 61.20   20.68  103.96    86.28    103.96   86.28    0.00      0.00     61.20   20.68  ?       ?      0.00    20.68  
1 1 1 11  -5  11 o 10 118.36  22.76  429.81    149.02   429.81   149.02   0.00      0.00     118.36  22.76  ?       ?      0.00    22.76  
1 1 1 11  -5  12 o 19 147.01  17.42  643.38    144.18   655.22   202.24   631.14    205.58   145.74  25.08  142.59  26.08  3.14    36.18  
1 1 1 11  -5  13 o 1  226.83  38.64  1697.54   485.08   1697.54  485.08   0.00      0.00     226.83  38.64  ?       ?      0.00    38.64  
1 1 1 11  -5  14 o 3  194.43  21.75  1146.62   238.61   1118.44  336.81   1175.01   338.10   186.04  32.73  191.29  31.91  -5.25   45.71  
1 1 1 11  -5  15 o 12 117.59  16.38  415.21    107.56   335.15   152.83   493.81    151.42   102.56  25.94  126.56  21.62  -24.00  33.77  
1 1 1 11  -5  16 o 17 228.52  25.68  1626.33   331.01   1646.90  467.87   1605.72   468.37   220.02  38.44  216.62  39.10  3.40    54.83  
1 1 1 11  -5  17 o 2  255.64  29.52  2095.81   425.32   1945.24  600.92   2246.97   602.08   228.62  47.35  250.73  43.40  -22.11  64.23  
1 1 1 11  -5  18 o 18 71.19   24.53  148.69    121.51   0.00     0.00     148.69    121.51   ?       ?      71.19   24.53  0.00    24.53  
1 1 1 11  -5  19 f 0  113.07  25.38  415.41    160.72   0.00     0.00     415.41    160.72   ?       ?      113.07  25.38  0.00    25.38  
1 1 1 11  -5  20 o 19 192.36  22.02  1159.68   238.78   1354.63  336.68   962.37    338.71   201.26  30.06  163.09  37.03  38.17   47.69  
1 1 1 11  -5  21 o 10 119.64  26.85  477.90    179.88   0.00     0.00     477.90    179.88   ?       ?      119.64  26.85  0.00    26.85  
1 1 1 11  -4  0  o 1  492.54  98.72  9658.72   2693.98  9658.72  2693.98  0.00      0.00     492.54  98.72  ?       ?      0.00    98.72  
1 1 1 11  -4  1  o 1  309.62  32.86  2893.06   575.15   3126.70  813.29   2659.31   813.49   314.81  46.39  287.14  51.23  27.66   69.11  
1 1 1 11  -4  2  o 9  375.24  40.49  4335.89   858.33   4692.02  1214.03  3979.96   1213.69  378.07  57.77  342.95  64.00  35.13   86.22  
1 1 1 11  -4  3  o 11 282.27  29.83  2390.21   476.09   2381.54  673.39   2398.88   673.21   275.05  44.14  276.18  43.93  -1.13   62.28  
1 1 1 11  -4  4  o 13 335.78  35.90  3438.66   681.35   3565.82  963.77   3311.60   963.38   331.68  52.35  317.75  54.79  13.93   75.78  
1 1 1 11  -4  5  o 15 155.15  17.53  708.59    153.38   815.52   216.52   600.88    217.30   165.08  23.51  140.06  28.01  25.02   36.57  
1 1 1 11  -4  6  x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 11  -4  7  o 2  272.47  44.40  2378.75   670.54   0.00     0.00     2378.75   670.54   ?       ?      272.47  44.40  0.00    44.40  
1 1 1 11  -4  8  o 17 86.59   15.69  224.51    75.12    176.42   105.24   274.48    107.27   76.63   22.47  95.02   20.28  -18.39  30.27  
1 1 1 11  -4  9  o 8  229.09  24.53  1574.56   317.60   1635.95  449.32   1513.26   449.00   228.50  35.40  218.74  37.08  9.76    51.26  
1 1 1 11  -4  10 f 0  214.07  34.82  1441.91   413.15   1441.91  413.15   0.00      0.00     214.07  34.82  ?       ?      0.00    34.82  
1 1 1 11  -4  11 o 3  100.30  21.86  308.61    122.27   308.61   122.27   0.00      0.00     100.30  21.86  ?       ?      0.00    21.86  
1 1 1 11  -4  12 o 6  70.07   17.49  149.54    70.15    120.24   97.20    181.40    101.35   65.36   21.95  77.14   21.88  -11.78  30.99  
1 1 1 11  -4  13 o 15 259.02  28.30  2065.32   413.97   2131.02  585.61   1999.71   585.26   253.81  41.63  244.46  43.29  9.36    60.06  
1 1 1 11  -4  14 o 15 183.80  31.06  1072.39   316.09   1072.39  316.09   0.00      0.00     183.80  31.06  ?       ?      0.00    31.06  
1 1 1 11  -4  15 o 8  218.41  24.15  1461.14   297.77   1508.15  421.09   1414.12   421.12   214.68  35.40  206.74  36.83  7.94    51.09  
1 1 1 11  -4  16 o 2  287.72  33.14  2677.09   537.42   2530.54  759.90   2823.74   760.15   258.71  52.95  277.96  49.45  -19.26  72.45  
1 1 1 11  -4  17 o 18 294.90  34.49  2862.54   572.83   2790.43  809.78   2934.76   810.44   267.34  54.61  276.59  52.97  -9.25   76.08  
1 1 1 11  -4  18 o 15 123.80  16.12  461.20    111.84   628.38   154.15   275.39    162.51   143.55  19.18  92.47   28.12  51.08   34.04  
1 1 1 11  -4  19 o 12 126.21  26.29  515.80    184.30   0.00     0.00     515.80    184.30   ?       ?      126.21  26.29  0.00    26.29  
1 1 1 11  -4  20 o 4  75.17   24.47  176.04    121.09   0.00     0.00     176.04    121.09   ?       ?      75.17   24.47  0.00    24.47  
1 1 1 11  -4  21 o 19 209.33  41.52  1657.75   481.32   0.00     0.00     1657.75   481.32   ?       ?      209.33  41.52  0.00    41.52  
1 1 1 11  -3  0  o 7  179.25  28.71  970.25    285.43   970.25   285.43   0.00      0.00     179.25  28.71  ?       ?      0.00    28.71  
1 1 1 11  -3  1  o 10 92.81   15.64  255.98    80.37    301.98   115.56   212.90    111.84   100.03  20.80  83.97   22.67  16.06   30.77  
1 1 1 11  -3  2  o 5  77.75   16.37  181.60    70.74    242.45   100.33   121.43    99.77    89.56   20.02  66.40   22.24  23.17   29.92  
1 1 1 11  -3  3  o 7  335.58  35.61  3407.69   675.62   3439.85  955.34   3375.52   955.60   327.81  52.54  324.28  53.17  3.53    74.75  
1 1 1 11  -3  4  o 9  351.13  37.46  3750.79   743.48   3869.41  1051.40  3632.15   1051.49  346.27  54.71  333.84  56.90  12.43   78.94  
1 1 1 11  -3  5  o 13 258.47  27.32  1990.27   399.30   2126.09  564.81   1854.55   564.60   262.72  38.60  243.62  41.88  19.10   56.96  
1 1 1 11  -3  6  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 11  -3  7  o 3  336.03  56.29  3736.70   1047.49  0.00     0.00     3736.70   1047.49  ?       ?      336.03  56.29  0.00    56.29  
1 1 1 11  -3  8  o 9  129.10  23.56  504.90    168.16   504.90   168.16   0.00      0.00     129.10  23.56  ?       ?      0.00    23.56  
1 1 1 11  -3  9  o 8  222.49  35.83  1544.26   442.11   1544.26  442.11   0.00      0.00     222.49  35.83  ?       ?      0.00    35.83  
1 1 1 11  -3  10 o 18 184.51  20.29  1010.93   211.40   1086.85  298.89   934.92    299.06   188.50  28.51  173.54  31.16  14.95   42.24  
1 1 1 11  -3  11 o 19 240.11  39.45  1846.79   524.92   1846.79  524.92   0.00      0.00     240.11  39.45  ?       ?      0.00    39.45  
1 1 1 11  -3  12 o 12 198.54  32.50  1234.56   357.64   1234.56  357.64   0.00      0.00     198.54  32.50  ?       ?      0.00    32.50  
1 1 1 11  -3  13 o 17 366.87  42.02  4385.70   868.99   4349.41  1228.86  4422.00   1229.02  338.71  65.57  342.46  64.89  -3.75   92.25  
1 1 1 11  -3  14 o 2  147.65  17.58  649.43    146.07   667.84   205.87   630.77    207.28   147.06  25.30  142.43  26.32  4.62    36.51  
1 1 1 11  -3  15 o 5  222.85  24.65  1517.91   310.04   1447.04  437.99   1589.08   438.94   209.39  37.83  221.07  35.81  -11.68  52.09  
1 1 1 11  -3  16 o 3  222.18  24.61  1517.85   308.70   1566.15  436.56   1469.54   436.57   217.88  36.17  209.84  37.62  8.04    52.19  
1 1 1 11  -3  17 o 4  150.87  18.17  685.81    154.21   770.86   215.44   596.45    220.84   157.14  24.70  135.73  29.21  21.41   38.25  
1 1 1 11  -3  18 o 16 120.37  22.12  451.97    147.19   -382.24  195.96   1531.94   222.96   44.22   21.78  226.37  17.29  -182.15 27.81  
1 1 1 11  -3  19 o 2  158.59  18.39  763.10    164.37   1003.48  231.48   518.64    233.44   179.61  22.98  123.70  32.47  55.91   39.78  
1 1 1 11  -3  20 o 1  59.09   22.97  77.30     111.75   0.00     0.00     77.30     111.75   ?       ?      59.09   22.97  0.00    22.97  
1 1 1 11  -3  21 o 10 129.58  27.16  556.22    195.60   0.00     0.00     556.22    195.60   ?       ?      129.58  27.16  0.00    27.16  
1 1 1 11  -3  22 o 5  124.57  18.70  482.60    129.57   490.22   186.61   475.52    180.05   120.52  27.57  119.02  26.98  1.50    38.57  
1 1 1 11  -2  0  o 14 153.93  17.46  695.55    151.54   717.88   213.65   672.94    214.96   154.73  24.90  149.43  26.00  5.30    36.00  
1 1 1 11  -2  1  o 15 402.17  43.32  4975.47   984.47   5112.15  1392.19  4838.77   1392.31  393.28  63.85  380.70  66.10  12.58   91.91  
1 1 1 11  -2  2  o 15 224.85  23.83  1493.82   302.92   1572.69  428.32   1414.90   428.46   227.64  33.80  214.94  36.00  12.71   49.38  
1 1 1 11  -2  3  o 10 274.67  28.95  2247.89   449.59   2352.52  635.80   2143.24   635.84   276.05  41.40  262.19  43.79  13.86   60.26  
1 1 1 11  -2  4  o 5  458.74  50.46  6610.93   1306.88  6930.29  1848.28  6291.62   1848.13  448.77  74.34  422.73  79.06  26.04   108.53 
1 1 1 11  -2  5  o 3  116.85  22.49  411.48    145.36   411.48   145.36   0.00      0.00     116.85  22.49  ?       ?      0.00    22.49  
1 1 1 11  -2  6  o 15 287.77  45.94  2602.80   733.46   0.00     0.00     2602.80   733.46   ?       ?      287.77  45.94  0.00    45.94  
1 1 1 11  -2  7  o 10 521.29  110.29 11466.78  3197.23  0.00     0.00     11466.78  3197.23  ?       ?      521.29  110.29 0.00    110.29 
1 1 1 11  -2  8  o 9  131.21  24.16  521.02    175.24   0.00     0.00     521.02    175.24   ?       ?      131.21  24.16  0.00    24.16  
1 1 1 11  -2  9  o 8  373.01  40.74  4336.86   858.23   4244.51  1213.36  4429.33   1214.10  351.54  62.41  360.73  60.79  -9.19   87.12  
1 1 1 11  -2  10 o 5  354.49  38.86  3921.68   777.89   4253.13  1100.32  3590.49   1099.88  355.25  55.79  320.42  62.04  34.82   83.43  
1 1 1 11  -2  11 o 17 378.79  71.95  5390.91   1507.29  5390.91  1507.29  0.00      0.00     378.79  71.95  ?       ?      0.00    71.95  
1 1 1 11  -2  12 o 2  197.13  32.40  1213.64   353.97   1213.64  353.97   0.00      0.00     197.13  32.40  ?       ?      0.00    32.40  
1 1 1 11  -2  13 o 8  105.32  24.09  343.16    142.45   343.16   142.45   0.00      0.00     105.32  24.09  ?       ?      0.00    24.09  
1 1 1 11  -2  14 o 16 266.87  29.20  2194.39   440.11   2289.15  622.34   2099.58   622.46   263.09  42.67  249.93  45.04  13.16   62.04  
1 1 1 11  -2  15 o 19 285.77  31.75  2563.37   512.00   2697.74  724.28   2429.14   723.89   280.35  46.64  262.81  49.80  17.54   68.23  
1 1 1 11  -2  16 o 12 185.86  21.10  1044.51   221.13   1048.63  312.49   1040.38   312.96   181.10  31.18  180.26  31.38  0.84    44.24  
1 1 1 11  -2  17 o 12 186.46  20.75  1054.70   218.37   1325.66  308.28   781.85    309.36   205.89  26.71  152.31  35.96  53.58   44.80  
1 1 1 11  -2  18 o 3  20.07   10.13  -181.05   55.42    -244.94  64.70    -4.95     107.41   ?       ?      48.41   20.97  0.00    20.97  
1 1 1 11  -2  19 o 1  70.09   20.23  152.24    85.91    162.34   126.94   143.71    116.69   73.86   25.08  70.13   24.05  3.73    34.75  
1 1 1 11  -2  20 o 9  162.56  20.01  811.64    182.80   681.27   259.31   940.42    257.73   141.45  32.60  170.74  27.21  -29.29  42.46  
1 1 1 11  -2  21 o 13 139.36  27.76  641.73    214.30   0.00     0.00     641.73    214.30   ?       ?      139.36  27.76  0.00    27.76  
1 1 1 11  -2  22 o 12 142.19  28.76  683.56    226.67   0.00     0.00     683.56    226.67   ?       ?      142.19  28.76  0.00    28.76  
1 1 1 11  -2  23 o 5  139.73  19.29  610.33    150.63   695.98   216.01   529.27    210.15   144.04  27.12  123.15  30.01  20.90   40.44  
1 1 1 11  -1  0  o 15 499.80  55.65  7954.21   1569.62  8002.60  2219.62  7905.81   2219.93  472.78  84.90  469.11  85.59  3.66    120.55 
1 1 1 11  -1  1  o 18 499.79  55.69  7952.47   1570.69  8081.49  2221.11  7823.42   2221.46  475.84  84.40  466.10  86.20  9.74    120.64 
1 1 1 11  -1  2  o 10 288.15  30.45  2478.98   496.06   2600.94  701.44   2356.95   701.62   289.70  43.52  274.28  46.20  15.42   63.47  
1 1 1 11  -1  3  o 8  97.86   15.95  284.10    86.54    276.85   120.24   291.90    124.65   95.57   22.32  98.13   22.59  -2.56   31.76  
1 1 1 11  -1  4  o 2  197.68  21.35  1150.85   238.40   1172.67  336.70   1128.91   337.61   196.99  30.78  192.96  31.57  4.03    44.09  
1 1 1 11  -1  5  x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 11  -1  6  o 18 165.74  18.66  807.44    174.44   884.79   245.39   728.43    248.01   171.92  25.65  154.81  28.97  17.11   38.69  
1 1 1 11  -1  7  o 8  586.68  150.64 18299.84  5099.26  0.00     0.00     18299.84  5099.26  ?       ?      586.68  150.64 0.00    150.64 
1 1 1 11  -1  8  o 12 463.33  87.74  8056.40   2248.39  0.00     0.00     8056.40   2248.39  ?       ?      463.33  87.74  0.00    87.74  
1 1 1 11  -1  9  o 7  442.60  49.50  6262.43   1236.27  6109.64  1748.05  6415.34   1748.65  409.46  77.20  422.46  74.84  -12.99  107.52 
1 1 1 11  -1  10 o 16 184.66  20.24  1009.04   211.05   1057.87  298.77   960.41    298.18   186.38  28.85  176.85  30.47  9.54    41.97  
1 1 1 11  -1  11 o 1  279.18  30.01  2368.63   473.50   2358.28  669.25   2379.00   670.01   269.93  44.76  271.26  44.57  -1.32   63.17  
1 1 1 11  -1  12 o 5  235.92  38.73  1774.68   506.38   1774.68  506.38   0.00      0.00     235.92  38.73  ?       ?      0.00    38.73  
1 1 1 11  -1  13 o 12 206.62  34.07  1345.04   390.05   1345.04  390.05   0.00      0.00     206.62  34.07  ?       ?      0.00    34.07  
1 1 1 11  -1  14 o 6  163.70  18.95  798.54    174.80   766.32   246.22   831.28    248.19   156.90  28.38  164.00  27.32  -7.10   39.39  
1 1 1 11  -1  15 o 17 381.58  45.05  4888.64   967.76   4995.15  1368.77  4782.18   1368.46  352.46  70.12  341.78  72.02  10.69   100.52 
1 1 1 11  -1  16 o 3  193.76  21.79  1135.94   238.21   1133.70  337.77   1138.17   336.01   188.01  32.47  188.54  32.20  -0.54   45.73  
1 1 1 11  -1  17 o 2  196.12  24.08  1183.76   265.37   -364.23  366.42   2891.23   384.84   69.67   33.19  309.23  21.82  -239.56 39.72  
1 1 1 11  -1  18 o 15 278.44  31.65  2501.90   496.99   3023.51  702.64   1979.69   703.05   293.68  42.95  222.97  55.22  70.71   69.95  
1 1 1 11  -1  19 o 7  212.67  24.27  1408.52   291.04   1445.58  411.93   1371.59   411.26   206.38  36.08  199.98  37.19  6.40    51.82  
1 1 1 11  -1  20 o 16 134.03  18.24  548.01    136.67   573.35   195.82   523.95    190.83   133.06  26.57  126.81  27.04  6.25    37.91  
1 1 1 11  -1  21 o 19 81.60   24.99  213.51    128.06   0.00     0.00     213.51    128.06   ?       ?      81.60   24.99  0.00    24.99  
1 1 1 11  -1  22 o 14 82.66   25.50  223.01    133.03   0.00     0.00     223.01    133.03   ?       ?      82.66   25.50  0.00    25.50  
1 1 1 11  -1  23 o 10 222.64  27.32  1648.19   341.84   1673.77  487.12   1623.36   479.82   205.67  42.66  202.47  42.63  3.19    60.31  
1 1 1 11  0   0  o 2  135.26  16.52  537.32    125.58   535.79   175.70   538.91    179.56   133.53  23.79  133.82  24.27  -0.29   33.99  
1 1 1 11  0   1  o 16 413.19  44.41  5254.79   1036.81  5124.92  1465.52  5384.93   1467.03  391.70  67.62  403.28  65.62  -11.58  94.23  
1 1 1 11  0   2  o 9  361.62  38.41  3966.76   785.22   3942.62  1109.75  3990.96   1111.19  349.67  57.26  352.07  56.92  -2.40   80.74  
1 1 1 11  0   3  o 18 97.65   16.47  283.47    89.07    279.87   120.28   287.83    132.53   96.11   22.24  97.36   23.89  -1.24   32.64  
1 1 1 11  0   4  o 11 171.49  27.95  885.78    265.73   885.78   265.73   0.00      0.00     171.49  27.95  ?       ?      0.00    27.95  
1 1 1 11  0   5  o 10 493.65  92.07  9010.09   2513.30  0.00     0.00     9010.09   2513.30  ?       ?      493.65  92.07  0.00    92.07  
1 1 1 11  0   6  o 18 177.59  19.68  927.60    197.24   962.93   277.78   891.67    280.12   178.89  27.97  171.57  29.51  7.32    40.65  
1 1 1 11  0   7  o 2  70.64   23.28  139.87    109.43   0.00     0.00     139.87    109.43   ?       ?      70.64   23.28  0.00    23.28  
1 1 1 11  0   8  o 1  161.95  26.96  791.94    241.85   0.00     0.00     791.94    241.85   ?       ?      161.95  26.96  0.00    26.96  
1 1 1 11  0   9  o 3  298.83  31.83  2695.89   537.70   2767.39  759.82   2624.16   761.03   295.11  46.38  286.28  48.00  8.83    66.75  
1 1 1 11  0   10 o 14 175.00  19.34  904.41    191.07   837.90   269.80   971.33    270.64   165.38  29.50  179.14  27.17  -13.76  40.11  
1 1 1 11  0   11 o 13 415.10  46.85  5553.77   1096.88  5379.58  1551.08  5728.02   1551.37  380.12  73.74  396.00  70.84  -15.87  102.26 
1 1 1 11  0   12 o 11 144.37  25.60  637.52    204.40   637.52   204.40   0.00      0.00     144.37  25.60  ?       ?      0.00    25.60  
1 1 1 11  0   13 f 0  362.65  70.03  5020.99   1405.09  5020.99  1405.09  0.00      0.00     362.65  70.03  ?       ?      0.00    70.03  
1 1 1 11  0   14 o 9  159.58  18.69  758.25    167.98   882.79   236.76   632.00    238.37   170.12  24.99  141.54  30.25  28.57   39.24  
1 1 1 11  0   15 o 8  427.99  52.92  6438.86   1272.55  6843.14  1799.87  6034.78   1799.45  394.77  82.10  358.36  88.10  36.41   120.42 
1 1 1 11  0   16 o 15 323.48  36.90  3390.49   672.99   3846.55  951.71   2934.34   951.80   327.23  52.43  273.83  62.00  53.40   81.20  
1 1 1 11  0   17 o 13 186.12  22.94  1060.02   239.94   -175.02  328.89   2465.21   350.82   72.90   33.65  285.75  21.54  -212.85 39.96  
1 1 1 11  0   18 o 6  133.63  17.57  538.60    131.55   634.99   186.59   443.33    185.50   142.74  23.60  117.04  27.99  25.69   36.61  
1 1 1 11  0   19 o 14 252.14  28.91  2034.22   410.96   2166.86  581.88   1902.21   580.49   246.57  42.65  226.95  46.13  19.61   62.83  
1 1 1 11  0   20 f 0  205.56  23.89  1322.52   276.67   1267.98  392.19   1376.55   390.36   190.76  37.15  200.76  35.15  -10.00  51.14  
1 1 1 11  0   21 o 14 84.67   20.13  226.77    96.43    242.70   141.51   212.96    131.77   86.47   26.23  81.58   25.41  4.89    36.52  
1 1 1 11  0   22 f 0  146.09  29.98  726.52    242.96   0.00     0.00     726.52    242.96   ?       ?      146.09  29.98  0.00    29.98  
1 1 1 11  0   23 o 8  222.09  49.24  2130.39   611.27   0.00     0.00     2130.39   611.27   ?       ?      222.09  49.24  0.00    49.24  
1 1 1 11  1   0  o 15 107.10  15.78  338.73    94.10    340.60   134.72   336.94    131.49   106.10  22.80  105.58  22.39  0.52    31.95  
1 1 1 11  1   1  o 5  288.58  30.28  2483.55   494.21   2452.71  698.69   2514.43   699.14   280.74  44.86  284.62  44.22  -3.88   63.00  
1 1 1 11  1   2  o 11 458.64  50.29  6575.87   1302.29  6829.48  1841.75  6322.28   1841.68  447.34  74.33  426.71  78.06  20.63   107.78 
1 1 1 11  1   3  o 9  398.71  42.80  4871.93   964.32   4930.42  1363.25  4813.36   1364.25  387.27  63.52  381.81  64.54  5.46    90.56  
1 1 1 11  1   4  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 11  1   5  o 1  561.12  64.38  10325.67  2036.18  10329.30 2879.06  10322.02  2880.12  518.85  100.29 518.53  100.38 0.31    141.90 
1 1 1 11  1   6  o 9  212.77  34.07  1378.82   402.16   0.00     0.00     1378.82   402.16   ?       ?      212.77  34.07  0.00    34.07  
1 1 1 11  1   7  o 2  247.52  39.35  1890.08   540.47   0.00     0.00     1890.08   540.47   ?       ?      247.52  39.35  0.00    39.35  
1 1 1 11  1   8  o 10 255.03  40.51  2018.43   573.23   0.00     0.00     2018.43   573.23   ?       ?      255.03  40.51  0.00    40.51  
1 1 1 11  1   9  o 8  238.38  25.25  1690.55   340.35   1642.03  480.65   1739.35   482.00   230.12  37.69  237.49  36.52  -7.37   52.48  
1 1 1 11  1   10 o 4  340.73  37.02  3573.81   712.42   3842.68  1007.41  3304.84   1007.61  342.10  53.01  312.87  58.24  29.23   78.76  
1 1 1 11  1   11 o 16 229.15  24.58  1570.18   318.32   1576.36  449.16   1563.94   451.19   224.69  36.04  223.61  36.40  1.08    51.22  
1 1 1 11  1   12 o 8  304.56  52.28  3131.72   881.15   3131.72  881.15   0.00      0.00     304.56  52.28  ?       ?      0.00    52.28  
1 1 1 11  1   13 o 15 306.89  53.94  3257.55   915.63   3257.55  915.63   0.00      0.00     306.89  53.94  ?       ?      0.00    53.94  
1 1 1 11  1   14 o 16 112.28  22.90  387.61    142.59   387.61   142.59   0.00      0.00     112.28  22.90  ?       ?      0.00    22.90  
1 1 1 11  1   15 o 14 264.69  29.11  2163.98   435.07   2239.77  614.82   2087.97   615.73   259.42  42.77  248.73  44.77  10.69   61.92  
1 1 1 11  1   16 o 1  67.24   23.41  124.70    110.77   0.00     0.00     124.70    110.77   ?       ?      67.24   23.41  0.00    23.41  
1 1 1 11  1   17 o 9  205.37  22.82  1286.89   264.47   1414.46  371.23   1155.42   376.87   209.92  31.80  186.29  36.55  23.64   48.44  
1 1 1 11  1   18 o 12 170.77  20.21  886.54    194.26   878.41   276.26   894.49    273.22   164.56  30.36  166.51  29.67  -1.95   42.45  
1 1 1 11  1   19 o 13 282.83  33.13  2635.94   527.73   2850.01  746.89   2422.51   745.77   274.72  49.16  246.07  54.25  28.65   73.22  
1 1 1 11  1   20 o 8  133.38  27.82  582.06    206.10   0.00     0.00     582.06    206.10   ?       ?      133.38  27.82  0.00    27.82  
1 1 1 11  1   21 o 8  78.56   21.22  196.22    97.94    219.12   139.77   174.12    137.27   82.68   26.23  75.66   26.07  7.02    36.99  
1 1 1 11  1   22 o 13 179.89  35.21  1152.62   350.63   0.00     0.00     1152.62   350.63   ?       ?      179.89  35.21  0.00    35.21  
1 1 1 11  1   23 o 15 183.53  36.94  1254.03   375.74   0.00     0.00     1254.03   375.74   ?       ?      183.53  36.94  0.00    36.94  
1 1 1 11  1   24 o 7  150.19  20.80  718.88    174.51   735.19   250.83   703.58    242.96   143.38  31.35  140.52  30.96  2.86    44.06  
1 1 1 11  2   0  o 14 280.56  29.47  2344.19   467.59   2344.15  661.01   2344.23   661.52   275.05  43.29  275.04  43.33  0.01    61.25  
1 1 1 11  2   1  o 11 205.01  21.82  1237.55   252.81   1162.33  358.33   1312.11   356.75   195.47  33.11  208.72  30.69  -13.25  45.15  
1 1 1 11  2   2  o 18 352.75  37.32  3763.67   744.39   3698.93  1052.68  3828.42   1052.76  339.45  55.97  346.18  54.80  -6.73   78.33  
1 1 1 11  2   3  o 8  242.13  38.12  1796.38   512.39   1796.38  512.39   0.00      0.00     242.13  38.12  ?       ?      0.00    38.12  
1 1 1 11  2   4  o 15 110.20  22.79  366.98    139.42   0.00     0.00     366.98    139.42   ?       ?      110.20  22.79  0.00    22.79  
1 1 1 11  2   5  o 13 318.70  33.72  3053.18   607.66   3103.83  858.87   3002.41   859.84   313.73  49.31  307.88  50.39  5.85    70.51  
1 1 1 11  2   6  o 5  282.62  44.92  2494.78   704.35   0.00     0.00     2494.78   704.35   ?       ?      282.62  44.92  0.00    44.92  
1 1 1 11  2   7  o 7  401.03  68.89  5467.47   1528.81  0.00     0.00     5467.47   1528.81  ?       ?      401.03  68.89  0.00    68.89  
1 1 1 11  2   8  o 8  162.56  27.49  799.72    247.38   0.00     0.00     799.72    247.38   ?       ?      162.56  27.49  0.00    27.49  
1 1 1 11  2   9  o 18 318.76  34.04  3088.20   613.19   3009.19  865.78   3167.72   868.59   304.41  51.37  313.42  49.95  -9.01   71.65  
1 1 1 11  2   10 o 1  221.71  23.76  1463.46   297.72   1407.32  418.97   1520.73   423.14   212.83  35.55  221.95  34.32  -9.13   49.41  
1 1 1 11  2   11 o 18 328.01  56.65  3665.59   1028.06  3665.59  1028.06  0.00      0.00     328.01  56.65  ?       ?      0.00    56.65  
1 1 1 11  2   12 o 4  197.68  32.29  1215.87   353.73   1215.87  353.73   0.00      0.00     197.68  32.29  ?       ?      0.00    32.29  
1 1 1 11  2   13 o 7  332.67  61.01  4003.78   1122.25  4003.78  1122.25  0.00      0.00     332.67  61.01  ?       ?      0.00    61.01  
1 1 1 11  2   14 o 17 500.45  67.51  9555.61   1890.18  9933.33  2672.95  9177.79   2673.29  427.98  108.63 399.45  112.06 28.53   156.06 
1 1 1 11  2   15 o 14 385.64  45.86  5015.85   995.33   5216.74  1407.07  4814.64   1408.16  359.73  70.66  339.59  74.30  20.14   102.54 
1 1 1 11  2   16 f 0  55.64   22.34  49.38     108.90   0.00     0.00     49.38     108.90   ?       ?      55.64   22.34  0.00    22.34  
1 1 1 11  2   17 o 6  288.69  33.14  2683.97   539.32   3003.38  762.39   2364.01   763.04   290.38  47.37  248.52  54.94  41.85   72.54  
1 1 1 11  2   18 o 4  207.18  23.62  1325.76   275.95   1440.06  389.68   1210.79   390.82   208.96  33.63  188.39  37.46  20.57   50.34  
1 1 1 11  2   19 o 6  114.39  18.10  399.73    114.91   449.17   163.30   351.23    161.74   118.61  24.78  103.92  26.90  14.69   36.58  
1 1 1 11  2   20 o 8  114.53  18.37  403.14    116.69   408.52   166.05   397.89    164.02   111.88  26.30  110.41  26.26  1.47    37.17  
1 1 1 11  2   21 o 4  140.96  19.19  612.97    151.26   692.78   215.42   535.34    212.44   145.58  26.76  125.72  29.88  19.86   40.11  
1 1 1 11  2   22 o 7  118.13  28.36  474.22    189.91   0.00     0.00     474.22    189.91   ?       ?      118.13  28.36  0.00    28.36  
1 1 1 11  2   23 o 1  136.35  29.19  644.22    221.62   0.00     0.00     644.22    221.62   ?       ?      136.35  29.19  0.00    29.19  
1 1 1 11  2   24 o 13 140.70  20.61  632.50    161.52   608.03   232.00   655.51    225.00   129.45  31.52  136.32  29.60  -6.87   43.24  
1 1 1 11  3   0  o 7  328.20  34.70  3243.53   643.96   3282.43  910.03   3204.52   911.37   321.96  50.93  317.57  51.77  4.39    72.62  
1 1 1 11  3   1  o 3  73.12   16.59  160.92    68.05    163.68   92.37    157.64    100.62   74.00   20.85  73.22   22.10  0.77    30.38  
1 1 1 11  3   2  o 4  117.47  15.60  406.02    102.61   383.39   143.79   429.50    146.49   112.65  23.01  119.56  22.16  -6.91   31.95  
1 1 1 11  3   3  x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 11  3   4  o 17 288.72  30.43  2490.23   496.86   2504.96  702.94   2475.52   702.39   283.49  44.67  281.65  44.95  1.84    63.37  
1 1 1 11  3   5  o 13 224.93  35.47  1545.65   442.81   0.00     0.00     1545.65   442.81   ?       ?      224.93  35.47  0.00    35.47  
1 1 1 11  3   6  o 8  210.32  33.52  1348.30   391.09   0.00     0.00     1348.30   391.09   ?       ?      210.32  33.52  0.00    33.52  
1 1 1 11  3   7  o 16 177.74  28.88  956.63    284.55   0.00     0.00     956.63    284.55   ?       ?      177.74  28.88  0.00    28.88  
1 1 1 11  3   8  o 16 210.24  22.51  1308.91   267.48   1268.87  376.85   1349.56   379.71   203.32  33.45  210.17  32.52  -6.85   46.65  
1 1 1 11  3   9  o 1  204.82  22.17  1244.05   256.50   1290.09  362.46   1197.87   363.03   205.31  31.78  197.12  33.26  8.19    46.00  
1 1 1 11  3   10 f 0  416.22  46.78  5563.78   1098.33  5475.16  1552.86  5652.48   1553.68  386.04  72.74  394.04  71.31  -8.00   101.86 
1 1 1 11  3   11 o 14 299.92  50.87  3004.07   844.54   3004.07  844.54   0.00      0.00     299.92  50.87  ?       ?      0.00    50.87  
1 1 1 11  3   12 f 0  248.22  41.09  1990.35   565.07   1990.35  565.07   0.00      0.00     248.22  41.09  ?       ?      0.00    41.09  
1 1 1 11  3   13 o 19 360.76  70.91  5062.58   1416.17  5062.58  1416.17  0.00      0.00     360.76  70.91  ?       ?      0.00    70.91  
1 1 1 11  3   14 o 6  418.80  50.79  6036.82   1196.07  6238.28  1690.72  5834.99   1692.29  383.70  79.38  364.96  82.69  18.73   114.63 
1 1 1 11  3   15 o 14 226.60  24.53  1562.46   314.05   -127.17  432.96   3438.52   456.22   87.59   39.74  337.63  23.69  -250.04 46.26  
1 1 1 11  3   16 f 0  293.84  33.15  2756.53   549.44   2721.23  774.91   2792.21   779.15   274.37  51.08  278.53  50.59  -4.17   71.89  
1 1 1 11  3   17 o 19 98.78   25.05  309.85    142.21   0.00     0.00     309.85    142.21   ?       ?      98.78   25.05  0.00    25.05  
1 1 1 11  3   18 o 18 173.44  31.51  987.05    302.16   0.00     0.00     987.05    302.16   ?       ?      173.44  31.51  0.00    31.51  
1 1 1 11  3   19 o 19 118.79  18.07  431.00    119.36   490.31   167.47   369.78    170.15   124.09  24.38  106.22  27.64  17.87   36.86  
1 1 1 11  3   20 o 11 125.28  18.47  481.84    128.88   514.22   181.73   449.07    182.81   125.80  26.02  116.53  27.73  9.28    38.03  
1 1 1 11  3   21 o 14 178.92  34.28  1117.63   339.32   1117.63  339.32   0.00      0.00     178.92  34.28  ?       ?      0.00    34.28  
1 1 1 11  3   22 o 1  66.58   25.69  113.33    139.00   0.00     0.00     113.33    139.00   ?       ?      66.58   25.69  0.00    25.69  
1 1 1 11  3   23 o 17 104.00  27.92  376.15    170.20   0.00     0.00     376.15    170.20   ?       ?      104.00  27.92  0.00    27.92  
1 1 1 11  3   24 o 13 159.38  33.98  945.18    301.40   0.00     0.00     945.18    301.40   ?       ?      159.38  33.98  0.00    33.98  
1 1 1 11  4   0  o 1  276.82  28.91  2287.05   452.59   2177.74  639.60   2396.69   640.52   263.80  43.77  278.16  41.37  -14.36  60.23  
1 1 1 11  4   1  o 5  458.03  50.42  6611.06   1303.81  6573.11  1843.61  6649.03   1844.13  432.88  77.01  435.96  76.47  -3.08   108.53 
1 1 1 11  4   2  o 17 323.98  52.35  3357.08   940.49   3357.08  940.49   0.00      0.00     323.98  52.35  ?       ?      0.00    52.35  
1 1 1 11  4   3  o 9  496.21  95.56  9406.19   2623.41  0.00     0.00     9406.19   2623.41  ?       ?      496.21  95.56  0.00    95.56  
1 1 1 11  4   4  o 19 367.50  61.47  4470.07   1251.08  0.00     0.00     4470.07   1251.08  ?       ?      367.50  61.47  0.00    61.47  
1 1 1 11  4   5  o 16 246.77  39.15  1884.20   536.07   0.00     0.00     1884.20   536.07   ?       ?      246.77  39.15  0.00    39.15  
1 1 1 11  4   6  o 1  270.22  43.23  2292.60   647.95   0.00     0.00     2292.60   647.95   ?       ?      270.22  43.23  0.00    43.23  
1 1 1 11  4   7  o 4  381.01  41.74  4512.82   897.92   4698.08  1270.00  4327.64   1269.72  373.32  61.39  355.25  64.64  18.07   89.15  
1 1 1 11  4   8  o 14 330.95  35.70  3357.24   667.52   3380.32  943.74   3334.13   944.28   320.48  53.16  317.88  53.65  2.60    75.53  
1 1 1 11  4   9  o 9  396.67  44.56  5006.58   997.14   5273.76  1410.00  4739.28   1410.33  386.48  65.92  361.11  70.56  25.37   96.56  
1 1 1 11  4   10 o 7  358.10  64.92  4591.40   1285.50  4591.40  1285.50  0.00      0.00     358.10  64.92  ?       ?      0.00    64.92  
1 1 1 11  4   11 o 8  388.23  77.31  5949.38   1662.44  5949.38  1662.44  0.00      0.00     388.23  77.31  ?       ?      0.00    77.31  
1 1 1 11  4   12 o 18 175.54  29.40  956.10    285.80   956.10   285.80   0.00      0.00     175.54  29.40  ?       ?      0.00    29.40  
1 1 1 11  4   13 o 14 68.84   18.35  144.19    73.84    207.89   100.14   68.26     109.32   82.25   21.10  58.58   22.73  23.67   31.02  
1 1 1 11  4   14 o 14 371.53  43.59  4588.95   912.01   4780.86  1288.83  4396.47   1290.74  350.22  66.54  330.24  70.25  19.98   96.76  
1 1 1 11  4   15 o 6  250.00  44.13  2134.31   610.15   0.00     0.00     2134.31   610.15   ?       ?      250.00  44.13  0.00    44.13  
1 1 1 11  4   16 o 5  355.12  43.14  4322.79   861.53   4638.25  1217.18  4006.09   1219.58  335.43  65.56  300.93  71.63  34.50   97.11  
1 1 1 11  4   17 o 10 145.65  18.56  641.61    151.67   612.85   209.14   673.51    220.29   138.44  27.29  145.22  27.43  -6.78   38.69  
1 1 1 11  4   18 o 14 62.13   25.01  69.16     136.91   0.00     0.00     69.16     136.91   ?       ?      62.13   25.01  0.00    25.01  
1 1 1 11  4   19 o 3  171.90  20.77  910.02    200.78   900.64   284.41   919.35    283.49   164.35  31.29  166.44  30.81  -2.08   43.91  
1 1 1 11  4   20 o 8  65.91   21.00  132.87    89.52    115.61   123.50   151.97    129.94   65.91   24.48  71.86   25.33  -5.95   35.23  
1 1 1 11  4   21 o 1  73.80   21.25  173.49    94.90    135.94   131.79   213.93    136.76   69.24   25.37  81.31   25.97  -12.07  36.30  
1 1 1 11  4   22 o 6  113.75  28.19  444.91    183.14   0.00     0.00     444.91    183.14   ?       ?      113.75  28.19  0.00    28.19  
1 1 1 11  4   23 o 10 105.29  28.82  392.33    179.21   0.00     0.00     392.33    179.21   ?       ?      105.29  28.82  0.00    28.82  
1 1 1 11  5   0  o 1  242.54  25.53  1751.75   350.09   1708.25  493.97   1795.65   496.24   234.56  37.98  241.02  37.05  -6.46   53.06  
1 1 1 11  5   1  o 18 223.70  35.53  1540.97   441.02   0.00     0.00     1540.97   441.02   ?       ?      223.70  35.53  0.00    35.53  
1 1 1 11  5   2  x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 11  5   3  o 8  378.86  65.48  4906.89   1372.63  0.00     0.00     4906.89   1372.63  ?       ?      378.86  65.48  0.00    65.48  
1 1 1 11  5   4  o 1  40.21   18.24  -52.04    91.14    0.00     0.00     -52.04    91.14    ?       ?      40.21   18.24  0.00    18.24  
1 1 1 11  5   5  o 1  144.76  17.03  617.08    138.85   669.06   194.45   562.99    198.34   149.24  23.47  135.88  26.38  13.36   35.31  
1 1 1 11  5   6  o 18 280.42  29.78  2370.82   472.06   2344.10  666.73   2397.68   668.45   271.32  44.34  274.74  43.86  -3.42   62.36  
1 1 1 11  5   7  o 13 122.97  15.75  446.15    108.66   464.35   150.17   426.15    157.42   124.05  21.89  118.21  24.02  5.84    32.50  
1 1 1 11  5   8  o 6  193.38  21.05  1110.10   229.91   1111.10  322.24   1109.05   328.12   190.13  30.56  189.69  31.22  0.44    43.68  
1 1 1 11  5   9  o 2  241.97  39.59  1862.90   530.92   1862.90  530.92   0.00      0.00     241.97  39.59  ?       ?      0.00    39.59  
1 1 1 11  5   10 o 11 223.79  36.83  1587.54   456.75   1587.54  456.75   0.00      0.00     223.79  36.83  ?       ?      0.00    36.83  
1 1 1 11  5   11 o 19 418.11  99.37  8418.47   2349.75  8418.47  2349.75  0.00      0.00     418.11  99.37  ?       ?      0.00    99.37  
1 1 1 11  5   12 o 10 483.27  64.19  8692.07   1736.73  9511.20  2456.15  7873.00   2456.06  439.64  99.63  375.46  108.11 64.18   147.02 
1 1 1 11  5   13 o 19 276.15  31.11  2375.13   484.57   2716.32  685.50   2034.36   685.07   285.91  43.10  240.04  51.27  45.87   66.98  
1 1 1 11  5   14 o 16 321.11  33.08  3261.22   601.15   907.18   844.85   5675.26   855.55   158.01  62.63  421.16  35.72  -263.16 72.10  
1 1 1 11  5   15 o 1  250.00  27.47  1941.81   387.76   1769.35  544.11   2119.79   552.75   226.39  43.45  251.76  39.55  -25.37  58.75  
1 1 1 11  5   16 o 9  127.92  26.21  519.85    185.97   0.00     0.00     519.85    185.97   ?       ?      127.92  26.21  0.00    26.21  
1 1 1 11  5   17 o 2  232.24  26.67  1699.15   349.19   1776.94  491.53   1619.88   496.16   226.76  39.18  213.68  41.95  13.08   57.40  
1 1 1 11  5   18 o 8  175.16  21.16  944.81    208.46   1086.92  291.23   795.49    298.52   183.22  28.62  152.03  34.94  31.19   45.17  
1 1 1 11  5   19 o 2  254.19  30.14  2124.23   431.21   2135.52  607.33   2112.75   612.36   235.83  46.51  233.48  47.31  2.35    66.35  
1 1 1 11  5   20 o 9  122.01  19.16  462.23    129.80   421.49   177.04   509.57    190.87   112.21  27.66  123.68  27.59  -11.47  39.07  
1 1 1 11  5   21 o 19 174.65  35.61  1102.46   344.89   0.00     0.00     1102.46   344.89   ?       ?      174.65  35.61  0.00    35.61  
1 1 1 11  5   22 o 1  76.46   27.28  185.39    151.07   0.00     0.00     185.39    151.07   ?       ?      76.46   27.28  0.00    27.28  
1 1 1 11  5   23 o 1  62.34   25.31  85.03     141.45   0.00     0.00     85.03     141.45   ?       ?      62.34   25.31  0.00    25.31  
1 1 1 11  6   0  o 6  357.73  62.88  4447.15   1244.22  0.00     0.00     4447.15   1244.22  ?       ?      357.73  62.88  0.00    62.88  
1 1 1 11  6   1  x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 11  6   2  x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 11  6   3  o 10 357.28  38.95  3969.68   786.04   3965.85  1110.67  3973.52   1112.58  341.47  58.78  341.76  58.83  -0.29   83.16  
1 1 1 11  6   4  o 18 447.41  51.57  6554.56   1300.34  6733.72  1838.78  6375.33   1839.13  421.62  78.87  406.34  81.68  15.28   113.54 
1 1 1 11  6   5  o 18 372.31  41.06  4360.65   863.04   4348.70  1219.94  4372.62   1221.11  352.93  62.50  354.06  62.36  -1.13   88.29  
1 1 1 11  6   6  o 12 200.20  21.74  1192.21   245.88   1194.84  347.42   1189.56   348.03   196.66  31.86  196.15  32.01  0.51    45.16  
1 1 1 11  6   7  o 16 389.11  74.93  5772.86   1613.10  5772.86  1613.10  0.00      0.00     389.11  74.93  ?       ?      0.00    74.93  
1 1 1 11  6   8  o 19 450.60  115.48 10762.32  3000.69  10762.32 3000.69  0.00      0.00     450.60  115.48 ?       ?      0.00    115.48 
1 1 1 11  6   9  o 14 238.47  39.24  1824.92   518.54   1824.92  518.54   0.00      0.00     238.47  39.24  ?       ?      0.00    39.24  
1 1 1 11  6   10 o 11 290.30  50.25  2871.89   807.06   2871.89  807.06   0.00      0.00     290.30  50.25  ?       ?      0.00    50.25  
1 1 1 11  6   11 o 8  246.41  26.99  1852.33   375.53   1920.45  528.65   1782.95   533.54   243.49  39.15  232.92  41.42  10.57   56.99  
1 1 1 11  6   12 o 3  201.37  22.34  1222.07   253.87   1204.91  356.31   1239.76   361.82   194.71  33.06  197.55  33.07  -2.84   46.76  
1 1 1 11  6   13 o 2  483.28  71.44  9616.04   1922.43  10481.41 2718.71  8750.67   2718.73  408.91  112.37 346.23  116.09 62.68   161.56 
1 1 1 11  6   14 o 17 25.03   10.07  8.27      22.20    3.29     22.64    132.41    113.08   23.84   9.95   68.61   23.66  -44.77  25.67  
1 1 1 11  6   15 o 10 310.87  36.90  3202.34   645.72   3469.95  912.37   2933.76   914.02   301.62  54.71  268.59  60.71  33.03   81.72  
1 1 1 11  6   16 o 13 122.32  18.16  454.87    123.65   475.42   175.00   434.39    174.75   121.97  25.80  116.07  26.77  5.89    37.18  
1 1 1 11  6   17 o 11 190.49  34.90  1230.61   367.53   0.00     0.00     1230.61   367.53   ?       ?      190.49  34.90  0.00    34.90  
1 1 1 11  6   18 o 17 207.73  24.75  1362.64   289.35   1562.57  409.01   1162.32   409.39   214.16  34.44  178.29  40.87  35.87   53.45  
1 1 1 11  6   19 o 4  125.06  19.00  483.80    132.12   589.51   186.36   376.97    187.34   135.07  24.95  105.42  29.70  29.65   38.79  
1 1 1 11  6   20 o 15 228.66  27.75  1723.40   356.84   1795.10  502.03   1650.18   507.30   217.04  41.81  204.30  44.52  12.74   61.07  
1 1 1 11  6   21 o 18 65.10   26.11  95.17     148.51   0.00     0.00     95.17     148.51   ?       ?      65.10   26.11  0.00    26.11  
1 1 1 11  6   22 o 4  141.01  32.54  729.51    258.05   0.00     0.00     729.51    258.05   ?       ?      141.01  32.54  0.00    32.54  
1 1 1 11  6   23 o 8  78.91   28.97  206.85    171.94   0.00     0.00     206.85    171.94   ?       ?      78.91   28.97  0.00    28.97  
1 1 1 11  7   0  o 5  256.39  27.51  1986.83   398.59   2029.18  562.51   1944.11   564.87   252.35  40.18  246.15  41.45  6.20    57.72  
1 1 1 11  7   1  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 11  7   2  o 1  237.30  38.69  1785.98   508.96   0.00     0.00     1785.98   508.96   ?       ?      237.30  38.69  0.00    38.69  
1 1 1 11  7   3  o 5  87.71   16.13  230.86    78.24    233.74   106.00   227.42    115.98   87.42   21.32  86.21   23.01  1.21    31.37  
1 1 1 11  7   4  o 13 154.20  25.86  725.83    220.84   725.83   220.84   0.00      0.00     154.20  25.86  ?       ?      0.00    25.86  
1 1 1 11  7   5  o 7  76.46   21.62  177.19    99.08    177.19   99.08    0.00      0.00     76.46   21.62  ?       ?      0.00    21.62  
1 1 1 11  7   6  o 10 371.36  71.40  5246.96   1466.94  5246.96  1466.94  0.00      0.00     371.36  71.40  ?       ?      0.00    71.40  
1 1 1 11  7   7  o 3  336.10  61.32  4066.36   1139.46  4066.36  1139.46  0.00      0.00     336.10  61.32  ?       ?      0.00    61.32  
1 1 1 11  7   8  o 4  142.53  25.23  623.55    198.92   623.55   198.92   0.00      0.00     142.53  25.23  ?       ?      0.00    25.23  
1 1 1 11  7   9  o 5  345.42  39.49  3832.07   768.96   4079.24  1087.28  3584.72   1087.68  337.04  58.30  309.99  63.26  27.05   86.03  
1 1 1 11  7   10 o 2  160.82  18.77  771.42    170.07   772.80   240.07   770.02    240.97   157.74  27.51  157.38  27.68  0.36    39.03  
1 1 1 11  7   11 o 5  190.02  21.29  1086.22   228.23   1126.24  320.25   1044.90   325.36   189.20  30.52  181.09  32.49  8.12    44.58  
1 1 1 11  7   12 o 16 93.56   16.87  264.88    87.27    251.04   113.41   284.96    136.64   89.88   22.13  95.33   24.75  -5.45   33.20  
1 1 1 11  7   13 o 7  82.89   17.40  210.14    80.17    -7.27    97.95    651.52    139.56   46.21   20.02  147.78  16.75  -101.57 26.10  
1 1 1 11  7   14 o 15 159.35  18.23  763.83    163.79   591.03   221.75   971.26    242.96   135.11  29.43  176.88  24.59  -41.77  38.35  
1 1 1 11  7   15 o 15 177.49  20.91  962.68    208.97   1054.06  292.07   866.85    299.10   181.02  29.09  161.10  33.44  19.92   44.32  
1 1 1 11  7   16 o 6  131.22  17.71  522.65    129.99   432.70   178.70   623.73    189.44   115.14  27.43  140.43  24.38  -25.28  36.70  
1 1 1 11  7   17 o 3  143.40  20.03  634.09    160.39   806.81   225.25   456.43    228.44   158.88  25.56  115.32  32.90  43.56   41.66  
1 1 1 11  7   18 o 8  306.18  40.18  3397.98   689.17   3746.48  974.53   3049.33   974.74   285.20  61.35  241.95  67.59  43.25   91.28  
1 1 1 11  7   19 o 5  179.65  22.41  1019.62   226.15   1089.03  320.55   950.84    319.10   177.25  32.71  163.17  35.11  14.07   47.98  
1 1 1 11  7   20 o 13 154.60  31.43  837.14    269.44   0.00     0.00     837.14    269.44   ?       ?      154.60  31.43  0.00    31.43  
1 1 1 11  7   21 o 7  81.18   27.46  220.85    152.10   0.00     0.00     220.85    152.10   ?       ?      81.18   27.46  0.00    27.46  
1 1 1 11  7   22 o 18 181.69  41.32  1374.14   421.17   0.00     0.00     1374.14   421.17   ?       ?      181.69  41.32  0.00    41.32  
1 1 1 11  8   0  o 8  97.07   20.68  287.78    111.69   287.78   111.69   0.00      0.00     97.07   20.68  ?       ?      0.00    20.68  
1 1 1 11  8   1  x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 11  8   2  o 10 287.15  48.90  2767.52   777.18   2767.52  777.18   0.00      0.00     287.15  48.90  ?       ?      0.00    48.90  
1 1 1 11  8   3  o 12 260.96  43.46  2228.18   628.25   2228.18  628.25   0.00      0.00     260.96  43.46  ?       ?      0.00    43.46  
1 1 1 11  8   4  o 13 221.70  36.08  1559.24   443.43   1559.24  443.43   0.00      0.00     221.70  36.08  ?       ?      0.00    36.08  
1 1 1 11  8   5  o 16 208.78  34.20  1375.48   395.75   1375.48  395.75   0.00      0.00     208.78  34.20  ?       ?      0.00    34.20  
1 1 1 11  8   6  o 4  369.76  42.22  4443.75   880.07   4450.48  1243.41  4437.00   1245.79  344.31  65.30  343.42  65.58  0.89    92.55  
1 1 1 11  8   7  o 14 339.21  38.76  3692.44   741.21   3965.30  1047.02  3418.32   1049.43  333.08  56.79  302.47  62.51  30.61   84.45  
1 1 1 11  8   8  f 0  383.08  45.00  4897.12   970.71   4940.73  1371.43  4853.33   1374.16  352.30  70.28  347.66  71.25  4.64    100.07 
1 1 1 11  8   9  o 4  107.00  16.87  343.74    100.19   395.69   139.61   288.58    143.85   113.39  22.24  96.04   25.62  17.35   33.93  
1 1 1 11  8   10 o 1  72.52   18.98  161.33    79.91    84.00    112.29   240.70    113.75   61.10   23.21  88.01   22.45  -26.91  32.29  
1 1 1 11  8   11 o 1  303.24  35.24  2974.17   601.98   3219.31  850.24   2727.77   852.42   298.01  51.56  267.18  57.30  30.84   77.08  
1 1 1 11  8   12 o 5  71.13   19.50  155.81    82.01    253.73   112.47   44.64     119.83   90.10   21.95  56.81   23.21  33.29   31.94  
1 1 1 11  8   13 o 16 68.12   16.98  142.77    66.18    4.09     74.81    642.00    141.94   41.78   17.79  146.21  17.24  -104.43 24.77  
1 1 1 11  8   14 o 13 320.94  40.02  3561.89   721.37   3927.18  1018.86  3194.70   1021.48  307.68  59.84  263.70  67.27  43.98   90.03  
1 1 1 11  8   15 o 3  232.39  27.47  1722.42   359.39   1964.43  505.30   1474.65   511.27   237.97  38.29  197.93  45.89  40.05   59.77  
1 1 1 11  8   16 o 5  52.70   19.94  65.04     82.72    111.82   106.19   -7.14     131.91   63.67   22.85  52.81   23.05  10.86   32.46  
1 1 1 11  8   17 o 16 242.83  29.13  1938.15   398.01   2036.29  559.53   1837.63   566.28   232.25  43.57  215.85  47.03  16.39   64.11  
1 1 1 11  8   18 o 3  64.41   21.37  125.62    92.17    118.37   119.70   136.19    144.46   65.55   24.15  70.39   26.41  -4.84   35.79  
1 1 1 11  8   19 o 7  100.28  28.31  345.98    170.11   0.00     0.00     345.98    170.11   ?       ?      100.28  28.31  0.00    28.31  
1 1 1 11  8   20 o 11 145.38  31.98  762.27    259.61   0.00     0.00     762.27    259.61   ?       ?      145.38  31.98  0.00    31.98  
1 1 1 11  8   21 o 1  116.45  30.41  495.08    205.47   0.00     0.00     495.08    205.47   ?       ?      116.45  30.41  0.00    30.41  
1 1 1 11  9   0  o 9  124.03  22.71  471.53    155.73   471.53   155.73   0.00      0.00     124.03  22.71  ?       ?      0.00    22.71  
1 1 1 11  9   1  x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 11  9   2  o 1  265.13  29.38  2169.00   439.68   2357.71  620.31   1978.46   623.31   267.68  41.73  240.98  46.74  26.70   62.66  
1 1 1 11  9   3  o 16 85.18   16.37  219.22    77.11    212.98   101.87   227.60    118.02   83.16   21.26  85.85   23.34  -2.68   31.57  
1 1 1 11  9   4  o 19 111.32  16.01  369.61    99.34    420.55   135.21   309.84    146.45   117.52  20.80  99.57   25.51  17.95   32.92  
1 1 1 11  9   5  o 7  194.68  21.63  1140.26   237.64   1210.65  332.79   1067.03   339.45   196.46  30.50  182.59  33.62  13.87   45.39  
1 1 1 11  9   6  o 18 355.16  41.33  4159.87   826.92   4250.01  1168.02  4069.28   1170.86  332.06  63.59  322.07  65.56  9.99    91.33  
1 1 1 11  9   7  o 9  272.60  30.15  2320.74   463.88   2300.89  655.11   2340.71   656.94   258.71  45.79  261.29  45.45  -2.58   64.51  
1 1 1 11  9   8  o 11 267.69  30.05  2245.78   453.84   2362.87  639.80   2127.18   643.88   262.98  43.93  246.22  47.27  16.76   64.53  
1 1 1 11  9   9  o 18 321.27  37.29  3385.38   674.93   3439.39  953.46   3331.13   955.54   300.27  57.40  293.64  58.74  6.63    82.13  
1 1 1 11  9   10 o 16 171.10  19.89  884.75    191.74   877.86   266.53   892.14    276.03   165.98  29.03  166.86  29.92  -0.88   41.69  
1 1 1 11  9   11 o 8  273.41  31.57  2403.71   486.46   2519.82  685.33   2285.80   690.61   264.25  46.89  247.57  50.31  16.68   68.78  
1 1 1 11  9   12 o 12 214.35  23.31  1417.19   282.17   1182.51  392.48   1668.25   405.95   185.33  38.16  226.10  32.18  -40.77  49.92  
1 1 1 11  9   13 o 6  47.66   17.92  52.31     66.52    -60.07   79.35    317.91    121.99   35.63   16.48  100.52  21.77  -64.89  27.30  
1 1 1 11  9   14 o 2  223.43  26.31  1584.28   330.97   1720.92  466.47   1445.75   469.67   222.40  37.89  199.04  42.40  23.36   56.87  
1 1 1 11  9   15 o 9  255.73  30.60  2157.23   440.34   2270.59  620.80   2042.45   624.69   244.15  45.98  226.70  49.40  17.45   67.49  
1 1 1 11  9   16 o 1  107.80  19.44  362.98    115.85   375.22   162.08   350.20    165.65   106.40  26.61  102.39  27.57  4.01    38.32  
1 1 1 11  9   17 o 4  189.81  37.57  1315.14   394.84   0.00     0.00     1315.14   394.84   ?       ?      189.81  37.57  0.00    37.57  
1 1 1 11  9   18 o 4  56.44   23.97  31.84     135.38   0.00     0.00     31.84     135.38   ?       ?      56.44   23.97  0.00    23.97  
1 1 1 11  9   19 o 10 118.65  29.61  499.69    201.06   0.00     0.00     499.69    201.06   ?       ?      118.65  29.61  0.00    29.61  
1 1 1 11  9   20 o 19 105.74  29.64  405.58    187.12   0.00     0.00     405.58    187.12   ?       ?      105.74  29.64  0.00    29.64  
1 1 1 11  10  0  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 11  10  1  o 18 95.36   17.72  276.28    93.45    290.61   123.75   257.26    142.55   96.59   22.70  90.70   26.02  5.89    34.54  
1 1 1 11  10  2  o 14 165.63  19.02  822.60    177.55   861.63   247.16   780.99    255.22   166.25  26.81  156.89  29.42  9.35    39.80  
1 1 1 11  10  3  o 8  378.34  46.13  4937.64   981.30   5081.60  1386.77  4793.26   1388.78  345.12  72.31  330.20  74.98  14.92   104.17 
1 1 1 11  10  4  o 13 169.46  19.41  863.02    185.46   901.73   257.61   821.36    267.22   169.72  27.37  160.47  30.11  9.25    40.69  
1 1 1 11  10  5  o 10 138.99  17.15  577.86    133.91   579.19   183.00   576.33    196.47   136.55  24.23  135.38  26.23  1.17    35.71  
1 1 1 11  10  6  o 3  458.64  68.98  8842.36   1759.90  9288.31  2487.92  8395.73   2489.82  368.92  109.54 335.20  111.06 33.72   155.99 
1 1 1 11  10  7  o 13 177.95  20.48  958.75    205.40   1045.50  287.93   868.86    293.09   181.75  28.53  163.23  32.42  18.53   43.19  
1 1 1 11  10  8  o 14 72.77   18.26  163.39    76.14    172.99   97.08    148.03    122.75   74.81   21.48  71.75   24.66  3.06    32.70  
1 1 1 11  10  9  o 6  213.24  24.37  1406.75   292.99   1536.32  410.90   1272.74   417.88   215.82  34.31  192.36  39.18  23.47   52.08  
1 1 1 11  10  10 o 18 148.57  18.37  667.62    153.37   740.25   212.33   588.39    221.77   153.46  24.96  134.20  29.58  19.26   38.71  
1 1 1 11  10  11 o 2  128.97  17.42  503.47    125.67   585.98   171.13   406.91    185.14   137.11  22.52  111.34  28.76  25.77   36.53  
1 1 1 11  10  12 o 6  174.00  19.14  921.13    188.02   11.47    247.31   2167.19   289.45   71.92   31.47  267.79  18.95  -195.87 36.74  
1 1 1 11  10  13 o 4  149.20  18.95  681.05    158.64   736.26   218.35   619.34    230.86   151.32  26.08  136.01  30.34  15.32   40.01  
1 1 1 11  10  14 o 8  214.67  24.81  1463.35   300.08   1397.63  420.17   1531.77   428.71   197.36  38.47  208.10  37.25  -10.75  53.55  
1 1 1 11  10  15 o 8  78.01   26.36  190.96    140.22   0.00     0.00     190.96    140.22   ?       ?      78.01   26.36  0.00    26.36  
1 1 1 11  10  16 o 4  80.18   26.92  207.11    146.25   0.00     0.00     207.11    146.25   ?       ?      80.18   26.92  0.00    26.92  
1 1 1 11  10  17 o 2  174.80  35.89  1129.43   348.05   0.00     0.00     1129.43   348.05   ?       ?      174.80  35.89  0.00    35.89  
1 1 1 11  10  18 o 10 80.40   27.49  216.23    152.51   0.00     0.00     216.23    152.51   ?       ?      80.40   27.49  0.00    27.49  
1 1 1 11  10  19 o 11 58.32   24.73  46.51     143.67   0.00     0.00     46.51     143.67   ?       ?      58.32   24.73  0.00    24.73  
1 1 1 11  11  0  o 7  156.62  29.83  787.16    258.37   0.00     0.00     787.16    258.37   ?       ?      156.62  29.83  0.00    29.83  
1 1 1 11  11  1  o 1  288.23  33.15  2675.26   538.56   2775.32  759.45   2574.03   763.85   276.39  49.69  262.76  52.48  13.62   72.27  
1 1 1 11  11  2  o 18 87.16   19.62  235.05    95.79    301.02   125.38   142.55    148.47   98.01   22.73  73.44   26.92  24.57   35.23  
1 1 1 11  11  3  o 9  257.46  29.41  2093.82   426.89   2256.19  600.61   1928.06   606.85   255.69  42.40  231.28  47.30  24.41   63.53  
1 1 1 11  11  4  o 1  354.52  44.28  4387.82   881.56   4782.23  1246.04  3992.56   1247.39  334.94  67.14  292.05  74.25  42.89   100.11 
1 1 1 11  11  5  o 9  59.20   18.62  103.90    70.56    123.32   94.34    79.25     106.28   65.09   21.62  59.14   22.55  5.95    31.24  
1 1 1 11  11  6  o 15 274.59  32.03  2436.06   495.39   2678.46  698.88   2191.29   702.30   272.84  46.27  239.01  52.61  33.83   70.07  
1 1 1 11  11  7  o 1  83.69   17.15  214.95    79.63    219.25   104.66   209.04    122.72   83.58   21.64  81.69   24.35  1.89    32.58  
1 1 1 11  11  8  o 10 113.26  16.65  387.88    104.99   425.32   140.87   341.09    157.48   116.76  21.82  102.75  26.52  14.00   34.34  
1 1 1 11  11  9  o 11 119.02  17.10  429.46    113.48   489.20   155.04   360.51    166.56   124.99  22.43  105.17  27.34  19.82   35.36  
1 1 1 11  11  10 o 2  245.16  28.88  1938.19   398.61   2148.88  560.41   1722.45   567.09   245.35  41.25  211.86  47.77  33.49   63.12  
1 1 1 11  11  11 o 3  109.52  15.69  362.88    95.81    478.27   119.43   154.52    160.48   125.48  17.02  74.99   27.90  50.50   32.68  
1 1 1 11  11  12 o 11 142.93  29.47  681.91    233.78   0.00     0.00     681.91    233.78   ?       ?      142.93  29.47  0.00    29.47  
1 1 1 11  11  13 o 13 117.68  27.56  462.26    182.88   0.00     0.00     462.26    182.88   ?       ?      117.68  27.56  0.00    27.56  
1 1 1 11  11  14 o 12 203.16  40.81  1561.67   459.46   0.00     0.00     1561.67   459.46   ?       ?      203.16  40.81  0.00    40.81  
1 1 1 11  11  15 o 2  113.96  28.85  449.39    188.88   0.00     0.00     449.39    188.88   ?       ?      113.96  28.85  0.00    28.85  
1 1 1 11  11  16 o 4  69.41   26.79  132.02    151.17   0.00     0.00     132.02    151.17   ?       ?      69.41   26.79  0.00    26.79  
1 1 1 11  11  17 o 10 103.26  29.32  381.82    181.85   0.00     0.00     381.82    181.85   ?       ?      103.26  29.32  0.00    29.32  
1 1 1 11  12  0  o 6  216.80  25.01  1463.24   305.53   1610.10  429.30   1312.50   434.93   219.69  35.23  193.72  40.42  25.97   53.62  
1 1 1 11  12  1  o 2  113.65  18.40  394.17    115.96   387.35   154.94   402.85    174.86   110.20  25.06  111.53  27.49  -1.33   37.20  
1 1 1 11  12  2  o 7  317.00  38.19  3408.86   680.93   3456.57  960.28   3360.62   965.70   289.59  59.75  283.09  61.21  6.50    85.53  
1 1 1 11  12  3  o 2  157.11  20.03  752.90    176.59   844.47   242.43   649.38    257.74   162.96  26.85  139.27  32.79  23.69   42.38  
1 1 1 11  12  4  o 9  69.42   20.92  148.02    90.22    108.40   113.55   215.88    148.61   64.32   23.55  83.37   27.11  -19.04  35.91  
1 1 1 11  12  5  o 19 348.86  44.95  4407.40   879.25   4526.83  1241.67  4287.29   1245.24  307.25  71.71  293.53  73.95  13.72   103.01 
1 1 1 11  12  6  o 12 168.13  20.16  864.67    190.70   987.41   264.52   731.86    275.17   175.75  27.09  147.01  33.37  28.74   42.98  
1 1 1 11  12  7  o 7  95.03   25.81  292.50    144.44   0.00     0.00     292.50    144.44   ?       ?      95.03   25.81  0.00    25.81  
1 1 1 11  12  8  o 11 219.94  41.99  1760.49   510.84   0.00     0.00     1760.49   510.84   ?       ?      219.94  41.99  0.00    41.99  
1 1 1 11  12  9  o 17 65.32   24.86  106.10    128.95   0.00     0.00     106.10    128.95   ?       ?      65.32   24.86  0.00    24.86  
1 1 1 11  12  10 o 17 137.15  28.85  627.66    219.90   0.00     0.00     627.66    219.90   ?       ?      137.15  28.85  0.00    28.85  
1 1 1 11  12  11 o 16 92.10   27.08  281.82    152.66   0.00     0.00     281.82    152.66   ?       ?      92.10   27.08  0.00    27.08  
1 1 1 11  12  12 o 6  114.29  28.48  445.38    186.16   0.00     0.00     445.38    186.16   ?       ?      114.29  28.48  0.00    28.48  
1 1 1 11  12  13 o 4  138.21  30.53  666.32    235.77   0.00     0.00     666.32    235.77   ?       ?      138.21  30.53  0.00    30.53  
1 1 1 11  12  14 o 7  128.95  18.90  521.78    135.75   549.09   179.80   485.58    207.01   128.27  25.32  116.77  30.54  11.50   39.67  
1 1 1 11  12  15 o 1  120.85  29.45  517.35    202.41   0.00     0.00     517.35    202.41   ?       ?      120.85  29.45  0.00    29.45  
1 1 1 11  13  0  o 12 78.32   26.31  188.18    139.62   0.00     0.00     188.18    139.62   ?       ?      78.32   26.31  0.00    26.31  
1 1 1 11  13  1  o 5  237.33  46.84  2141.88   615.55   0.00     0.00     2141.88   615.55   ?       ?      237.33  46.84  0.00    46.84  
1 1 1 11  13  2  f 0  145.56  28.92  697.64    233.11   0.00     0.00     697.64    233.11   ?       ?      145.56  28.92  0.00    28.92  
1 1 1 11  13  3  o 12 204.54  39.08  1489.22   442.10   0.00     0.00     1489.22   442.10   ?       ?      204.54  39.08  0.00    39.08  
1 1 1 11  13  4  o 3  278.16  68.19  3821.91   1080.32  0.00     0.00     3821.91   1080.32  ?       ?      278.16  68.19  0.00    68.19  
1 1 1 11  13  5  o 15 108.56  28.70  394.22    181.52   0.00     0.00     394.22    181.52   ?       ?      108.56  28.70  0.00    28.70  
1 1 1 11  13  6  o 12 58.62   25.40  9.15      157.77   0.00     0.00     9.15      157.77   ?       ?      58.62   25.40  0.00    25.40  
1 1 1 11  13  7  o 17 211.76  42.34  1686.98   496.75   0.00     0.00     1686.98   496.75   ?       ?      211.76  42.34  0.00    42.34  
1 1 1 11  13  8  o 17 243.19  54.01  2574.21   734.46   0.00     0.00     2574.21   734.46   ?       ?      243.19  54.01  0.00    54.01  
1 1 1 11  13  9  o 2  158.47  20.48  784.97    181.96   937.13   250.67   615.49    264.55   168.81  26.76  130.41  34.72  38.40   43.84  
1 1 1 11  13  10 o 19 113.90  17.16  400.29    108.75   570.64   141.83   157.30    169.39   135.54  18.73  74.75   28.48  60.79   34.08  
1 1 1 11  13  11 o 12 115.48  19.28  419.56    123.29   -317.59  153.83   1743.54   206.16   38.16   18.89  240.71  14.99  -202.55 24.12  
1 1 1 11  13  12 f 0  105.45  18.54  349.98    108.13   464.64   141.27   187.75    168.04   120.36  21.22  77.79   28.62  42.58   35.63  
1 1 1 12  -12 0  o 12 79.30   26.17  208.22    138.27   208.22   138.27   0.00      0.00     79.30   26.17  ?       ?      0.00    26.17  
1 1 1 12  -12 1  o 4  132.27  18.32  546.17    135.37   612.23   195.08   484.80    188.01   134.97  26.12  118.38  28.09  16.60   38.36  
1 1 1 12  -12 2  o 7  65.69   20.45  136.16    85.33    165.16   124.83   110.72    116.90   72.41   24.87  63.52   23.78  8.89    34.41  
1 1 1 12  -11 0  o 12 182.46  35.73  1204.87   360.80   1204.87  360.80   0.00      0.00     182.46  35.73  ?       ?      0.00    35.73  
1 1 1 12  -11 1  o 4  80.54   25.34  211.46    130.65   211.46   130.65   0.00      0.00     80.54   25.34  ?       ?      0.00    25.34  
1 1 1 12  -11 2  o 19 122.48  17.96  464.22    122.56   502.42   182.81   433.02    165.17   122.56  26.74  114.10  25.82  8.46    37.17  
1 1 1 12  -11 3  o 15 109.98  17.81  375.25    108.61   448.03   162.40   316.35    146.09   116.58  25.02  97.34   25.75  19.24   35.90  
1 1 1 12  -11 4  o 4  123.61  17.80  472.13    122.70   484.10   183.67   462.49    164.89   119.88  27.30  118.47  25.03  1.42    37.04  
1 1 1 12  -11 5  o 1  92.39   19.26  270.20    98.82    315.25   150.18   235.80    131.24   96.91   26.32  84.57   25.17  12.34   36.42  
1 1 1 12  -11 6  o 16 57.12   19.12  96.60     73.79    116.81   107.33   78.48     101.63   63.92   22.97  57.24   22.00  6.68    31.80  
1 1 1 12  -11 7  o 11 160.39  19.38  799.30    174.82   818.59   250.49   780.98    244.09   155.38  29.15  151.75  29.08  3.63    41.18  
1 1 1 12  -10 0  o 8  98.04   20.14  302.75    109.52   258.94   151.80   350.32    158.18   88.91   27.20  102.92  26.59  -14.02  38.04  
1 1 1 12  -10 1  x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 12  -10 2  o 16 219.68  42.71  1800.13   519.17   1800.13  519.17   0.00      0.00     219.68  42.71  ?       ?      0.00    42.71  
1 1 1 12  -10 3  o 6  64.41   25.68  86.33     142.79   0.00     0.00     86.33     142.79   ?       ?      64.41   25.68  0.00    25.68  
1 1 1 12  -10 4  o 6  126.43  19.63  495.66    137.84   391.16   189.85   612.17    200.47   107.55  29.75  137.01  26.45  -29.46  39.80  
1 1 1 12  -10 5  o 13 120.19  16.65  439.87    111.78   466.05   159.75   414.76    156.47   120.37  23.96  112.98  24.81  7.39    34.49  
1 1 1 12  -10 6  o 1  100.78  16.82  311.86    93.89    325.50   134.94   299.07    130.71   100.18  23.82  95.98   23.83  4.20    33.69  
1 1 1 12  -10 7  o 1  105.65  16.95  342.86    99.33    367.55   142.38   319.43    138.65   106.41  23.89  98.82   24.55  7.60    34.26  
1 1 1 12  -10 8  o 13 81.62   18.25  209.27    83.36    160.18   121.57   252.83    114.52   72.26   24.55  88.43   22.51  -16.17  33.30  
1 1 1 12  -10 9  o 7  208.15  24.60  1388.75   288.29   1326.15  408.97   1450.58   406.45   189.52  38.90  201.06  36.56  -11.54  53.38  
1 1 1 12  -10 10 o 10 68.59   23.56  142.07    112.03   0.00     0.00     142.07    112.03   ?       ?      68.59   23.56  0.00    23.56  
1 1 1 12  -9  0  f 0  224.72  42.43  1833.04   527.37   0.00     0.00     1833.04   527.37   ?       ?      224.72  42.43  0.00    42.43  
1 1 1 12  -9  1  o 9  72.24   21.04  162.70    92.57    204.03   129.43   119.42    132.45   80.54   25.20  67.83   25.33  12.72   35.73  
1 1 1 12  -9  2  o 7  221.45  25.73  1548.41   321.00   1502.09  454.14   1594.66   453.77   205.87  39.87  213.71  38.40  -7.85   55.35  
1 1 1 12  -9  3  o 4  122.62  26.73  487.90    182.86   487.90   182.86   0.00      0.00     122.62  26.73  ?       ?      0.00    26.73  
1 1 1 12  -9  4  o 12 161.20  30.51  858.32    272.02   858.32   272.02   0.00      0.00     161.20  30.51  ?       ?      0.00    30.51  
1 1 1 12  -9  5  o 9  64.29   19.43  126.50    77.77    52.31    123.92   174.71    99.90    57.91   23.62  74.70   21.89  -16.79  32.20  
1 1 1 12  -9  6  f 0  64.79   19.24  129.09    76.75    41.53    128.49   177.66    95.70    57.37   23.79  75.21   21.24  -17.84  31.89  
1 1 1 12  -9  7  o 9  152.39  18.75  708.74    160.59   849.77   236.99   588.99    218.38   162.79  26.25  133.25  29.34  29.53   39.37  
1 1 1 12  -9  8  o 1  119.08  27.98  468.73    188.04   468.73   188.04   0.00      0.00     119.08  27.98  ?       ?      0.00    27.98  
1 1 1 12  -9  9  f 0  67.66   19.78  142.54    81.67    97.90    136.99   167.16    101.73   65.16   25.40  73.03   22.26  -7.87   33.77  
1 1 1 12  -9  10 o 6  89.88   27.53  265.62    155.38   265.62   155.38   0.00      0.00     89.88   27.53  ?       ?      0.00    27.53  
1 1 1 12  -9  11 x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 12  -9  12 x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 12  -8  0  o 19 180.43  32.68  1076.12   326.03   0.00     0.00     1076.12   326.03   ?       ?      180.43  32.68  0.00    32.68  
1 1 1 12  -8  1  o 1  191.01  34.19  1215.79   361.18   0.00     0.00     1215.79   361.18   ?       ?      191.01  34.19  0.00    34.19  
1 1 1 12  -8  2  o 18 176.27  21.31  951.32    211.22   1034.88  302.39   871.70    295.17   178.42  30.63  162.03  32.86  16.39   44.92  
1 1 1 12  -8  3  o 18 222.75  25.53  1549.67   320.56   1682.70  455.42   1419.04   451.29   223.14  36.84  201.51  40.42  21.63   54.69  
1 1 1 12  -8  4  o 15 72.85   23.81  159.74    114.59   159.74   114.59   0.00      0.00     72.85   23.81  ?       ?      0.00    23.81  
1 1 1 12  -8  5  o 5  168.62  30.73  928.15    286.47   928.15   286.47   0.00      0.00     168.62  30.73  ?       ?      0.00    30.73  
1 1 1 12  -8  6  o 18 137.31  17.75  570.20    136.65   601.62   200.36   542.88    186.84   137.19  26.40  130.42  25.87  6.78    36.96  
1 1 1 12  -8  7  o 12 180.94  21.03  1002.81   214.41   994.81   309.64   1010.18   297.17   173.26  32.32  175.85  30.55  -2.59   44.47  
1 1 1 12  -8  8  o 19 91.46   18.30  258.39    92.74    330.90   139.56   201.05    124.10   101.71  24.25  80.08   24.61  21.63   34.55  
1 1 1 12  -8  9  o 6  228.51  26.10  1650.07   336.19   1745.93  479.55   1557.42   471.44   223.71  38.74  209.10  40.74  14.61   56.22  
1 1 1 12  -8  10 x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 12  -8  11 o 2  107.26  18.43  354.96    109.41   320.09   164.04   382.90    146.85   98.49   27.80  109.13  24.09  -10.63  36.79  
1 1 1 12  -8  12 o 17 81.94   19.93  212.20    92.84    162.70   153.65   240.67    116.52   75.18   27.42  86.48   23.05  -11.31  35.82  
1 1 1 12  -8  13 o 19 76.27   23.87  184.58    116.12   0.00     0.00     184.58    116.12   ?       ?      76.27   23.87  0.00    23.87  
1 1 1 12  -8  14 o 7  65.48   23.29  123.37    110.09   0.00     0.00     123.37    110.09   ?       ?      65.48   23.29  0.00    23.29  
1 1 1 12  -7  0  o 13 78.03   25.43  183.51    130.79   0.00     0.00     183.51    130.79   ?       ?      78.03   25.43  0.00    25.43  
1 1 1 12  -7  1  o 17 255.95  46.96  2339.18   664.53   0.00     0.00     2339.18   664.53   ?       ?      255.95  46.96  0.00    46.96  
1 1 1 12  -7  2  o 7  229.52  41.05  1803.07   521.02   0.00     0.00     1803.07   521.02   ?       ?      229.52  41.05  0.00    41.05  
1 1 1 12  -7  3  o 1  105.26  18.25  337.49    106.28   391.61   173.86   305.21    134.29   110.47  27.52  98.36   24.00  12.11   36.51  
1 1 1 12  -7  4  o 4  40.87   16.83  17.33     63.69    19.29    88.24    15.20     92.02    47.19   19.66  47.50   19.95  -0.31   28.01  
1 1 1 12  -7  5  o 5  125.76  23.99  495.35    166.88   495.35   166.88   0.00      0.00     125.76  23.99  ?       ?      0.00    23.99  
1 1 1 12  -7  6  o 7  57.36   21.32  80.03     93.70    80.03    93.70    0.00      0.00     57.36   21.32  ?       ?      0.00    21.32  
1 1 1 12  -7  7  o 10 192.92  21.75  1136.96   236.74   1126.34  334.34   1147.64   335.26   185.47  32.59  187.43  32.33  -1.96   45.90  
1 1 1 12  -7  8  f 0  62.05   18.43  116.82    70.44    56.60    97.48    182.62    101.90   54.24   21.34  76.61   22.01  -22.36  30.66  
1 1 1 12  -7  9  o 2  157.05  28.22  792.42    245.06   792.42   245.06   0.00      0.00     157.05  28.22  ?       ?      0.00    28.22  
1 1 1 12  -7  10 o 8  271.74  55.22  2950.24   832.03   0.00     0.00     2950.24   832.03   ?       ?      271.74  55.22  0.00    55.22  
1 1 1 12  -7  11 o 16 126.37  17.16  483.59    121.30   503.93   173.71   464.24    169.44   125.69  24.96  120.35  25.33  5.34    35.56  
1 1 1 12  -7  12 o 15 58.25   19.28  99.08     75.03    149.66   109.23   53.90     103.24   70.45   23.26  54.59   21.81  15.86   31.88  
1 1 1 12  -7  13 o 10 70.54   19.36  155.61    80.73    203.69   116.60   111.35    111.89   80.03   23.70  64.19   23.40  15.85   33.30  
1 1 1 12  -7  14 o 3  59.89   22.86  86.39     109.24   0.00     0.00     86.39     109.24   ?       ?      59.89   22.86  0.00    22.86  
1 1 1 12  -7  15 o 18 85.92   24.74  240.85    128.60   0.00     0.00     240.85    128.60   ?       ?      85.92   24.74  0.00    24.74  
1 1 1 12  -7  16 o 17 73.88   20.96  173.78    93.00    190.49   147.14   162.67    120.01   78.10   26.99  72.52   24.39  5.58    36.38  
1 1 1 12  -6  0  o 14 283.70  31.76  2540.92   508.38   2540.56  718.30   2541.27   719.63   268.81  48.32  268.74  48.43  0.06    68.41  
1 1 1 12  -6  1  o 11 128.20  27.00  518.31    192.43   0.00     0.00     518.31    192.43   ?       ?      128.20  27.00  0.00    27.00  
1 1 1 12  -6  2  o 16 172.29  30.50  942.70    290.63   0.00     0.00     942.70    290.63   ?       ?      172.29  30.50  0.00    30.50  
1 1 1 12  -6  3  o 2  136.68  16.51  556.58    126.92   511.38   180.37   600.91    178.62   127.87  25.47  139.83  23.06  -11.95  34.35  
1 1 1 12  -6  4  o 4  138.15  16.72  569.20    129.89   621.91   182.95   515.62    184.45   142.18  23.22  128.16  25.96  14.02   34.83  
1 1 1 12  -6  5  o 5  242.10  26.76  1811.80   365.74   1757.67  516.84   1866.09   517.62   228.18  40.96  236.43  39.53  -8.24   56.93  
1 1 1 12  -6  6  o 7  207.99  35.51  1417.24   408.77   1417.24  408.77   0.00      0.00     207.99  35.51  ?       ?      0.00    35.51  
1 1 1 12  -6  7  x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 12  -6  8  o 6  114.59  16.10  394.00    102.97   360.69   143.33   429.52    148.03   107.03  23.93  117.44  22.78  -10.41  33.04  
1 1 1 12  -6  9  x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 12  -6  10 o 18 86.67   22.97  236.58    116.09   236.58   116.09   0.00      0.00     86.67   22.97  ?       ?      0.00    22.97  
1 1 1 12  -6  11 o 7  76.34   17.94  180.22    77.26    203.26   108.24   156.30    110.32   80.49   22.54  72.02   23.35  8.47    32.45  
1 1 1 12  -6  12 o 16 107.50  17.05  351.22    101.71   295.41   143.47   407.62    144.22   95.86   25.59  113.77  22.88  -17.91  34.33  
1 1 1 12  -6  13 o 12 155.67  18.82  737.14    164.76   761.31   233.16   713.03    232.86   153.67  27.44  148.03  28.44  5.64    39.51  
1 1 1 12  -6  14 o 14 55.87   19.68  85.57     78.48    93.78    107.86   76.34     114.39   61.07   22.84  59.44   23.20  1.63    32.56  
1 1 1 12  -6  15 f 0  119.64  25.72  466.32    171.41   0.00     0.00     466.32    171.41   ?       ?      119.64  25.72  0.00    25.72  
1 1 1 12  -6  16 o 10 132.24  27.09  578.29    198.73   0.00     0.00     578.29    198.73   ?       ?      132.24  27.09  0.00    27.09  
1 1 1 12  -6  17 o 5  91.12   26.08  275.46    143.34   275.46   143.34   0.00      0.00     91.12   26.08  ?       ?      0.00    26.08  
1 1 1 12  -5  0  o 12 239.35  26.36  1751.24   356.25   1648.57  504.14   1853.64   503.49   223.15  40.86  238.98  37.97  -15.83  55.78  
1 1 1 12  -5  1  o 6  82.19   20.12  207.66    94.17    228.46   132.36   186.34    134.00   86.13   25.18  79.32   25.74  6.82    36.01  
1 1 1 12  -5  2  o 1  78.89   21.81  191.04    102.09   0.00     0.00     191.04    102.09   ?       ?      78.89   21.81  0.00    21.81  
1 1 1 12  -5  3  o 14 261.29  44.99  2304.34   650.54   0.00     0.00     2304.34   650.54   ?       ?      261.29  44.99  0.00    44.99  
1 1 1 12  -5  4  o 11 60.33   17.95  108.75    66.76    97.16    94.10    120.50    94.72    60.75   21.54  65.03   21.67  -4.29   30.55  
1 1 1 12  -5  5  o 17 288.87  32.15  2620.20   524.06   2415.04  740.78   2825.75   741.48   261.06  51.26  287.58  46.50  -26.52  69.21  
1 1 1 12  -5  6  o 11 87.33   21.78  236.26    108.84   236.26   108.84   0.00      0.00     87.33   21.78  ?       ?      0.00    21.78  
1 1 1 12  -5  7  o 12 100.33  22.18  312.23    124.32   312.23   124.32   0.00      0.00     100.33  22.18  ?       ?      0.00    22.18  
1 1 1 12  -5  8  o 14 327.84  68.76  4471.90   1252.64  4471.90  1252.64  0.00      0.00     327.84  68.76  ?       ?      0.00    68.76  
1 1 1 12  -5  9  x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 12  -5  10 o 9  141.97  17.43  604.84    139.11   596.56   195.78   613.28    197.70   137.66  25.72  139.68  25.60  -2.01   36.29  
1 1 1 12  -5  11 o 9  122.69  16.74  452.75    114.87   506.37   160.42   396.34    164.55   127.63  22.73  111.37  26.18  16.27   34.67  
1 1 1 12  -5  12 o 16 174.10  20.09  920.77    197.10   931.34   278.90   910.22    278.57   169.92  29.67  167.72  30.04  2.20    42.22  
1 1 1 12  -5  13 o 6  55.88   19.24  87.02     74.70    96.00    104.42   77.60     106.91   61.27   22.56  58.80   22.57  2.47    31.91  
1 1 1 12  -5  14 o 4  254.41  29.47  2086.69   422.43   2032.13  598.31   2140.93   596.51   233.70  46.24  241.97  44.59  -8.28   64.23  
1 1 1 12  -5  15 o 17 108.71  25.36  382.60    155.35   0.00     0.00     382.60    155.35   ?       ?      108.71  25.36  0.00    25.36  
1 1 1 12  -5  16 o 19 122.93  26.18  493.40    179.07   0.00     0.00     493.40    179.07   ?       ?      122.93  26.18  0.00    26.18  
1 1 1 12  -5  17 f 0  84.92   24.37  234.64    125.04   0.00     0.00     234.64    125.04   ?       ?      84.92   24.37  0.00    24.37  
1 1 1 12  -5  18 o 6  157.76  20.14  775.76    178.21   693.71   253.16   856.38    250.93   140.97  32.02  160.10  28.34  -19.13  42.76  
1 1 1 12  -4  0  f 0  217.22  23.83  1423.71   292.34   1350.27  409.77   1499.83   417.19   205.34  36.08  217.52  34.56  -12.18  49.96  
1 1 1 12  -4  1  o 5  102.50  22.76  323.98    130.43   323.98   130.43   0.00      0.00     102.50  22.76  ?       ?      0.00    22.76  
1 1 1 12  -4  2  o 19 149.31  25.59  685.43    211.42   0.00     0.00     685.43    211.42   ?       ?      149.31  25.59  0.00    25.59  
1 1 1 12  -4  3  f 0  133.10  24.50  544.72    180.33   0.00     0.00     544.72    180.33   ?       ?      133.10  24.50  0.00    24.50  
1 1 1 12  -4  4  o 18 136.71  24.86  575.30    187.96   0.00     0.00     575.30    187.96   ?       ?      136.71  24.86  0.00    24.86  
1 1 1 12  -4  5  o 3  389.24  45.48  5043.08   997.17   5145.66  1410.50  4940.59   1409.94  361.23  70.55  351.19  72.34  10.04   101.05 
1 1 1 12  -4  6  o 8  165.37  18.88  815.58    176.06   820.91   250.04   810.34    247.93   162.54  27.80  161.49  27.74  1.05    39.27  
1 1 1 12  -4  7  o 9  208.86  34.94  1398.52   404.17   1398.52  404.17   0.00      0.00     208.86  34.94  ?       ?      0.00    34.94  
1 1 1 12  -4  8  x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 12  -4  9  o 16 99.04   16.45  295.38    90.23    330.61   129.61   262.25    125.70   103.20  22.51  91.63   23.71  11.56   32.70  
1 1 1 12  -4  10 o 3  113.44  16.60  386.32    104.91   401.48   146.23   370.24    150.61   113.57  23.21  108.51  24.73  5.07    33.92  
1 1 1 12  -4  11 o 19 70.36   18.45  152.32    75.45    191.02   102.14   105.85    111.92   78.47   21.86  64.11   23.40  14.36   32.02  
1 1 1 12  -4  12 o 6  77.91   18.50  187.54    81.51    141.16   116.89   231.45    113.72   70.14   24.06  85.88   22.72  -15.74  33.09  
1 1 1 12  -4  13 o 16 90.82   17.73  252.94    89.10    164.16   125.78   342.39    126.25   74.39   24.97  104.70  21.72  -30.31  33.09  
1 1 1 12  -4  14 o 14 280.38  58.44  3228.49   910.07   3228.49  910.07   0.00      0.00     280.38  58.44  ?       ?      0.00    58.44  
1 1 1 12  -4  15 o 1  150.03  18.87  685.38    158.94   589.21   224.35   782.28    225.21   133.42  30.02  156.74  25.94  -23.32  39.67  
1 1 1 12  -4  16 x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 12  -4  17 o 11 179.89  33.65  1112.28   334.68   0.00     0.00     1112.28   334.68   ?       ?      179.89  33.65  0.00    33.65  
1 1 1 12  -4  18 o 18 132.74  18.70  544.77    138.58   555.27   197.46   534.58    194.52   129.04  27.50  126.51  27.57  2.53    38.94  
1 1 1 12  -4  19 f 0  211.91  25.34  1454.53   302.12   1470.44  428.10   1438.75   426.44   198.91  38.89  196.31  39.21  2.60    55.23  
1 1 1 12  -3  0  o 11 154.18  18.18  706.19    157.85   782.50   218.76   623.32    227.98   160.32  24.55  141.17  29.10  19.15   38.07  
1 1 1 12  -3  1  o 12 89.86   16.45  242.92    81.74    249.54   117.47   236.71    113.80   90.01   22.73  87.72   22.49  2.29    31.98  
1 1 1 12  -3  2  o 19 405.12  47.09  5435.14   1074.65  5601.25  1520.05  5269.15   1519.53  379.81  72.36  364.17  75.18  15.63   104.34 
1 1 1 12  -3  3  o 19 187.87  30.87  1099.11   321.35   0.00     0.00     1099.11   321.35   ?       ?      187.87  30.87  0.00    30.87  
1 1 1 12  -3  4  o 15 125.95  23.29  485.19    162.20   0.00     0.00     485.19    162.20   ?       ?      125.95  23.29  0.00    23.29  
1 1 1 12  -3  5  o 17 309.74  34.12  2997.49   596.57   3171.75  843.87   2823.39   843.47   305.63  49.81  284.68  53.58  20.95   73.16  
1 1 1 12  -3  6  o 6  192.77  21.17  1111.71   230.38   1086.57  326.60   1136.62   325.03   186.09  31.71  190.90  30.70  -4.81   44.14  
1 1 1 12  -3  7  o 7  213.68  35.42  1456.42   419.22   1456.42  419.22   0.00      0.00     213.68  35.42  ?       ?      0.00    35.42  
1 1 1 12  -3  8  x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 12  -3  9  o 10 275.40  48.75  2630.89   742.60   2630.89  742.60   0.00      0.00     275.40  48.75  ?       ?      0.00    48.75  
1 1 1 12  -3  10 o 17 185.28  31.79  1093.63   325.97   1093.63  325.97   0.00      0.00     185.28  31.79  ?       ?      0.00    31.79  
1 1 1 12  -3  11 o 5  295.59  33.44  2793.57   557.53   2779.65  789.06   2807.44   787.86   276.89  51.54  278.77  51.11  -1.88   72.59  
1 1 1 12  -3  12 o 3  96.88   17.70  285.83    94.82    273.76   134.20   297.87    133.99   93.14   24.70  97.20   24.13  -4.07   34.53  
1 1 1 12  -3  13 o 15 137.19  17.72  566.95    136.28   660.51   195.80   479.06    189.78   145.48  24.30  122.05  27.72  23.43   36.86  
1 1 1 12  -3  14 o 15 209.27  37.12  1482.35   429.62   0.00     0.00     1482.35   429.62   ?       ?      209.27  37.12  0.00    37.12  
1 1 1 12  -3  15 o 7  143.94  18.49  628.87    149.26   688.78   215.00   573.12    207.38   146.87  26.47  132.88  28.07  13.99   38.58  
1 1 1 12  -3  16 o 16 92.83   18.75  267.33    96.48    258.50   140.43   275.22    132.77   89.60   25.87  92.53   24.58  -2.92   35.68  
1 1 1 12  -3  17 o 19 115.16  26.38  433.46    170.62   0.00     0.00     433.46    170.62   ?       ?      115.16  26.38  0.00    26.38  
1 1 1 12  -3  18 o 15 146.89  28.79  719.28    234.08   0.00     0.00     719.28    234.08   ?       ?      146.89  28.79  0.00    28.79  
1 1 1 12  -3  19 o 16 129.18  17.63  513.49    127.30   643.00   177.72   377.01    182.44   142.00  22.55  104.84  29.22  37.16   36.92  
1 1 1 12  -3  20 o 4  30.97   15.58  -363.43   125.22   -363.43  125.22   0.00      0.00     30.97   15.58  ?       ?      0.00    15.58  
1 1 1 12  -2  0  o 11 129.65  16.89  498.83    122.74   554.12   166.57   433.15    181.54   135.27  22.22  117.91  27.35  17.35   35.24  
1 1 1 12  -2  1  o 4  377.70  42.63  4591.95   908.09   4578.36  1284.00  4605.54   1284.46  352.79  65.82  354.11  65.60  -1.33   92.93  
1 1 1 12  -2  2  o 1  258.50  27.86  2029.64   406.94   2097.36  575.39   1961.87   575.62   255.41  40.60  245.77  42.33  9.64    58.65  
1 1 1 12  -2  3  o 6  133.77  24.22  546.98    179.17   0.00     0.00     546.98    179.17   ?       ?      133.77  24.22  0.00    24.22  
1 1 1 12  -2  4  o 12 220.84  36.19  1544.70   442.95   0.00     0.00     1544.70   442.95   ?       ?      220.84  36.19  0.00    36.19  
1 1 1 12  -2  5  o 12 351.15  39.28  3923.93   778.28   4124.67  1100.60  3723.14   1100.72  341.64  58.20  320.11  62.14  21.53   85.14  
1 1 1 12  -2  6  o 13 286.64  31.29  2534.05   506.52   2788.01  716.69   2280.61   715.96   291.38  44.23  258.63  50.03  32.75   66.78  
1 1 1 12  -2  7  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 12  -2  8  o 12 76.95   22.81  179.32    107.94   179.32   107.94   0.00      0.00     76.95   22.81  ?       ?      0.00    22.81  
1 1 1 12  -2  9  o 4  58.28   22.36  71.55     104.95   71.55    104.95   0.00      0.00     58.28   22.36  ?       ?      0.00    22.36  
1 1 1 12  -2  10 o 18 147.18  17.92  646.50    148.27   695.94   211.78   598.95    207.66   150.05  25.50  138.34  27.12  11.70   37.22  
1 1 1 12  -2  11 f 0  70.78   18.74  153.49    77.32    171.32   110.29   136.26    108.42   75.28   23.22  68.97   23.18  6.31    32.81  
1 1 1 12  -2  12 o 12 211.65  23.60  1367.89   281.85   1399.62  397.98   1335.96   399.20   207.37  34.65  201.74  35.78  5.62    49.81  
1 1 1 12  -2  13 f 0  203.28  22.95  1264.27   263.12   1417.38  372.39   1111.61   371.84   209.70  31.94  182.04  36.85  27.66   48.76  
1 1 1 12  -2  14 f 0  141.10  26.93  633.99    210.17   0.00     0.00     633.99    210.17   ?       ?      141.10  26.93  0.00    26.93  
1 1 1 12  -2  15 o 7  173.18  20.42  914.57    199.13   1046.93  283.36   785.42    279.89   180.97  28.19  153.58  32.75  27.39   43.21  
1 1 1 12  -2  16 o 3  240.58  27.67  1843.68   375.17   1847.05  531.47   1840.34   529.67   226.85  42.37  226.52  42.29  0.34    59.86  
1 1 1 12  -2  17 o 13 279.23  33.25  2608.05   522.52   2754.22  739.43   2462.26   738.49   264.57  50.53  244.70  54.02  19.87   73.97  
1 1 1 12  -2  18 o 16 99.44   26.82  326.80    156.57   0.00     0.00     326.80    156.57   ?       ?      99.44   26.82  0.00    26.82  
1 1 1 12  -2  19 o 2  61.70   23.92  90.25     120.90   0.00     0.00     90.25     120.90   ?       ?      61.70   23.92  0.00    23.92  
1 1 1 12  -2  20 o 14 196.57  23.02  1232.75   254.90   1605.66  362.52   868.11    358.48   217.75  29.78  148.62  40.79  69.13   50.50  
1 1 1 12  -1  0  o 19 89.11   16.36  238.51    80.62    261.65   112.65   214.22    115.42   92.42   21.62  83.76   23.21  8.66    31.72  
1 1 1 12  -1  1  o 8  123.72  15.91  452.89    110.42   472.62   155.83   432.99    156.49   124.69  22.60  118.92  23.75  5.77    32.79  
1 1 1 12  -1  2  o 5  367.87  41.09  4305.92   853.01   4356.27  1205.96  4255.50   1206.72  349.40  62.42  344.19  63.41  5.21    88.97  
1 1 1 12  -1  3  o 16 270.41  45.12  2392.25   675.69   0.00     0.00     2392.25   675.69   ?       ?      270.41  45.12  0.00    45.12  
1 1 1 12  -1  4  o 13 264.85  44.14  2288.98   647.48   0.00     0.00     2288.98   647.48   ?       ?      264.85  44.14  0.00    44.14  
1 1 1 12  -1  5  o 17 107.35  15.83  342.71    94.60    294.87   131.09   394.68    136.64   97.79   23.62  113.86  21.70  -16.07  32.07  
1 1 1 12  -1  6  o 8  417.14  94.28  7897.82   2204.31  7897.82  2204.31  0.00      0.00     417.14  94.28  ?       ?      0.00    94.28  
1 1 1 12  -1  7  o 3  351.00  66.50  4610.08   1290.92  0.00     0.00     4610.08   1290.92  ?       ?      351.00  66.50  0.00    66.50  
1 1 1 12  -1  8  o 18 182.92  30.43  1043.07   308.30   1043.07  308.30   0.00      0.00     182.92  30.43  ?       ?      0.00    30.43  
1 1 1 12  -1  9  o 19 230.28  38.47  1715.01   490.59   1715.01  490.59   0.00      0.00     230.28  38.47  ?       ?      0.00    38.47  
1 1 1 12  -1  10 o 16 270.53  47.21  2498.47   706.57   2498.47  706.57   0.00      0.00     270.53  47.21  ?       ?      0.00    47.21  
1 1 1 12  -1  11 o 14 332.95  38.05  3594.58   714.26   3615.07  1010.37  3574.11   1009.86  311.24  58.70  308.95  59.09  2.29    83.29  
1 1 1 12  -1  12 o 17 140.56  17.71  591.65    139.72   656.19   198.42   528.15    196.79   145.53  24.63  129.18  27.39  16.36   36.83  
1 1 1 12  -1  13 o 15 130.10  17.47  508.73    127.22   583.43   181.32   436.30    178.54   137.03  23.92  116.95  27.12  20.08   36.16  
1 1 1 12  -1  14 o 5  295.62  34.18  2851.56   569.33   3085.38  805.89   2618.58   804.43   288.86  50.43  259.03  55.75  29.83   75.18  
1 1 1 12  -1  15 o 11 126.88  17.90  487.75    126.75   486.26   181.09   489.17    177.46   123.21  26.40  123.85  25.80  -0.64   36.91  
1 1 1 12  -1  16 o 4  48.07   19.35  36.42     81.96    -11.27   118.91   79.57     113.13   50.07   21.87  59.93   23.16  -9.86   31.86  
1 1 1 12  -1  17 o 7  114.82  18.37  404.54    117.01   383.14   166.60   425.37    164.38   108.22  26.93  114.69  25.61  -6.47   37.16  
1 1 1 12  -1  18 o 9  211.11  40.29  1617.07   470.44   0.00     0.00     1617.07   470.44   ?       ?      211.11  40.29  0.00    40.29  
1 1 1 12  -1  19 o 16 153.47  30.30  798.45    257.48   0.00     0.00     798.45    257.48   ?       ?      153.47  30.30  0.00    30.30  
1 1 1 12  -1  20 o 6  148.40  30.76  762.42    253.45   762.42   253.45   0.00      0.00     148.40  30.76  ?       ?      0.00    30.76  
1 1 1 12  -1  21 o 19 130.05  28.67  581.33    208.24   0.00     0.00     581.33    208.24   ?       ?      130.05  28.67  0.00    28.67  
1 1 1 12  0   0  o 14 185.57  20.31  1023.15   212.84   917.15   298.18   1133.28   303.92   171.63  31.42  192.50  28.35  -20.88  42.32  
1 1 1 12  0   1  o 8  297.65  32.18  2719.00   541.18   2701.59  764.63   2736.48   766.06   285.82  48.32  287.90  48.04  -2.08   68.14  
1 1 1 12  0   2  o 19 175.25  19.53  911.09    193.16   918.65   270.65   903.24    275.75   173.08  28.21  171.26  29.09  1.82    40.52  
1 1 1 12  0   3  o 4  307.76  52.90  3204.68   900.86   0.00     0.00     3204.68   900.86   ?       ?      307.76  52.90  0.00    52.90  
1 1 1 12  0   4  o 1  123.06  23.35  462.18    158.93   0.00     0.00     462.18    158.93   ?       ?      123.06  23.35  0.00    23.35  
1 1 1 12  0   5  o 11 508.38  64.91  9349.34   1851.15  9818.22  2617.96  8880.49   2617.88  455.67  102.56 420.18  107.96 35.49   148.91 
1 1 1 12  0   6  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 12  0   7  o 8  188.88  20.80  1064.09   221.76   1050.55  312.38   1077.85   314.86   183.76  30.69  186.27  30.50  -2.51   43.27  
1 1 1 12  0   8  o 9  323.67  58.78  3749.52   1052.01  3749.52  1052.01  0.00      0.00     323.67  58.78  ?       ?      0.00    58.78  
1 1 1 12  0   9  o 15 230.77  38.41  1718.44   490.93   1718.44  490.93   0.00      0.00     230.77  38.41  ?       ?      0.00    38.41  
1 1 1 12  0   10 o 3  162.52  28.32  822.83    254.59   822.83   254.59   0.00      0.00     162.52  28.32  ?       ?      0.00    28.32  
1 1 1 12  0   11 o 1  118.67  16.79  421.05    111.17   403.86   156.81   438.42    157.64   113.82  24.71  118.95  23.92  -5.13   34.39  
1 1 1 12  0   12 o 13 97.01   17.46  285.23    93.68    313.65   132.93   257.19    132.05   100.21  23.51  90.69   24.70  9.53    34.10  
1 1 1 12  0   13 o 4  156.60  18.80  737.46    165.63   674.68   234.10   800.38    234.36   145.32  29.08  159.90  26.45  -14.58  39.31  
1 1 1 12  0   14 o 13 176.81  20.71  949.69    206.25   1100.88  294.24   803.62    289.20   186.32  28.41  155.94  33.32  30.38   43.78  
1 1 1 12  0   15 o 14 187.52  21.68  1076.37   229.13   1046.70  324.92   1105.71   323.15   178.03  33.01  183.96  31.75  -5.93   45.80  
1 1 1 12  0   16 o 1  127.67  26.54  524.45    188.20   0.00     0.00     524.45    188.20   ?       ?      127.67  26.54  0.00    26.54  
1 1 1 12  0   17 f 0  285.10  34.05  2725.55   546.35   2837.66  773.08   2613.68   772.23   267.06  52.30  252.13  54.91  14.93   75.83  
1 1 1 12  0   18 o 17 219.94  42.48  1788.14   516.98   0.00     0.00     1788.14   516.98   ?       ?      219.94  42.48  0.00    42.48  
1 1 1 12  0   19 o 10 123.28  28.14  509.42    194.73   0.00     0.00     509.42    194.73   ?       ?      123.28  28.14  0.00    28.14  
1 1 1 12  0   20 o 5  207.97  25.04  1401.33   292.95   1739.29  417.16   1072.50   411.48   222.37  33.74  163.29  43.23  59.08   54.83  
1 1 1 12  0   21 o 7  95.68   21.19  296.23    113.34   339.55   164.77   257.33    156.16   99.30   27.81  87.19   27.73  12.11   39.27  
1 1 1 12  1   0  o 19 91.01   16.71  248.86    84.09    269.69   119.54   228.46    118.32   93.75   22.50  86.39   23.32  7.36    32.40  
1 1 1 12  1   1  o 18 386.82  43.36  4796.75   946.34   4685.44  1337.88  4908.22   1338.76  357.51  67.67  368.32  65.73  -10.82  94.33  
1 1 1 12  1   2  o 14 129.16  24.54  510.16    175.34   0.00     0.00     510.16    175.34   ?       ?      129.16  24.54  0.00    24.54  
1 1 1 12  1   3  o 16 88.49   22.93  240.12    117.40   0.00     0.00     240.12    117.40   ?       ?      88.49   22.93  0.00    22.93  
1 1 1 12  1   4  o 4  297.68  50.83  2975.06   837.49   0.00     0.00     2975.06   837.49   ?       ?      297.68  50.83  0.00    50.83  
1 1 1 12  1   5  o 9  265.48  44.20  2300.05   649.95   2300.05  649.95   0.00      0.00     265.48  44.20  ?       ?      0.00    44.20  
1 1 1 12  1   6  o 11 105.34  25.08  343.57    149.50   0.00     0.00     343.57    149.50   ?       ?      105.34  25.08  0.00    25.08  
1 1 1 12  1   7  o 7  227.35  24.64  1557.39   316.50   1552.74  445.34   1562.15   449.89   221.19  36.33  221.71  36.63  -0.52   51.59  
1 1 1 12  1   8  o 3  229.87  37.96  1693.65   483.40   1693.65  483.40   0.00      0.00     229.87  37.96  ?       ?      0.00    37.96  
1 1 1 12  1   9  o 4  128.61  24.79  510.07    176.37   510.07   176.37   0.00      0.00     128.61  24.79  ?       ?      0.00    24.79  
1 1 1 12  1   10 o 3  88.74   17.40  238.69    85.45    288.39   118.66   185.16    123.15   96.70   21.89  78.58   24.58  18.12   32.91  
1 1 1 12  1   11 o 17 193.66  21.65  1129.56   236.52   1072.88  332.14   1187.87   336.90   183.39  32.75  193.96  31.32  -10.57  45.32  
1 1 1 12  1   12 o 1  204.30  22.89  1266.97   263.82   1351.54  372.56   1181.90   373.65   205.66  32.65  190.35  35.50  15.31   48.23  
1 1 1 12  1   13 o 10 223.09  24.96  1530.44   314.17   1609.81  443.93   1450.81   444.68   221.27  36.20  208.04  38.66  13.23   52.96  
1 1 1 12  1   14 o 5  150.11  18.69  680.14    157.55   721.94   222.43   638.06    223.18   151.17  26.60  140.98  28.56  10.20   39.03  
1 1 1 12  1   15 o 17 217.98  24.72  1475.92   303.83   1383.09  429.12   1569.23   430.24   200.61  38.66  216.37  35.90  -15.75  52.76  
1 1 1 12  1   16 o 14 211.49  24.29  1393.59   289.54   1553.24  409.42   1233.84   409.53   215.64  34.22  187.59  39.29  28.05   52.10  
1 1 1 12  1   17 o 5  145.58  18.79  646.86    153.36   863.80   214.90   421.70    218.93   166.18  23.15  111.50  32.33  54.68   39.77  
1 1 1 12  1   18 o 14 147.15  29.32  719.32    238.99   0.00     0.00     719.32    238.99   ?       ?      147.15  29.32  0.00    29.32  
1 1 1 12  1   19 o 8  204.18  39.91  1537.94   450.99   0.00     0.00     1537.94   450.99   ?       ?      204.18  39.91  0.00    39.91  
1 1 1 12  1   20 o 4  195.99  39.45  1447.79   428.52   0.00     0.00     1447.79   428.52   ?       ?      195.99  39.45  0.00    39.45  
1 1 1 12  1   21 o 9  194.01  24.40  1226.23   265.72   1446.58  379.56   1014.45   372.11   200.27  34.24  159.84  40.51  40.43   53.04  
1 1 1 12  2   0  o 11 169.30  18.88  849.75    180.42   838.45   254.76   861.13    255.54   165.20  27.85  167.60  27.51  -2.39   39.15  
1 1 1 12  2   1  o 14 224.82  36.64  1595.01   456.66   0.00     0.00     1595.01   456.66   ?       ?      224.82  36.64  0.00    36.64  
1 1 1 12  2   2  o 15 333.98  59.34  3911.70   1095.99  0.00     0.00     3911.70   1095.99  ?       ?      333.98  59.34  0.00    59.34  
1 1 1 12  2   3  o 3  169.68  28.40  885.61    266.91   0.00     0.00     885.61    266.91   ?       ?      169.68  28.40  0.00    28.40  
1 1 1 12  2   4  o 18 158.80  18.02  746.76    161.34   731.00   227.01   762.85    229.34   154.43  26.56  157.95  26.21  -3.53   37.32  
1 1 1 12  2   5  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 12  2   6  o 19 426.70  50.23  6101.35   1206.97  6181.42  1706.11  6021.12   1707.72  392.38  78.49  385.02  79.88  7.36    111.99 
1 1 1 12  2   7  o 8  234.78  38.72  1768.61   503.73   1768.61  503.73   0.00      0.00     234.78  38.72  ?       ?      0.00    38.72  
1 1 1 12  2   8  o 13 141.90  25.49  619.39    200.02   619.39   200.02   0.00      0.00     141.90  25.49  ?       ?      0.00    25.49  
1 1 1 12  2   9  o 17 176.43  29.83  971.30    291.33   971.30   291.33   0.00      0.00     176.43  29.83  ?       ?      0.00    29.83  
1 1 1 12  2   10 o 15 96.61   17.47  282.00    93.33    300.84   125.26   258.49    139.94   98.61   22.61  91.25   25.65  7.36    34.20  
1 1 1 12  2   11 o 8  176.65  20.23  936.80    201.43   881.23   281.13   995.43    288.75   166.83  30.48  178.17  29.25  -11.34  42.24  
1 1 1 12  2   12 o 17 86.18   18.19  227.26    87.16    278.98   120.62   170.75    126.09   94.64   22.53  76.01   24.98  18.63   33.64  
1 1 1 12  2   13 o 7  88.25   18.37  238.99    90.05    200.50   125.96   279.23    128.79   80.73   24.80  94.23   23.80  -13.51  34.37  
1 1 1 12  2   14 o 14 191.61  21.90  1121.19   236.52   1066.05  333.30   1177.13   335.70   179.95  33.50  190.43  31.83  -10.48  46.21  
1 1 1 12  2   15 o 5  264.26  30.43  2244.96   453.22   2320.89  640.21   2168.67   641.71   252.99  45.77  241.96  47.89  11.03   66.24  
1 1 1 12  2   16 o 10 79.26   19.83  196.53    89.98    278.67   123.09   102.26    131.86   93.61   23.06  65.57   25.09  28.04   34.08  
1 1 1 12  2   17 o 7  21.45   10.81  -191.36   61.35    -359.13  70.35    341.38    125.36   ?       ?      103.98  21.70  0.00    21.70  
1 1 1 12  2   18 o 4  125.38  27.60  519.52    193.30   0.00     0.00     519.52    193.30   ?       ?      125.38  27.60  0.00    27.60  
1 1 1 12  2   19 o 14 64.50   24.94  101.20    131.28   0.00     0.00     101.20    131.28   ?       ?      64.50   24.94  0.00    24.94  
1 1 1 12  2   20 o 6  157.52  32.23  873.15    281.66   0.00     0.00     873.15    281.66   ?       ?      157.52  32.23  0.00    32.23  
1 1 1 12  2   21 o 14 150.88  21.46  727.51    180.68   683.36   256.97   770.67    254.08   136.95  33.06  147.73  30.95  -10.79  45.29  
1 1 1 12  3   0  o 11 312.70  54.54  3360.70   943.40   0.00     0.00     3360.70   943.40   ?       ?      312.70  54.54  0.00    54.54  
1 1 1 12  3   1  o 11 300.83  51.73  3062.98   861.09   0.00     0.00     3062.98   861.09   ?       ?      300.83  51.73  0.00    51.73  
1 1 1 12  3   2  o 9  234.28  38.44  1748.44   499.10   0.00     0.00     1748.44   499.10   ?       ?      234.28  38.44  0.00    38.44  
1 1 1 12  3   3  o 15 238.82  39.33  1824.60   520.43   0.00     0.00     1824.60   520.43   ?       ?      238.82  39.33  0.00    39.33  
1 1 1 12  3   4  o 5  148.32  26.08  674.79    213.91   674.79   213.91   0.00      0.00     148.32  26.08  ?       ?      0.00    26.08  
1 1 1 12  3   5  x 8  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 12  3   6  o 1  401.30  86.40  6915.43   1931.54  6915.43  1931.54  0.00      0.00     401.30  86.40  ?       ?      0.00    86.40  
1 1 1 12  3   7  f 0  100.53  23.96  312.75    136.29   312.75   136.29   0.00      0.00     100.53  23.96  ?       ?      0.00    23.96  
1 1 1 12  3   8  o 16 285.05  49.52  2774.76   780.95   2774.76  780.95   0.00      0.00     285.05  49.52  ?       ?      0.00    49.52  
1 1 1 12  3   9  o 19 204.36  34.16  1328.41   386.62   1328.41  386.62   0.00      0.00     204.36  34.16  ?       ?      0.00    34.16  
1 1 1 12  3   10 o 14 202.86  22.59  1242.45   258.65   1207.32  364.01   1278.27   367.59   194.29  33.87  200.47  33.09  -6.19   47.35  
1 1 1 12  3   11 o 16 242.24  26.93  1807.17   368.16   1933.43  518.82   1679.09   522.52   242.58  38.54  222.89  42.38  19.69   57.29  
1 1 1 12  3   12 o 18 134.77  17.93  545.60    135.29   548.59   186.47   542.29    196.60   132.36  25.47  130.94  27.05  1.42    37.15  
1 1 1 12  3   13 f 0  260.87  29.54  2149.10   434.56   2141.07  611.83   2157.27   617.34   246.79  44.84  247.45  45.12  -0.67   63.61  
1 1 1 12  3   14 o 9  216.10  24.75  1448.12   301.53   1558.07  421.37   1332.74   431.66   216.66  35.08  196.46  39.64  20.20   52.93  
1 1 1 12  3   15 f 0  326.80  40.25  3698.12   739.17   3919.38  1044.31  3475.99   1046.38  303.97  61.95  277.59  66.53  26.38   90.91  
1 1 1 12  3   16 o 12 146.60  18.72  654.51    153.95   697.27   213.68   608.36    221.99   147.61  26.18  135.94  29.31  11.66   39.30  
1 1 1 12  3   17 o 15 20.37   9.42   -21.17    25.98    -25.17   26.58    64.32     122.93   20.05   9.36   59.09   23.73  -39.04  25.51  
1 1 1 12  3   18 o 3  53.86   23.10  13.03     127.96   0.00     0.00     13.03     127.96   ?       ?      53.86   23.10  0.00    23.10  
1 1 1 12  3   19 o 9  136.94  29.55  638.39    225.47   0.00     0.00     638.39    225.47   ?       ?      136.94  29.55  0.00    29.55  
1 1 1 12  3   20 f 0  114.87  28.87  457.15    190.08   0.00     0.00     457.15    190.08   ?       ?      114.87  28.87  0.00    28.87  
1 1 1 12  3   21 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 12  4   0  f 0  142.27  25.12  619.93    197.69   0.00     0.00     619.93    197.69   ?       ?      142.27  25.12  0.00    25.12  
1 1 1 12  4   1  o 12 189.04  20.61  1064.57   220.06   1014.57  310.38   1115.12   312.05   180.46  31.08  190.05  29.56  -9.59   42.89  
1 1 1 12  4   2  f 0  119.21  15.57  420.78    104.00   366.39   142.45   482.88    152.20   109.15  23.43  126.18  21.80  -17.02  32.01  
1 1 1 12  4   3  o 17 93.51   15.58  261.38    80.70    220.36   110.85   307.65    117.71   84.75   22.44  100.34  21.10  -15.59  30.80  
1 1 1 12  4   4  x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 12  4   5  x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 12  4   6  o 19 82.25   23.66  206.59    117.72   206.59   117.72   0.00      0.00     82.25   23.66  ?       ?      0.00    23.66  
1 1 1 12  4   7  o 15 89.02   23.90  244.83    124.71   244.83   124.71   0.00      0.00     89.02   23.90  ?       ?      0.00    23.90  
1 1 1 12  4   8  f 0  266.93  46.16  2406.63   681.83   2406.63  681.83   0.00      0.00     266.93  46.16  ?       ?      0.00    46.16  
1 1 1 12  4   9  o 16 236.53  26.24  1710.51   350.32   1811.55  495.72   1609.70   495.13   236.20  37.84  220.51  40.61  15.69   55.50  
1 1 1 12  4   10 o 1  82.75   19.09  210.30    88.85    241.88   129.46   182.19    122.16   88.18   24.63  77.81   24.50  10.38   34.74  
1 1 1 12  4   11 o 12 96.95   17.82  285.69    95.52    269.19   133.80   302.83    136.40   92.62   24.71  98.21   24.32  -5.59   34.67  
1 1 1 12  4   12 o 10 149.03  18.51  668.30    154.92   709.31   218.26   626.66    219.93   150.33  26.25  140.16  28.31  10.16   38.60  
1 1 1 12  4   13 o 2  221.11  25.11  1515.39   313.15   1547.61  441.07   1482.64   444.68   214.70  37.13  208.95  38.49  5.75    53.48  
1 1 1 12  4   14 o 12 89.32   19.28  247.46    95.95    253.39   126.80   239.52    146.78   89.34   24.15  87.08   26.77  2.26    36.05  
1 1 1 12  4   15 o 16 274.28  32.30  2468.20   498.91   2654.44  703.46   2279.70   707.69   266.45  47.74  240.01  52.80  26.44   71.18  
1 1 1 12  4   16 o 16 135.31  20.06  564.83    151.12   -33.82   195.66   1450.03   237.92   61.53   27.41  218.51  19.16  -156.98 33.44  
1 1 1 12  4   17 o 15 220.97  25.78  1557.74   320.89   1531.77  446.75   1585.42   461.20   206.60  39.10  209.51  39.80  -2.91   55.79  
1 1 1 12  4   18 o 10 182.76  36.14  1188.95   365.72   0.00     0.00     1188.95   365.72   ?       ?      182.76  36.14  0.00    36.14  
1 1 1 12  4   19 o 16 54.47   23.47  13.90     133.25   0.00     0.00     13.90     133.25   ?       ?      54.47   23.47  0.00    23.47  
1 1 1 12  4   20 f 0  187.07  23.81  1136.12   249.93   1364.49  353.96   909.06    352.94   196.07  32.59  151.14  40.04  44.93   51.63  
1 1 1 12  4   21 o 11 138.92  31.78  699.28    247.96   0.00     0.00     699.28    247.96   ?       ?      138.92  31.78  0.00    31.78  
1 1 1 12  5   0  o 12 297.84  32.61  2756.61   548.44   2749.47  774.63   2763.78   776.60   284.53  49.20  285.29  49.19  -0.76   69.58  
1 1 1 12  5   1  o 13 72.25   18.63  159.06    77.78    235.24   110.58   84.48     109.41   87.43   22.04  61.04   22.97  26.39   31.84  
1 1 1 12  5   2  o 10 100.57  16.12  302.42    89.91    302.17   127.80   302.65    126.52   98.97   22.94  99.09   22.73  -0.12   32.29  
1 1 1 12  5   3  o 11 211.33  34.86  1415.30   408.14   1415.30  408.14   0.00      0.00     211.33  34.86  ?       ?      0.00    34.86  
1 1 1 12  5   4  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 12  5   5  o 13 247.46  41.39  2005.68   567.27   2005.68  567.27   0.00      0.00     247.46  41.39  ?       ?      0.00    41.39  
1 1 1 12  5   6  o 1  64.55   21.80  116.79    95.89    116.79   95.89    0.00      0.00     64.55   21.80  ?       ?      0.00    21.80  
1 1 1 12  5   7  o 12 232.82  25.73  1651.70   338.14   1770.20  477.01   1532.02   479.39   234.57  36.62  215.60  40.21  18.97   54.39  
1 1 1 12  5   8  o 11 105.34  16.70  333.12    97.64    352.12   134.62   312.02    141.84   106.70  22.68  99.89   24.84  6.81    33.63  
1 1 1 12  5   9  f 0  113.29  17.30  385.80    108.95   381.28   153.70   390.35    154.45   110.35  24.86  111.72  24.74  -1.36   35.07  
1 1 1 12  5   10 o 15 194.67  22.13  1149.61   242.96   1174.90  343.70   1124.36   343.50   191.26  32.46  186.52  33.30  4.75    46.51  
1 1 1 12  5   11 o 6  220.18  24.96  1493.27   309.94   1551.34  437.70   1434.88   438.93   216.63  36.49  206.76  38.39  9.87    52.97  
1 1 1 12  5   12 o 14 357.48  44.94  4496.47   901.94   4861.84  1275.40  4130.94   1275.69  334.02  68.80  294.74  75.17  39.28   101.90 
1 1 1 12  5   13 f 0  189.13  22.32  1098.69   237.62   1251.21  335.48   945.12    336.62   196.60  30.73  166.76  36.20  29.85   47.49  
1 1 1 12  5   14 o 10 55.58   20.27  79.06     84.00    148.63   117.27   5.77      120.37   71.05   24.11  52.15   22.39  18.90   32.90  
1 1 1 12  5   15 o 5  210.94  24.73  1397.27   293.80   1572.77  414.31   1219.76   416.68   215.67  34.64  184.32  40.49  31.36   53.28  
1 1 1 12  5   16 o 3  59.40   18.76  106.18    71.55    -5.41    78.94    619.92    169.38   41.36   17.94  140.87  21.64  -99.51  28.11  
1 1 1 12  5   17 o 14 144.73  30.64  710.04    246.60   0.00     0.00     710.04    246.60   ?       ?      144.73  30.64  0.00    30.64  
1 1 1 12  5   18 o 11 258.10  68.77  3663.45   1037.33  0.00     0.00     3663.45   1037.33  ?       ?      258.10  68.77  0.00    68.77  
1 1 1 12  5   19 o 2  130.86  31.08  604.47    229.95   0.00     0.00     604.47    229.95   ?       ?      130.86  31.08  0.00    31.08  
1 1 1 12  5   20 o 6  162.55  35.83  994.43    325.31   0.00     0.00     994.43    325.31   ?       ?      162.55  35.83  0.00    35.83  
1 1 1 12  6   0  o 14 161.37  18.24  775.32    165.99   718.62   232.32   834.45    237.24   151.87  27.67  164.64  25.96  -12.77  37.94  
1 1 1 12  6   1  o 18 129.44  23.55  514.61    168.57   514.61   168.57   0.00      0.00     129.44  23.55  ?       ?      0.00    23.55  
1 1 1 12  6   2  o 1  137.14  24.73  579.54    187.49   579.54   187.49   0.00      0.00     137.14  24.73  ?       ?      0.00    24.73  
1 1 1 12  6   3  x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 12  6   4  x 15 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 12  6   5  o 11 178.58  20.37  956.30    205.14   1004.49  289.59   907.75    290.64   179.30  29.13  169.37  31.04  9.93    42.57  
1 1 1 12  6   6  o 18 272.08  29.93  2301.74   459.76   2262.13  648.95   2341.65   651.46   257.55  45.56  262.81  44.78  -5.25   63.88  
1 1 1 12  6   7  o 2  150.01  17.82  671.92    150.42   615.41   209.72   731.80    215.88   140.08  27.06  153.80  25.33  -13.72  37.07  
1 1 1 12  6   8  o 3  216.51  24.18  1431.09   295.36   1497.70  414.09   1362.10   421.42   215.14  34.71  203.11  37.52  12.04   51.12  
1 1 1 12  6   9  o 6  155.28  18.59  724.12    162.43   722.72   226.53   725.60    233.04   151.62  27.02  151.55  27.81  0.06    38.77  
1 1 1 12  6   10 f 0  199.18  22.70  1211.74   254.97   1297.28  358.94   1124.63   362.24   200.39  32.30  184.21  35.54  16.19   48.03  
1 1 1 12  6   11 o 13 171.29  20.48  891.59    197.39   977.32   274.73   800.09    283.80   175.34  28.25  155.76  32.78  19.58   43.28  
1 1 1 12  6   12 o 19 103.90  17.90  329.55    102.91   366.61   139.65   285.52    152.23   107.82  23.25  94.36   26.83  13.46   35.50  
1 1 1 12  6   13 o 6  117.16  18.39  419.19    119.63   479.69   166.40   354.48    172.10   122.96  24.44  104.20  28.12  18.76   37.26  
1 1 1 12  6   14 f 0  119.32  18.99  437.42    125.71   517.89   176.71   354.97    178.88   127.25  25.08  103.69  28.95  23.56   38.30  
1 1 1 12  6   15 o 3  26.03   12.80  -136.13   67.02    -209.78  78.51    61.78     128.70   25.62   12.81  59.66   24.17  -34.04  27.35  
1 1 1 12  6   16 o 2  47.31   18.51  44.74     73.01    38.07    87.46    60.07     132.63   49.16   19.92  59.83   24.42  -10.68  31.52  
1 1 1 12  6   17 o 14 215.39  43.94  1800.57   524.87   0.00     0.00     1800.57   524.87   ?       ?      215.39  43.94  0.00    43.94  
1 1 1 12  6   18 o 3  149.61  31.50  783.80    261.99   0.00     0.00     783.80    261.99   ?       ?      149.61  31.50  0.00    31.50  
1 1 1 12  6   19 o 9  178.18  23.53  1031.93   234.79   1206.69  328.73   849.95    335.45   184.08  32.28  146.37  39.16  37.72   50.75  
1 1 1 12  6   20 o 10 199.36  45.99  1732.56   515.64   0.00     0.00     1732.56   515.64   ?       ?      199.36  45.99  0.00    45.99  
1 1 1 12  7   0  o 13 93.88   21.37  272.68    112.59   272.68   112.59   0.00      0.00     93.88   21.37  ?       ?      0.00    21.37  
1 1 1 12  7   1  o 19 285.51  51.84  2913.53   818.43   2913.53  818.43   0.00      0.00     285.51  51.84  ?       ?      0.00    51.84  
1 1 1 12  7   2  o 7  185.07  31.01  1085.41   317.78   1085.41  317.78   0.00      0.00     185.07  31.01  ?       ?      0.00    31.01  
1 1 1 12  7   3  x 5  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 12  7   4  o 12 89.89   17.17  245.33    85.39    196.99   113.43   308.55    129.72   80.01   23.29  99.50   23.15  -19.49  32.84  
1 1 1 12  7   5  o 12 180.80  20.99  986.85    213.77   1153.83  300.36   815.46    304.30   192.22  28.05  157.79  34.55  34.43   44.50  
1 1 1 12  7   6  o 5  363.74  43.32  4490.78   886.83   4398.01  1253.30  4583.81   1255.05  323.56  69.55  333.19  67.92  -9.64   97.21  
1 1 1 12  7   7  o 6  107.65  17.39  350.23    103.82   425.96   144.55   269.53    149.21   117.32  22.28  92.48   26.65  24.84   34.74  
1 1 1 12  7   8  o 5  106.52  17.98  344.65    106.04   332.57   146.31   358.02    153.90   102.48  25.08  106.23  25.55  -3.74   35.80  
1 1 1 12  7   9  o 11 284.40  32.84  2612.00   526.30   2700.33  743.16   2523.13   745.46   271.55  49.50  259.54  51.85  12.01   71.68  
1 1 1 12  7   10 o 11 140.71  18.37  598.74    144.87   635.58   203.05   560.54    206.75   141.74  25.91  131.87  28.17  9.88    38.27  
1 1 1 12  7   11 o 7  175.37  20.56  937.98    203.09   949.80   284.03   925.60    290.52   171.15  30.00  168.11  31.25  3.04    43.32  
1 1 1 12  7   12 o 2  150.22  18.79  685.72    158.47   671.02   219.90   701.60    228.57   144.24  27.56  147.29  28.06  -3.05   39.33  
1 1 1 12  7   13 o 18 55.05   19.69  80.76     78.82    51.20    100.33   128.42    127.38   53.72   21.49  68.58   24.97  -14.86  32.94  
1 1 1 12  7   14 o 14 132.26  18.71  536.53    138.06   613.33   185.86   441.96    206.23   138.79  24.21  114.26  30.76  24.52   39.14  
1 1 1 12  7   15 o 8  124.72  28.47  519.51    199.29   0.00     0.00     519.51    199.29   ?       ?      124.72  28.47  0.00    28.47  
1 1 1 12  7   16 o 6  104.03  28.12  365.82    171.87   0.00     0.00     365.82    171.87   ?       ?      104.03  28.12  0.00    28.12  
1 1 1 12  7   17 o 9  114.97  29.22  456.95    193.19   0.00     0.00     456.95    193.19   ?       ?      114.97  29.22  0.00    29.22  
1 1 1 12  7   18 f 0  106.57  21.63  368.43    127.78   476.58   180.83   260.59    180.57   117.93  27.26  87.35   29.91  30.58   40.47  
1 1 1 12  7   19 f 0  48.80   20.84  17.15     103.33   32.02    144.49   1.57      147.85   57.31   24.57  55.02   24.20  2.29    34.48  
1 1 1 12  8   0  o 19 295.95  33.80  2813.33   563.93   2908.59  796.23   2717.45   798.81   283.49  50.79  271.06  53.24  12.43   73.58  
1 1 1 12  8   1  o 9  214.93  23.62  1410.81   286.62   1341.77  401.74   1482.40   409.04   201.98  35.97  213.51  34.55  -11.53  49.87  
1 1 1 12  8   2  o 5  152.53  26.47  729.23    223.37   729.23   223.37   0.00      0.00     152.53  26.47  ?       ?      0.00    26.47  
1 1 1 12  8   3  o 13 112.56  25.07  399.34    157.86   0.00     0.00     399.34    157.86   ?       ?      112.56  25.07  0.00    25.07  
1 1 1 12  8   4  o 9  62.41   19.32  116.20    76.30    151.95   100.85   68.34     116.68   71.04   22.25  59.38   23.36  11.66   32.26  
1 1 1 12  8   5  o 10 103.41  16.83  323.14    96.48    310.05   132.08   338.12    141.29   99.31   23.53  103.58  24.20  -4.26   33.75  
1 1 1 12  8   6  o 7  199.64  22.40  1216.59   252.25   1194.37  354.62   1239.35   358.89   191.12  33.54  194.95  33.26  -3.83   47.24  
1 1 1 12  8   7  o 18 232.38  26.41  1683.28   346.10   1782.85  486.05   1580.87   492.94   230.03  38.14  213.27  41.76  16.75   56.56  
1 1 1 12  8   8  o 19 150.57  19.16  687.03    161.85   801.76   226.60   567.54    231.25   159.79  25.57  131.31  31.15  28.48   40.30  
1 1 1 12  8   9  o 17 290.33  61.68  3533.65   996.25   0.00     0.00     3533.65   996.25   ?       ?      290.33  61.68  0.00    61.68  
1 1 1 12  8   10 o 7  52.90   19.82  66.36     81.22    54.11    110.07   81.01     120.35   55.99   22.47  61.25   23.83  -5.26   32.75  
1 1 1 12  8   11 o 5  73.70   21.01  169.59    93.19    222.62   126.63   106.96    137.62   83.74   24.67  66.85   25.62  16.89   35.57  
1 1 1 12  8   12 o 9  210.43  25.17  1397.98   298.05   1569.49  420.40   1224.66   422.61   214.28  35.41  183.58  41.12  30.70   54.27  
1 1 1 12  8   13 o 11 119.45  18.72  439.64    124.16   434.10   172.27   445.63    179.11   115.04  26.61  116.25  27.31  -1.21   38.13  
1 1 1 12  8   14 f 0  101.08  27.59  340.97    164.58   0.00     0.00     340.97    164.58   ?       ?      101.08  27.59  0.00    27.59  
1 1 1 12  8   15 o 12 168.16  33.70  993.10    313.99   0.00     0.00     993.10    313.99   ?       ?      168.16  33.70  0.00    33.70  
1 1 1 12  8   16 o 1  86.24   27.86  248.72    157.15   0.00     0.00     248.72    157.15   ?       ?      86.24   27.86  0.00    27.86  
1 1 1 12  8   17 o 15 116.32  19.50  428.59    125.60   452.41   167.89   398.32    189.29   115.69  25.92  106.00  29.85  9.69    39.53  
1 1 1 12  8   18 o 6  71.47   22.07  166.00    99.66    114.51   129.88   239.71    155.41   64.95   24.89  83.80   27.75  -18.85  37.27  
1 1 1 12  9   0  f 0  147.74  17.97  656.38    149.25   701.92   206.04   606.10    216.48   149.95  24.80  137.48  28.37  12.47   37.68  
1 1 1 12  9   1  f 0  155.66  18.51  729.67    162.18   727.84   224.09   731.69    235.00   151.83  26.68  151.56  28.04  0.28    38.71  
1 1 1 12  9   2  x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 12  9   3  o 5  283.80  33.08  2607.37   528.88   2848.41  745.84   2363.60   750.07   280.54  48.04  247.83  54.23  32.71   72.45  
1 1 1 12  9   4  o 9  142.56  17.79  611.94    142.41   605.68   195.42   619.03    207.96   138.60  25.50  139.47  26.95  -0.87   37.10  
1 1 1 12  9   5  o 4  103.05  16.96  322.13    96.86    283.64   126.20   377.28    151.08   94.75   23.35  109.02  24.71  -14.27  34.00  
1 1 1 12  9   6  o 5  229.05  25.96  1639.27   335.27   1695.62  471.22   1581.50   477.13   223.20  38.15  213.39  40.43  9.81    55.58  
1 1 1 12  9   7  o 7  274.57  31.88  2448.62   493.15   2489.52  695.20   2407.20   699.67   258.54  48.62  252.37  50.06  6.17    69.79  
1 1 1 12  9   8  o 14 156.14  19.41  742.33    170.24   809.53   237.37   671.16    244.27   159.23  26.93  142.55  30.75  16.68   40.88  
1 1 1 12  9   9  o 14 180.55  21.58  1004.27   219.27   1132.76  305.49   867.72    314.92   186.76  29.47  158.94  35.42  27.82   46.08  
1 1 1 12  9   10 o 18 302.96  37.13  3157.50   632.24   3207.81  891.71   3106.64   896.57   274.53  58.38  267.42  59.89  7.11    83.64  
1 1 1 12  9   11 o 5  98.19   19.49  300.95    105.97   297.61   144.14   304.88    156.35   95.57   25.71  96.36   27.12  -0.79   37.37  
1 1 1 12  9   12 o 2  66.53   25.23  112.92    132.63   0.00     0.00     112.92    132.63   ?       ?      66.53   25.23  0.00    25.23  
1 1 1 12  9   13 o 10 88.81   27.25  260.23    152.16   0.00     0.00     260.23    152.16   ?       ?      88.81   27.25  0.00    27.25  
1 1 1 12  9   14 o 11 116.04  29.09  461.78    193.41   0.00     0.00     461.78    193.41   ?       ?      116.04  29.09  0.00    29.09  
1 1 1 12  9   15 o 10 240.30  30.52  1982.01   411.57   2108.40  578.74   1852.68   585.42   225.97  46.18  204.64  50.22  21.33   68.22  
1 1 1 12  9   16 o 10 152.94  21.12  746.05    180.47   821.88   251.10   665.03    259.56   153.81  29.51  134.17  33.74  19.64   44.82  
1 1 1 12  9   17 o 18 143.21  21.56  661.52    171.76   816.69   239.37   496.83    246.60   153.86  28.14  113.97  34.63  39.89   44.62  
1 1 1 12  10  0  o 8  59.30   19.49  102.39    76.72    153.17   104.89   43.98     112.50   71.15   22.74  55.17   22.51  15.97   31.99  
1 1 1 12  10  1  o 11 156.05  27.57  778.75    237.96   778.75   237.96   0.00      0.00     156.05  27.57  ?       ?      0.00    27.57  
1 1 1 12  10  2  o 17 147.80  28.32  704.27    231.52   0.00     0.00     704.27    231.52   ?       ?      147.80  28.32  0.00    28.32  
1 1 1 12  10  3  o 15 153.09  18.83  710.72    162.02   817.06   223.15   592.17    235.61   161.29  24.90  133.64  31.27  27.66   39.97  
1 1 1 12  10  4  f 0  163.72  19.51  815.21    179.73   853.80   247.58   772.22    261.32   163.44  27.35  153.26  30.77  10.18   41.17  
1 1 1 12  10  5  o 7  246.61  28.24  1939.21   392.60   1944.93  552.24   1933.37   558.26   232.96  42.87  231.45  43.61  1.51    61.16  
1 1 1 12  10  6  o 8  218.47  24.88  1494.94   306.51   1487.93  430.76   1502.12   436.23   207.67  37.51  208.36  37.87  -0.68   53.30  
1 1 1 12  10  7  f 0  305.43  37.63  3212.32   645.86   3354.14  911.13   3069.08   915.66   282.22  58.17  263.67  61.61  18.56   84.73  
1 1 1 12  10  8  o 19 57.04   23.33  49.45     121.24   0.00     0.00     49.45     121.24   ?       ?      57.04   23.33  0.00    23.33  
1 1 1 12  10  9  o 11 147.18  30.10  723.08    245.76   0.00     0.00     723.08    245.76   ?       ?      147.18  30.10  0.00    30.10  
1 1 1 12  10  10 o 2  153.50  30.47  792.55    259.05   0.00     0.00     792.55    259.05   ?       ?      153.50  30.47  0.00    30.47  
1 1 1 12  10  11 o 4  76.61   27.06  178.18    148.33   0.00     0.00     178.18    148.33   ?       ?      76.61   27.06  0.00    27.06  
1 1 1 12  10  12 o 4  161.72  32.75  914.27    293.63   0.00     0.00     914.27    293.63   ?       ?      161.72  32.75  0.00    32.75  
1 1 1 12  10  13 o 2  193.94  23.61  1208.50   257.45   1305.45  354.45   1100.23   374.57   192.25  33.32  169.84  39.21  22.41   51.46  
1 1 1 12  10  14 o 19 105.29  19.26  351.14    112.14   48.50    138.44   928.78    191.26   58.52   24.52  172.20  19.70  -113.67 31.45  
1 1 1 12  10  15 o 10 294.29  43.47  3518.61   712.33   3689.00  1005.68  3347.07   1009.11  243.04  68.92  221.79  70.50  21.25   98.59  
1 1 1 12  11  0  o 12 173.39  21.18  927.33    206.47   912.08   284.18   944.39    300.48   165.76  31.00  167.74  32.38  -1.98   44.83  
1 1 1 12  11  1  x 2  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 12  11  2  f 0  126.93  18.18  492.02    128.69   539.23   179.45   442.04    184.64   129.80  24.99  115.82  28.07  13.98   37.58  
1 1 1 12  11  3  o 19 178.00  33.10  1069.47   325.82   0.00     0.00     1069.47   325.82   ?       ?      178.00  33.10  0.00    33.10  
1 1 1 12  11  4  o 3  110.25  26.95  398.76    169.11   0.00     0.00     398.76    169.11   ?       ?      110.25  26.95  0.00    26.95  
1 1 1 12  11  5  o 6  163.19  31.45  894.14    283.93   0.00     0.00     894.14    283.93   ?       ?      163.19  31.45  0.00    31.45  
1 1 1 12  11  6  o 19 262.98  58.95  3064.85   867.94   0.00     0.00     3064.85   867.94   ?       ?      262.98  58.95  0.00    58.95  
1 1 1 12  11  7  o 9  180.62  34.31  1130.15   342.78   0.00     0.00     1130.15   342.78   ?       ?      180.62  34.31  0.00    34.31  
1 1 1 12  11  8  o 14 185.52  35.99  1219.08   369.47   0.00     0.00     1219.08   369.47   ?       ?      185.52  35.99  0.00    35.99  
1 1 1 12  11  9  o 11 128.01  29.31  556.79    210.75   0.00     0.00     556.79    210.75   ?       ?      128.01  29.31  0.00    29.31  
1 1 1 12  11  10 o 11 55.15   20.29  79.85     84.48    18.77    110.98   163.98    130.26   51.01   21.69  73.10   25.39  -22.09  33.39  
1 1 1 12  11  11 o 14 203.50  25.20  1346.62   288.08   1509.87  400.51   1171.64   414.66   204.91  35.32  171.90  42.31  33.01   55.12  
1 1 1 12  11  12 o 17 50.01   19.78  50.63     84.17    87.95    106.88   -10.31    136.58   59.14   22.60  52.53   23.18  6.61    32.37  
1 1 1 12  12  1  o 14 139.12  31.16  655.77    242.67   0.00     0.00     655.77    242.67   ?       ?      139.12  31.16  0.00    31.16  
1 1 1 12  12  2  o 18 123.86  30.55  521.07    215.86   0.00     0.00     521.07    215.86   ?       ?      123.86  30.55  0.00    30.55  
1 1 1 12  12  3  o 8  130.98  30.23  580.95    222.64   0.00     0.00     580.95    222.64   ?       ?      130.98  30.23  0.00    30.23  
1 1 1 12  12  4  o 4  156.00  31.03  825.34    268.10   0.00     0.00     825.34    268.10   ?       ?      156.00  31.03  0.00    31.03  
1 1 1 12  12  5  o 2  118.18  18.33  431.45    120.31   412.91   161.42   454.62    180.46   112.06  25.65  116.77  27.40  -4.70   37.53  
1 1 1 12  12  6  o 6  174.48  22.01  957.47    215.59   1136.20  299.18   764.41    310.95   184.58  29.21  144.21  37.29  40.37   47.36  
1 1 1 12  12  7  o 6  114.42  18.26  405.96    115.93   412.84   152.45   396.52    178.53   112.42  24.33  108.04  28.41  4.38    37.41  
1 1 1 12  12  8  o 12 87.20   19.63  241.65    95.87    266.50   121.84   201.27    155.32   90.29   23.34  79.77   27.72  10.52   36.24  
1 1 1 13  -10 0  o 9  107.59  28.99  407.44    183.07   407.44   183.07   0.00      0.00     107.59  28.99  ?       ?      0.00    28.99  
1 1 1 13  -10 1  o 7  124.90  20.31  496.42    140.64   526.69   200.64   467.17    197.21   122.92  28.92  115.05  29.67  7.87    41.43  
1 1 1 13  -9  0  o 15 173.06  37.45  1117.87   361.27   1117.87  361.27   0.00      0.00     173.06  37.45  ?       ?      0.00    37.45  
1 1 1 13  -9  1  o 1  181.88  38.36  1241.23   387.87   1241.23  387.87   0.00      0.00     181.88  38.36  ?       ?      0.00    38.36  
1 1 1 13  -9  2  o 8  76.79   23.50  190.85    113.30   172.78   185.10   201.68    143.29   77.57   29.72  79.11   26.65  -1.54   39.92  
1 1 1 13  -9  3  o 7  174.90  22.97  978.27    225.03   919.40   326.89   1031.31   310.25   157.40  36.83  171.19  32.76  -13.80  49.30  
1 1 1 13  -9  4  o 10 159.44  21.93  807.52    195.40   792.25   285.74   820.92    267.80   148.11  34.28  153.41  31.46  -5.30   46.53  
1 1 1 13  -9  5  o 18 69.44   22.93  150.39    106.18   152.97   151.45   147.88    148.91   72.76   27.10  71.90   26.85  0.86    38.15  
1 1 1 13  -9  6  o 10 72.89   20.41  169.98    88.75    298.56   149.54   100.05    110.28   94.12   26.54  61.52   23.08  32.60   35.17  
1 1 1 13  -9  7  o 12 228.17  27.56  1726.06   353.68   1764.68  506.47   1689.31   494.11   211.75  43.13  207.30  42.93  4.45    60.86  
1 1 1 13  -8  0  o 9  125.68  30.89  543.95    221.27   543.95   221.27   0.00      0.00     125.68  30.89  ?       ?      0.00    30.89  
1 1 1 13  -8  1  o 8  152.43  33.77  814.26    287.74   814.26   287.74   0.00      0.00     152.43  33.77  ?       ?      0.00    33.77  
1 1 1 13  -8  2  o 2  196.31  39.67  1416.91   431.62   1416.91  431.62   0.00      0.00     196.31  39.67  ?       ?      0.00    39.67  
1 1 1 13  -8  3  o 13 177.44  22.50  991.18    224.02   1076.74  325.10   913.83    309.13   176.43  33.32  161.23  34.44  15.20   47.92  
1 1 1 13  -8  4  o 4  98.02   22.85  310.24    126.21   335.47   192.65   291.27    167.06   99.23   30.70  93.37   28.53  5.86    41.91  
1 1 1 13  -8  5  o 5  168.23  22.47  893.46    211.63   977.57   306.22   816.56    292.80   167.96  32.94  151.92  34.38  16.05   47.61  
1 1 1 13  -8  6  o 12 185.53  22.04  1082.45   230.19   1041.72  326.35   1122.79   324.74   172.06  34.25  180.36  32.56  -8.31   47.25  
1 1 1 13  -8  7  o 7  71.02   19.27  159.62    80.58    171.63   112.07   146.78    115.92   73.66   23.50  69.63   23.96  4.03    33.56  
1 1 1 13  -8  8  o 7  152.41  19.31  720.84    165.19   630.96   233.54   810.85    233.70   135.02  30.81  156.61  26.97  -21.59  40.95  
1 1 1 13  -8  9  o 5  147.07  18.88  670.13    155.70   656.72   223.33   682.81    217.19   139.11  28.91  142.99  27.46  -3.87   39.87  
1 1 1 13  -7  0  o 11 62.84   24.30  91.84     124.59   91.84    124.59   0.00      0.00     62.84   24.30  ?       ?      0.00    24.30  
1 1 1 13  -7  1  o 17 68.26   25.47  123.32    133.87   0.00     0.00     123.32    133.87   ?       ?      68.26   25.47  0.00    25.47  
1 1 1 13  -7  2  o 8  83.58   26.98  222.06    147.39   222.06   147.39   0.00      0.00     83.58   26.98  ?       ?      0.00    26.98  
1 1 1 13  -7  3  o 10 280.12  101.61 7530.24   2106.56  7530.24  2106.56  0.00      0.00     280.12  101.61 ?       ?      0.00    101.61 
1 1 1 13  -7  4  o 14 158.55  21.27  780.47    188.72   603.33   265.51   961.33    268.29   131.28  34.71  171.70  28.20  -40.42  44.72  
1 1 1 13  -7  5  o 2  201.93  23.65  1280.90   268.94   1114.85  380.22   1447.17   380.47   176.18  38.66  206.76  33.18  -30.58  50.94  
1 1 1 13  -7  6  o 14 99.70   24.77  323.14    141.16   0.00     0.00     323.14    141.16   ?       ?      99.70   24.77  0.00    24.77  
1 1 1 13  -7  7  o 14 78.11   19.04  191.96    84.61    195.43   119.36   188.46    119.95   78.41   24.15  77.23   24.27  1.19    34.24  
1 1 1 13  -7  8  o 6  92.21   17.95  264.35    91.62    174.82   127.89   358.75    131.32   75.15   25.18  105.93  22.30  -30.79  33.63  
1 1 1 13  -7  9  o 6  51.00   19.59  58.55     80.59    30.33    113.90   86.83     114.03   53.08   22.24  60.43   23.28  -7.35   32.19  
1 1 1 13  -7  10 o 15 234.55  28.25  1815.54   372.69   1673.97  527.28   1956.89   526.86   204.35  46.05  227.29  41.92  -22.94  62.28  
1 1 1 13  -7  11 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 13  -6  0  o 7  112.87  27.49  417.12    176.41   417.12   176.41   0.00      0.00     112.87  27.49  ?       ?      0.00    27.49  
1 1 1 13  -6  1  o 5  213.75  40.36  1620.59   477.09   1620.59  477.09   0.00      0.00     213.75  40.36  ?       ?      0.00    40.36  
1 1 1 13  -6  2  o 17 100.84  20.79  318.41    116.33   235.74   166.63   397.02    162.48   86.60   28.73  110.76  26.00  -24.16  38.75  
1 1 1 13  -6  3  o 14 137.50  28.49  617.82    217.49   617.82   217.49   0.00      0.00     137.50  28.49  ?       ?      0.00    28.49  
1 1 1 13  -6  4  o 14 292.86  70.54  4163.25   1171.84  4163.25  1171.84  0.00      0.00     292.86  70.54  ?       ?      0.00    70.54  
1 1 1 13  -6  5  o 5  92.56   17.70  263.89    90.61    258.69   127.14   269.25    129.15   89.85   24.14  91.62   24.20  -1.76   34.18  
1 1 1 13  -6  6  o 5  209.45  23.78  1370.24   280.92   1470.65  398.22   1270.78   396.33   208.43  34.49  190.85  37.51  17.57   50.96  
1 1 1 13  -6  7  o 16 68.55   19.23  146.16    78.75    196.48   113.41   99.30     109.43   78.85   23.38  62.14   23.06  16.71   32.84  
1 1 1 13  -6  8  o 3  69.64   19.37  151.38    80.27    183.18   116.82   122.94    110.47   76.48   23.94  65.92   23.34  10.56   33.44  
1 1 1 13  -6  9  o 7  135.65  18.18  562.66    138.00   521.76   197.81   601.44    192.60   125.53  28.15  136.55  25.51  -11.03  37.99  
1 1 1 13  -6  10 o 6  47.61   20.81  -8.83     107.69   -8.83    107.69   0.00      0.00     47.61   20.81  ?       ?      0.00    20.81  
1 1 1 13  -6  11 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 13  -6  12 o 12 93.76   25.42  290.83    140.20   0.00     0.00     290.83    140.20   ?       ?      93.76   25.42  0.00    25.42  
1 1 1 13  -6  13 o 4  156.53  30.83  841.23    267.13   0.00     0.00     841.23    267.13   ?       ?      156.53  30.83  0.00    30.83  
1 1 1 13  -5  0  o 16 178.84  32.67  1059.52   323.07   0.00     0.00     1059.52   323.07   ?       ?      178.84  32.67  0.00    32.67  
1 1 1 13  -5  1  o 19 158.91  19.98  770.14    178.26   795.20   252.60   745.28    251.59   156.64  29.16  151.00  30.08  5.65    41.90  
1 1 1 13  -5  2  o 13 232.23  26.86  1699.87   351.50   1608.17  496.19   1792.23   498.00   212.89  42.09  227.52  39.56  -14.63  57.77  
1 1 1 13  -5  3  o 13 249.58  48.12  2317.73   664.43   2317.73  664.43   0.00      0.00     249.58  48.12  ?       ?      0.00    48.12  
1 1 1 13  -5  4  o 17 238.81  44.48  2058.46   587.34   2058.46  587.34   0.00      0.00     238.81  44.48  ?       ?      0.00    44.48  
1 1 1 13  -5  5  o 15 112.13  25.53  403.31    160.65   403.31   160.65   0.00      0.00     112.13  25.53  ?       ?      0.00    25.53  
1 1 1 13  -5  6  o 19 268.75  31.18  2346.90   472.17   2326.27  669.11   2367.37   666.40   248.38  48.67  251.58  47.89  -3.20   68.28  
1 1 1 13  -5  7  o 8  247.30  28.52  1957.15   397.54   1873.10  562.82   2040.84   561.58   225.80  45.00  238.70  42.54  -12.90  61.93  
1 1 1 13  -5  8  o 17 115.06  17.50  403.22    111.92   334.27   157.54   473.49    159.03   101.34  26.71  122.33  23.50  -20.98  35.58  
1 1 1 13  -5  9  o 13 119.56  25.65  461.23    170.81   461.23   170.81   0.00      0.00     119.56  25.65  ?       ?      0.00    25.65  
1 1 1 13  -5  10 x 1  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 13  -5  11 x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 13  -5  12 o 7  153.51  19.14  725.37    165.04   766.42   234.39   685.00    232.42   152.55  27.79  143.02  29.29  9.53    40.38  
1 1 1 13  -5  13 o 9  152.41  30.52  790.74    257.71   0.00     0.00     790.74    257.71   ?       ?      152.41  30.52  0.00    30.52  
1 1 1 13  -5  14 o 19 116.70  26.87  455.73    176.31   0.00     0.00     455.73    176.31   ?       ?      116.70  26.87  0.00    26.87  
1 1 1 13  -4  0  o 11 130.76  28.24  552.11    205.75   0.00     0.00     552.11    205.75   ?       ?      130.76  28.24  0.00    28.24  
1 1 1 13  -4  1  o 9  124.94  17.95  472.72    125.03   585.63   171.20   343.66    183.04   137.48  22.47  102.87  29.48  34.61   37.07  
1 1 1 13  -4  2  o 4  256.62  29.32  2092.16   424.23   1943.69  597.84   2242.74   602.09   231.35  46.63  252.80  43.03  -21.46  63.45  
1 1 1 13  -4  3  f 0  176.29  21.27  948.96    210.91   877.39   292.07   1026.96   304.90   163.38  32.29  177.94  30.97  -14.55  44.74  
1 1 1 13  -4  4  o 16 76.49   23.90  179.60    116.48   179.60   116.48   0.00      0.00     76.49   23.90  ?       ?      0.00    23.90  
1 1 1 13  -4  5  o 8  86.59   24.32  236.98    125.86   236.98   125.86   0.00      0.00     86.59   24.32  ?       ?      0.00    24.32  
1 1 1 13  -4  6  o 9  193.05  22.11  1143.19   240.64   1076.08  340.72   1209.97   339.90   179.60  34.30  192.45  31.88  -12.85  46.83  
1 1 1 13  -4  7  o 3  70.56   19.81  154.10    83.51    244.72   121.92   73.99     114.63   87.87   23.65  59.50   23.22  28.38   33.15  
1 1 1 13  -4  8  o 6  59.63   20.16  101.78    81.98    100.06   120.13   103.27    112.15   63.88   24.06  63.36   23.37  0.52    33.54  
1 1 1 13  -4  9  o 3  91.04   25.94  266.26    142.10   266.26   142.10   0.00      0.00     91.04   25.94  ?       ?      0.00    25.94  
1 1 1 13  -4  10 x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 13  -4  11 o 9  151.32  19.49  701.67    165.37   651.79   234.25   751.24    233.50   140.02  30.04  152.04  27.78  -12.02  40.92  
1 1 1 13  -4  12 o 15 58.75   20.78  95.52     87.55    112.31   126.79   80.23     121.04   65.95   24.75  60.82   23.83  5.13    34.35  
1 1 1 13  -4  13 o 7  153.48  29.61  787.42    251.43   0.00     0.00     787.42    251.43   ?       ?      153.48  29.61  0.00    29.61  
1 1 1 13  -4  14 o 11 75.79   25.08  180.51    126.99   0.00     0.00     180.51    126.99   ?       ?      75.79   25.08  0.00    25.08  
1 1 1 13  -4  15 o 8  54.81   20.42  76.65     85.98    17.10    122.02   135.39    121.18   52.90   22.62  68.14   24.41  -15.24  33.29  
1 1 1 13  -3  0  o 17 93.66   27.20  278.84    154.90   0.00     0.00     278.84    154.90   ?       ?      93.66   27.20  0.00    27.20  
1 1 1 13  -3  1  o 11 167.34  31.43  907.72    290.89   0.00     0.00     907.72    290.89   ?       ?      167.34  31.43  0.00    31.43  
1 1 1 13  -3  2  o 13 92.06   19.49  261.63    99.79    293.69   132.50   219.61    151.67   96.46   24.02  84.60   27.38  11.86   36.42  
1 1 1 13  -3  3  o 13 282.44  32.19  2561.10   512.57   2590.82  724.71   2531.35   725.05   266.76  49.13  262.76  49.89  4.01    70.02  
1 1 1 13  -3  4  o 12 108.30  24.58  370.94    149.28   370.94   149.28   0.00      0.00     108.30  24.58  ?       ?      0.00    24.58  
1 1 1 13  -3  5  o 3  156.60  28.39  782.97    245.79   782.97   245.79   0.00      0.00     156.60  28.39  ?       ?      0.00    28.39  
1 1 1 13  -3  6  o 7  201.00  35.23  1342.28   391.67   1342.28  391.67   0.00      0.00     201.00  35.23  ?       ?      0.00    35.23  
1 1 1 13  -3  7  o 12 74.36   19.54  171.56    84.49    215.90   122.49   131.31    116.71   82.96   24.22  68.43   24.01  14.53   34.11  
1 1 1 13  -3  8  f 0  96.41   17.57  284.10    93.66    385.93   134.67   188.70    130.36   111.20  21.88  78.54   25.38  32.66   33.50  
1 1 1 13  -3  9  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 13  -3  10 o 12 163.14  30.05  869.72    271.09   0.00     0.00     869.72    271.09   ?       ?      163.14  30.05  0.00    30.05  
1 1 1 13  -3  11 o 16 111.12  25.98  399.54    162.72   399.54   162.72   0.00      0.00     111.12  25.98  ?       ?      0.00    25.98  
1 1 1 13  -3  12 f 0  107.74  18.61  357.85    110.95   324.65   156.94   391.02    156.87   99.62   26.84  109.93  25.37  -10.31  36.94  
1 1 1 13  -3  13 o 17 139.58  18.93  598.05    147.80   704.18   210.29   494.43    207.79   147.94  25.69  121.15  30.03  26.79   39.52  
1 1 1 13  -3  14 o 5  149.95  29.57  753.23    245.50   0.00     0.00     753.23    245.50   ?       ?      149.95  29.57  0.00    29.57  
1 1 1 13  -3  15 o 3  75.92   26.14  178.73    137.92   0.00     0.00     178.73    137.92   ?       ?      75.92   26.14  0.00    26.14  
1 1 1 13  -3  16 o 8  80.64   21.37  209.66    100.52   282.75   150.46   150.75    135.08   91.80   26.85  71.40   25.75  20.41   37.21  
1 1 1 13  -2  0  o 13 266.78  49.80  2578.26   734.61   0.00     0.00     2578.26   734.61   ?       ?      266.78  49.80  0.00    49.80  
1 1 1 13  -2  1  o 5  202.39  35.62  1347.31   398.73   0.00     0.00     1347.31   398.73   ?       ?      202.39  35.62  0.00    35.62  
1 1 1 13  -2  2  o 4  141.16  17.82  598.14    141.18   661.63   202.14   537.67    197.26   145.68  25.07  130.11  27.28  15.57   37.05  
1 1 1 13  -2  3  o 16 224.86  24.98  1555.97   317.02   1543.49  448.27   1568.45   448.39   215.35  37.63  217.39  37.27  -2.04   52.96  
1 1 1 13  -2  4  o 19 245.08  43.66  2082.71   591.80   2082.71  591.80   0.00      0.00     245.08  43.66  ?       ?      0.00    43.66  
1 1 1 13  -2  5  o 15 237.55  42.31  1944.96   555.80   1944.96  555.80   0.00      0.00     237.55  42.31  ?       ?      0.00    42.31  
1 1 1 13  -2  6  o 10 189.30  33.12  1169.43   346.80   1169.43  346.80   0.00      0.00     189.30  33.12  ?       ?      0.00    33.12  
1 1 1 13  -2  7  o 16 229.55  25.75  1637.04   333.48   1628.70  471.44   1645.39   471.80   218.98  38.93  220.30  38.72  -1.32   54.90  
1 1 1 13  -2  8  o 8  226.71  40.69  1775.53   510.10   1775.53  510.10   0.00      0.00     226.71  40.69  ?       ?      0.00    40.69  
1 1 1 13  -2  9  x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 13  -2  10 o 18 219.63  24.96  1503.84   309.13   1499.39  437.87   1508.26   436.49   209.28  37.84  210.15  37.56  -0.88   53.32  
1 1 1 13  -2  11 o 6  204.35  23.46  1295.93   270.27   1353.38  382.98   1238.94   381.47   200.76  34.47  190.52  36.20  10.24   49.99  
1 1 1 13  -2  12 o 2  160.41  19.82  787.46    178.61   951.85   253.91   626.43    251.30   172.70  26.45  135.96  32.62  36.74   41.99  
1 1 1 13  -2  13 o 7  130.00  18.54  517.57    134.48   543.23   193.12   493.40    187.38   129.12  26.93  122.72  27.30  6.40    38.35  
1 1 1 13  -2  14 o 15 221.98  43.34  1845.04   532.51   0.00     0.00     1845.04   532.51   ?       ?      221.98  43.34  0.00    43.34  
1 1 1 13  -2  15 x 11 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 13  -2  16 x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 13  -2  17 o 6  236.09  28.95  1872.14   384.20   2147.64  546.44   1602.80   540.29   235.91  41.88  193.08  48.75  42.83   64.27  
1 1 1 13  -1  0  o 11 294.88  57.13  3301.47   932.19   0.00     0.00     3301.47   932.19   ?       ?      294.88  57.13  0.00    57.13  
1 1 1 13  -1  1  f 0  81.08   26.75  196.48    144.48   0.00     0.00     196.48    144.48   ?       ?      81.08   26.75  0.00    26.75  
1 1 1 13  -1  2  o 3  209.03  23.27  1331.36   274.56   1397.86  387.65   1264.41   388.92   208.12  33.59  196.29  35.83  11.83   49.12  
1 1 1 13  -1  3  o 5  206.83  23.08  1302.89   269.35   1280.24  380.92   1325.54   380.91   198.21  34.74  202.23  34.02  -4.03   48.62  
1 1 1 13  -1  4  o 4  188.29  32.31  1141.41   336.67   1141.41  336.67   0.00      0.00     188.29  32.31  ?       ?      0.00    32.31  
1 1 1 13  -1  5  o 9  180.21  31.26  1042.22   311.62   1042.22  311.62   0.00      0.00     180.21  31.26  ?       ?      0.00    31.26  
1 1 1 13  -1  6  o 9  193.44  33.54  1218.84   359.00   1218.84  359.00   0.00      0.00     193.44  33.54  ?       ?      0.00    33.54  
1 1 1 13  -1  7  o 15 60.18   19.70  105.15    78.43    82.82    112.76   126.07    109.16   60.71   23.21  67.01   23.24  -6.30   32.85  
1 1 1 13  -1  8  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 13  -1  9  o 5  92.06   24.62  269.00    132.60   0.00     0.00     269.00    132.60   ?       ?      92.06   24.62  0.00    24.62  
1 1 1 13  -1  10 o 5  68.70   20.41  144.75    86.35    82.47    119.66   212.42    124.73   61.45   23.80  82.29   24.55  -20.84  34.19  
1 1 1 13  -1  11 o 10 70.03   20.10  151.71    85.01    105.65   122.44   194.57    118.11   64.97   24.33  78.93   23.97  -13.96  34.15  
1 1 1 13  -1  12 o 2  55.89   20.49  79.57     85.98    94.00    119.87   64.28     123.39   62.86   23.95  59.40   23.80  3.46    33.77  
1 1 1 13  -1  13 o 8  138.46  18.81  586.23    145.62   701.69   207.75   474.72    204.17   148.31  25.31  119.21  29.89  29.10   39.17  
1 1 1 13  -1  14 f 0  200.36  38.04  1423.03   421.54   0.00     0.00     1423.03   421.54   ?       ?      200.36  38.04  0.00    38.04  
1 1 1 13  -1  15 o 13 223.14  44.60  1911.39   551.33   0.00     0.00     1911.39   551.33   ?       ?      223.14  44.60  0.00    44.60  
1 1 1 13  -1  16 o 10 80.16   26.50  206.21    141.74   0.00     0.00     206.21    141.74   ?       ?      80.16   26.50  0.00    26.50  
1 1 1 13  -1  17 o 10 143.93  19.98  649.19    160.63   721.15   228.74   579.17    225.64   146.10  28.30  128.63  30.94  17.47   41.93  
1 1 1 13  0   0  o 11 188.84  33.46  1152.91   349.43   0.00     0.00     1152.91   349.43   ?       ?      188.84  33.46  0.00    33.46  
1 1 1 13  0   1  o 10 279.26  31.37  2462.09   494.25   2453.95  696.44   2470.35   701.53   264.25  47.66  264.92  47.89  -0.67   67.57  
1 1 1 13  0   2  o 1  147.63  18.08  652.91    150.01   687.74   209.19   616.03    215.24   148.73  25.41  139.57  27.84  9.16    37.70  
1 1 1 13  0   3  o 14 88.84   17.72  240.72    87.19    249.99   121.16   230.76    125.58   89.46   23.35  86.08   24.34  3.39    33.72  
1 1 1 13  0   4  o 16 183.28  31.37  1073.92   318.20   1073.92  318.20   0.00      0.00     183.28  31.37  ?       ?      0.00    31.37  
1 1 1 13  0   5  o 11 167.03  28.88  883.37    266.89   883.37   266.89   0.00      0.00     167.03  28.88  ?       ?      0.00    28.88  
1 1 1 13  0   6  o 5  81.40   23.96  205.33    119.44   205.33   119.44   0.00      0.00     81.40   23.96  ?       ?      0.00    23.96  
1 1 1 13  0   7  o 5  151.33  27.68  726.14    231.63   726.14   231.63   0.00      0.00     151.33  27.68  ?       ?      0.00    27.68  
1 1 1 13  0   8  x 14 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 13  0   9  o 5  62.30   20.51  113.10    84.97    124.88   116.61   99.75     124.07   67.44   23.97  64.58   24.43  2.86    34.23  
1 1 1 13  0   10 o 10 220.83  25.28  1518.80   314.66   1714.57  445.49   1323.90   444.51   226.88  35.36  194.13  41.17  32.75   54.27  
1 1 1 13  0   11 o 17 150.80  18.94  690.48    160.34   764.01   226.20   616.20    227.32   155.06  26.35  137.16  29.73  17.90   39.73  
1 1 1 13  0   12 o 4  191.18  22.37  1129.12   240.90   1145.15  342.20   1113.37   339.19   184.99  33.45  182.18  33.67  2.81    47.47  
1 1 1 13  0   13 o 3  154.70  19.96  734.39    173.10   784.22   242.69   682.78    246.97   155.23  28.28  142.94  30.99  12.29   41.95  
1 1 1 13  0   14 o 9  112.47  19.38  392.21    120.61   489.61   169.01   291.12    172.18   123.40  24.72  94.05   29.01  29.36   38.11  
1 1 1 13  0   15 o 9  242.66  51.57  2432.30   696.25   0.00     0.00     2432.30   696.25   ?       ?      242.66  51.57  0.00    51.57  
1 1 1 13  0   16 o 18 126.07  29.04  539.64    205.81   0.00     0.00     539.64    205.81   ?       ?      126.07  29.04  0.00    29.04  
1 1 1 13  0   17 o 5  102.37  20.86  335.21    118.40   312.29   172.87   355.48    162.51   95.45   29.00  102.36  27.20  -6.91   39.75  
1 1 1 13  0   18 o 6  150.22  20.71  713.38    173.87   749.56   247.78   678.28    244.06   146.75  30.41  138.56  31.41  8.19    43.72  
1 1 1 13  1   0  o 11 225.03  25.03  1552.81   317.84   1507.75  443.71   1600.29   455.50   213.67  37.54  220.41  37.33  -6.74   52.94  
1 1 1 13  1   1  o 8  274.55  30.69  2370.54   475.47   2355.16  672.01   2385.96   672.83   259.72  46.79  261.75  46.48  -2.03   65.96  
1 1 1 13  1   2  o 15 59.80   19.65  102.78    78.01    169.62   103.37   14.34     118.90   74.61   22.37  53.26   22.54  21.35   31.75  
1 1 1 13  1   3  o 3  139.24  25.63  605.38    197.36   605.38   197.36   0.00      0.00     139.24  25.63  ?       ?      0.00    25.63  
1 1 1 13  1   4  o 14 283.77  52.90  2946.21   830.10   2946.21  830.10   0.00      0.00     283.77  52.90  ?       ?      0.00    52.90  
1 1 1 13  1   5  o 19 98.17   23.90  302.55    133.39   302.55   133.39   0.00      0.00     98.17   23.90  ?       ?      0.00    23.90  
1 1 1 13  1   6  o 4  284.57  32.32  2585.32   518.61   2619.42  731.01   2550.76   735.86   270.20  48.93  265.21  50.17  4.99    70.08  
1 1 1 13  1   7  x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 13  1   8  o 19 206.51  36.49  1422.29   416.75   0.00     0.00     1422.29   416.75   ?       ?      206.51  36.49  0.00    36.49  
1 1 1 13  1   9  o 13 209.73  23.71  1355.10   280.48   1342.33  395.41   1368.03   397.92   200.66  35.63  202.73  35.48  -2.06   50.29  
1 1 1 13  1   10 o 7  160.38  19.49  780.55    175.79   686.26   247.90   875.91    249.31   144.68  30.79  166.14  27.07  -21.46  41.00  
1 1 1 13  1   11 o 4  246.39  28.44  1932.29   394.95   2107.50  558.95   1757.57   558.14   245.28  41.15  218.72  45.92  26.56   61.66  
1 1 1 13  1   12 o 19 53.85   20.18  69.32     84.23    49.16    115.22   92.47     123.45   56.16   22.83  63.15   24.25  -6.99   33.30  
1 1 1 13  1   13 o 7  163.98  20.29  825.75    186.92   868.46   263.54   782.51    265.16   162.87  29.26  153.13  31.22  9.74    42.79  
1 1 1 13  1   14 o 12 290.84  35.90  2908.84   586.72   3220.04  829.63   2597.46   829.86   280.39  53.49  239.40  60.40  40.99   80.68  
1 1 1 13  1   15 o 1  66.07   25.20  109.90    132.72   0.00     0.00     109.90    132.72   ?       ?      66.07   25.20  0.00    25.20  
1 1 1 13  1   16 o 8  65.76   25.42  107.00    136.27   0.00     0.00     107.00    136.27   ?       ?      65.76   25.42  0.00    25.42  
1 1 1 13  1   17 o 14 240.43  29.72  1955.78   401.48   2163.64  568.64   1749.16   566.93   233.72  44.00  201.20  49.44  32.53   66.18  
1 1 1 13  1   18 o 5  67.41   22.37  141.55    100.98   131.94   144.02   150.84    141.63   69.11   26.28  71.44   26.28  -2.32   37.16  
1 1 1 13  2   0  o 13 320.75  36.80  3354.34   665.34   3228.86  938.56   3481.09   943.31   290.40  58.33  304.88  55.96  -14.48  80.83  
1 1 1 13  2   1  o 2  154.23  27.61  748.52    235.46   0.00     0.00     748.52    235.46   ?       ?      154.23  27.61  0.00    27.61  
1 1 1 13  2   2  o 12 244.04  27.18  1844.02   374.30   1891.14  529.00   1796.78   529.69   237.55  40.23  230.32  41.59  7.23    57.86  
1 1 1 13  2   3  o 4  207.57  35.71  1409.06   410.18   1409.06  410.18   0.00      0.00     207.57  35.71  ?       ?      0.00    35.71  
1 1 1 13  2   4  o 18 156.17  28.33  771.35    244.65   771.35   244.65   0.00      0.00     156.17  28.33  ?       ?      0.00    28.33  
1 1 1 13  2   5  o 4  189.44  32.52  1157.63   340.87   1157.63  340.87   0.00      0.00     189.44  32.52  ?       ?      0.00    32.52  
1 1 1 13  2   6  o 11 195.29  33.70  1241.77   364.16   1241.77  364.16   0.00      0.00     195.29  33.70  ?       ?      0.00    33.70  
1 1 1 13  2   7  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 13  2   8  o 17 72.55   20.18  162.58    87.10    179.97   116.65   140.66    130.94   76.68   23.91  71.34   25.40  5.34    34.89  
1 1 1 13  2   9  o 1  109.10  18.09  362.52    109.35   363.38   147.70   361.48    162.68   107.02  24.56  106.06  26.73  0.96    36.30  
1 1 1 13  2   10 o 13 224.79  25.66  1578.01   325.23   1532.43  455.90   1625.25   464.09   210.99  39.08  217.94  38.50  -6.94   54.86  
1 1 1 13  2   11 o 11 258.92  29.90  2155.77   436.32   2164.99  614.96   2146.43   619.17   243.38  45.69  241.58  46.33  1.80    65.07  
1 1 1 13  2   12 o 9  204.54  23.67  1302.28   272.76   1269.12  384.46   1335.88   387.05   192.60  36.10  198.41  35.27  -5.81   50.47  
1 1 1 13  2   13 o 2  44.88   19.00  10.70     84.56    41.92    115.85   -24.91    123.72   55.22   22.72  49.59   21.96  5.63    31.60  
1 1 1 13  2   14 o 12 213.94  25.00  1450.66   301.29   1321.94  424.73   1581.03   427.46   190.90  40.04  213.24  36.21  -22.34  53.99  
1 1 1 13  2   15 o 13 146.75  30.15  726.65    245.48   0.00     0.00     726.65    245.48   ?       ?      146.75  30.15  0.00    30.15  
1 1 1 13  2   16 o 9  74.58   26.49  168.39    142.37   0.00     0.00     168.39    142.37   ?       ?      74.58   26.49  0.00    26.49  
1 1 1 13  2   17 o 9  140.13  20.43  619.07    159.53   602.26   220.45   637.54    231.13   131.86  29.82  135.25  30.50  -3.39   42.66  
1 1 1 13  2   18 o 14 109.36  20.30  381.80    122.77   377.34   169.03   386.78    178.62   104.61  27.71  105.33  28.74  -0.72   39.93  
1 1 1 13  3   0  o 17 94.08   17.02  268.56    88.52    252.87   117.43   289.20    134.73   89.93   22.74  95.84   24.42  -5.91   33.37  
1 1 1 13  3   1  o 19 273.73  50.38  2707.34   762.44   2707.34  762.44   0.00      0.00     273.73  50.38  ?       ?      0.00    50.38  
1 1 1 13  3   2  o 1  41.64   18.90  -51.72    97.97    -51.72   97.97    0.00      0.00     41.64   18.90  ?       ?      0.00    18.90  
1 1 1 13  3   3  o 12 210.93  36.28  1464.88   423.51   1464.88  423.51   0.00      0.00     210.93  36.28  ?       ?      0.00    36.28  
1 1 1 13  3   4  f 0  117.38  25.73  435.37    168.61   435.37   168.61   0.00      0.00     117.38  25.73  ?       ?      0.00    25.73  
1 1 1 13  3   5  o 6  225.50  25.39  1569.54   322.96   1614.44  458.03   1525.14   455.44   220.17  37.59  213.05  38.66  7.13    53.92  
1 1 1 13  3   6  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 13  3   7  o 13 294.61  59.97  3475.86   979.65   0.00     0.00     3475.86   979.65   ?       ?      294.61  59.97  0.00    59.97  
1 1 1 13  3   8  o 4  135.17  17.94  551.44    135.79   530.07   191.39   573.11    192.68   128.89  26.74  134.54  25.89  -5.65   37.22  
1 1 1 13  3   9  f 0  149.38  19.00  676.35    159.24   665.04   220.88   688.60    229.77   144.07  27.71  146.30  28.38  -2.24   39.67  
1 1 1 13  3   10 o 1  304.56  36.41  3110.26   623.98   3262.15  880.92   2957.33   883.96   287.01  55.47  267.48  59.14  19.53   81.09  
1 1 1 13  3   11 o 2  150.39  19.39  689.70    163.48   746.07   225.62   627.39    237.21   152.76  26.70  137.56  30.81  15.20   40.77  
1 1 1 13  3   12 o 19 172.32  21.14  914.52    204.78   883.66   285.78   947.09    293.59   162.84  31.71  168.92  31.43  -6.08   44.65  
1 1 1 13  3   13 o 3  178.37  21.73  986.49    217.95   1007.83  303.80   963.86    312.87   173.57  31.66  168.18  33.58  5.39    46.15  
1 1 1 13  3   14 o 7  228.59  46.48  2023.79   589.21   0.00     0.00     2023.79   589.21   ?       ?      228.59  46.48  0.00    46.48  
1 1 1 13  3   15 o 10 70.20   25.86  138.13    137.31   0.00     0.00     138.13    137.31   ?       ?      70.20   25.86  0.00    25.86  
1 1 1 13  3   16 o 5  81.41   27.22  214.47    149.44   0.00     0.00     214.47    149.44   ?       ?      81.41   27.22  0.00    27.22  
1 1 1 13  3   17 o 4  260.95  33.25  2403.28   486.82   2363.27  686.91   2443.65   690.04   226.56  53.65  231.91  52.99  -5.35   75.41  
1 1 1 13  3   18 o 3  28.63   13.94  -123.12   73.51    -284.69  84.72    369.15    147.88   24.25   12.28  104.86  24.93  -80.61  27.79  
1 1 1 13  4   0  o 11 78.20   23.42  188.39    113.33   188.39   113.33   0.00      0.00     78.20   23.42  ?       ?      0.00    23.42  
1 1 1 13  4   1  o 7  187.03  32.24  1130.32   333.68   1130.32  333.68   0.00      0.00     187.03  32.24  ?       ?      0.00    32.24  
1 1 1 13  4   2  o 16 243.42  43.12  2047.52   580.57   2047.52  580.57   0.00      0.00     243.42  43.12  ?       ?      0.00    43.12  
1 1 1 13  4   3  o 18 60.94   21.74  98.61     95.99    98.61    95.99    0.00      0.00     60.94   21.74  ?       ?      0.00    21.74  
1 1 1 13  4   4  o 9  148.44  17.92  661.73    149.65   613.71   208.15   713.12    215.31   139.15  27.03  150.85  25.79  -11.70  37.36  
1 1 1 13  4   5  o 9  286.96  33.46  2663.07   540.79   2923.36  763.09   2400.44   766.51   284.66  48.43  249.91  54.93  34.75   73.23  
1 1 1 13  4   6  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 13  4   7  o 1  264.27  29.98  2223.36   446.77   2167.05  631.29   2279.86   632.37   245.10  46.57  253.02  45.20  -7.92   64.89  
1 1 1 13  4   8  o 11 177.68  20.94  962.74    209.51   956.47   296.41   969.01    296.17   171.27  31.30  172.58  31.04  -1.31   44.08  
1 1 1 13  4   9  o 9  135.07  18.58  554.04    140.28   525.16   199.24   582.43    197.54   127.34  28.02  135.05  26.43  -7.71   38.52  
1 1 1 13  4   10 o 5  200.58  23.27  1246.19   262.94   1231.19  372.60   1261.08   371.12   190.84  35.31  193.73  34.64  -2.89   49.47  
1 1 1 13  4   11 o 18 152.36  20.05  711.67    171.08   847.91   243.10   577.99    240.80   162.64  26.98  130.84  32.27  31.80   42.06  
1 1 1 13  4   12 o 10 214.59  25.09  1452.81   303.27   1445.49  426.49   1460.30   431.33   203.06  37.98  203.85  38.26  -0.79   53.91  
1 1 1 13  4   13 o 4  222.34  26.21  1579.56   328.10   1571.44  458.71   1588.06   469.48   209.03  39.68  209.21  40.55  -0.18   56.74  
1 1 1 13  4   14 o 11 69.36   26.60  122.39    148.49   0.00     0.00     122.39    148.49   ?       ?      69.36   26.60  0.00    26.60  
1 1 1 13  4   15 o 7  166.64  34.30  981.77    317.22   0.00     0.00     981.77    317.22   ?       ?      166.64  34.30  0.00    34.30  
1 1 1 13  4   16 o 13 85.37   22.30  237.53    110.48   261.44   145.29   204.76    170.09   88.33   26.53  80.54   28.92  7.79    39.24  
1 1 1 13  4   17 o 11 169.72  22.23  922.22    211.36   937.24   291.02   905.46    307.48   162.31  32.37  156.76  35.05  5.55    47.71  
1 1 1 13  5   0  x 16 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 13  5   1  o 6  299.72  61.22  3622.91   1017.65  3622.91  1017.65  0.00      0.00     299.72  61.22  ?       ?      0.00    61.22  
1 1 1 13  5   2  o 4  238.29  26.58  1767.65   357.43   1732.25  504.53   1803.32   506.42   225.02  40.55  230.41  39.72  -5.39   56.76  
1 1 1 13  5   3  o 18 90.42   18.63  251.48    93.47    180.55   128.01   332.50    136.81   77.36   25.16  102.73  23.68  -25.37  34.55  
1 1 1 13  5   4  o 16 182.21  20.98  1009.26   215.48   995.25   302.10   1023.77   307.46   175.38  31.15  177.86  31.25  -2.48   44.12  
1 1 1 13  5   5  o 7  136.37  25.58  586.96    192.89   586.96   192.89   0.00      0.00     136.37  25.58  ?       ?      0.00    25.58  
1 1 1 13  5   6  o 7  182.69  32.68  1094.31   330.10   0.00     0.00     1094.31   330.10   ?       ?      182.69  32.68  0.00    32.68  
1 1 1 13  5   7  o 6  194.09  22.18  1155.21   242.70   1144.22  340.54   1166.55   346.00   186.34  33.04  188.03  33.27  -1.68   46.89  
1 1 1 13  5   8  o 1  54.96   19.87  78.21     80.45    85.27    107.21   69.10     121.72   60.02   22.70  59.93   23.77  0.09    32.87  
1 1 1 13  5   9  o 7  136.71  18.74  569.07    143.22   618.95   200.95   517.57    204.17   139.21  26.10  125.68  28.90  13.53   38.94  
1 1 1 13  5   10 o 7  97.42   20.09  296.15    108.60   389.82   154.05   203.59    153.13   110.18  24.94  81.49   27.55  28.69   37.16  
1 1 1 13  5   11 o 12 236.26  27.79  1791.29   369.71   1858.73  522.60   1723.72   523.11   226.95  41.65  216.15  43.66  10.80   60.34  
1 1 1 13  5   12 o 14 138.33  20.00  591.40    154.22   697.04   220.35   489.97    215.92   146.29  27.24  120.11  31.08  26.18   41.33  
1 1 1 13  5   13 o 19 73.85   26.18  161.45    139.01   0.00     0.00     161.45    139.01   ?       ?      73.85   26.18  0.00    26.18  
1 1 1 13  5   14 o 7  137.18  30.72  645.42    235.86   0.00     0.00     645.42    235.86   ?       ?      137.18  30.72  0.00    30.72  
1 1 1 13  5   15 o 5  132.10  31.52  612.59    235.68   0.00     0.00     612.59    235.68   ?       ?      132.10  31.52  0.00    31.52  
1 1 1 13  5   16 o 2  183.51  23.44  1086.11   241.28   1127.07  335.29   1042.12   347.49   176.67  34.30  166.44  37.29  10.22   50.67  
1 1 1 13  5   17 o 19 31.77   15.08  -82.78    74.27    -149.41  83.34    174.41    163.75   29.80   14.58  75.66   28.18  -45.86  31.73  
1 1 1 13  6   0  o 7  324.26  38.62  3545.42   704.83   3536.30  995.40   3554.59   998.16   293.76  61.02  294.51  61.05  -0.75   86.31  
1 1 1 13  6   1  o 13 193.72  22.36  1149.50   244.09   1245.39  341.96   1049.89   348.53   196.09  31.44  177.00  35.54  19.09   47.45  
1 1 1 13  6   2  o 2  193.25  21.88  1141.22   238.47   1135.18  334.49   1147.46   340.06   186.35  32.44  187.10  32.86  -0.74   46.18  
1 1 1 13  6   3  o 7  259.89  29.92  2153.81   438.19   2246.68  618.60   2060.27   620.79   251.47  44.48  237.77  47.15  13.69   64.82  
1 1 1 13  6   4  o 7  136.42  18.11  562.73    138.32   567.48   194.52   557.87    196.73   133.51  26.32  132.09  26.86  1.42    37.60  
1 1 1 13  6   5  x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 13  6   6  o 15 336.54  41.72  3953.42   788.73   4026.79  1114.82  3879.90   1116.05  302.14  66.11  293.56  67.62  8.58    94.57  
1 1 1 13  6   7  o 17 157.58  19.37  755.42    171.58   771.92   239.99   738.17    245.39   154.84  28.03  150.52  29.45  4.32    40.66  
1 1 1 13  6   8  o 8  144.99  18.95  640.37    153.92   679.60   211.15   595.88    224.86   145.87  26.18  134.39  29.92  11.48   39.75  
1 1 1 13  6   9  o 14 264.79  31.19  2294.76   465.09   2363.70  655.57   2224.90   659.93   250.34  47.35  239.87  49.56  10.47   68.55  
1 1 1 13  6   10 o 3  143.68  19.43  633.46    156.19   823.78   215.33   422.15    226.90   161.68  23.92  111.17  33.10  50.51   40.84  
1 1 1 13  6   11 o 5  302.88  37.61  3208.87   639.84   3159.99  902.34   3258.30   907.43   264.92  60.64  270.40  60.02  -5.48   85.33  
1 1 1 13  6   12 o 15 98.47   27.97  323.32    165.46   0.00     0.00     323.32    165.46   ?       ?      98.47   27.97  0.00    27.97  
1 1 1 13  6   13 o 16 122.91  29.23  513.26    203.23   0.00     0.00     513.26    203.23   ?       ?      122.91  29.23  0.00    29.23  
1 1 1 13  6   14 o 13 136.39  30.57  644.20    233.45   0.00     0.00     644.20    233.45   ?       ?      136.39  30.57  0.00    30.57  
1 1 1 13  6   15 o 16 161.17  22.01  828.73    198.30   935.92   280.41   721.48    280.48   163.99  30.92  139.78  35.03  24.21   46.72  
1 1 1 13  6   16 o 14 221.35  28.39  1661.55   352.41   1889.75  496.29   1429.45   500.52   219.62  40.87  179.83  47.70  39.79   62.82  
1 1 1 13  7   0  o 11 260.46  30.07  2177.18   441.33   2264.47  622.01   2088.70   626.28   250.72  44.86  237.55  47.58  13.16   65.40  
1 1 1 13  7   1  o 2  385.48  51.71  5643.19   1115.51  5600.22  1576.10  5686.32   1579.05  317.93  84.80  321.70  84.45  -3.77   119.68 
1 1 1 13  7   2  o 4  118.44  17.71  425.87    116.69   466.56   158.13   377.22    172.92   121.79  23.47  107.74  27.78  14.05   36.37  
1 1 1 13  7   3  o 11 88.84   18.65  244.10    92.08    203.58   121.12   299.60    141.74   80.62   24.22  96.70   25.26  -16.08  35.00  
1 1 1 13  7   4  o 12 74.07   23.36  168.22    111.03   168.22   111.03   0.00      0.00     74.07   23.36  ?       ?      0.00    23.36  
1 1 1 13  7   5  o 11 79.76   25.52  197.22    132.03   0.00     0.00     197.22    132.03   ?       ?      79.76   25.52  0.00    25.52  
1 1 1 13  7   6  o 14 254.48  30.08  2094.98   431.00   2264.35  608.87   1924.87   610.20   249.84  44.06  224.54  48.74  25.30   65.70  
1 1 1 13  7   7  o 10 194.92  23.09  1180.87   253.39   1279.51  355.84   1079.39   360.91   195.90  32.80  176.44  36.82  19.46   49.31  
1 1 1 13  7   8  o 9  86.40   20.10  234.57    97.79    241.47   132.54   226.32    144.88   86.73   25.16  84.40   26.70  2.34    36.68  
1 1 1 13  7   9  o 5  92.64   20.48  270.41    106.00   340.44   148.50   197.67    151.36   102.30  25.40  80.15   27.39  22.15   37.35  
1 1 1 13  7   10 o 11 259.79  58.06  2971.71   844.13   0.00     0.00     2971.71   844.13   ?       ?      259.79  58.06  0.00    58.06  
1 1 1 13  7   11 o 19 222.79  45.52  1929.45   562.51   0.00     0.00     1929.45   562.51   ?       ?      222.79  45.52  0.00    45.52  
1 1 1 13  7   12 o 18 257.81  65.72  3442.60   975.37   0.00     0.00     3442.60   975.37   ?       ?      257.81  65.72  0.00    65.72  
1 1 1 13  7   13 f 0  154.40  32.64  840.15    280.25   0.00     0.00     840.15    280.25   ?       ?      154.40  32.64  0.00    32.64  
1 1 1 13  7   14 o 16 151.90  20.59  728.34    174.94   679.28   240.33   783.63    255.12   139.12  30.90  149.94  30.68  -10.81  43.54  
1 1 1 13  7   15 f 0  138.92  20.48  612.56    158.46   624.57   212.08   597.38    238.41   134.76  28.32  128.40  32.36  6.36    43.00  
1 1 1 13  8   0  o 9  176.57  20.78  956.47    206.62   968.70   285.75   943.08    299.12   172.05  30.02  168.25  32.14  3.80    43.98  
1 1 1 13  8   1  o 7  107.32  17.72  352.14    105.35   297.38   140.34   422.84    159.46   96.09   25.15  114.89  24.90  -18.80  35.39  
1 1 1 13  8   2  o 15 187.34  21.73  1081.61   229.35   1080.23  319.24   1083.09   329.72   180.46  31.99  179.82  33.16  0.64    46.08  
1 1 1 13  8   3  o 12 190.99  22.71  1131.17   244.13   1275.90  340.96   978.90    349.72   196.93  31.20  167.42  37.34  29.51   48.66  
1 1 1 13  8   4  x 3  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 13  8   5  o 3  77.92   20.25  190.85    91.38    146.88   118.72   254.77    143.14   70.61   24.25  88.89   26.24  -18.28  35.73  
1 1 1 13  8   6  o 2  185.69  22.05  1069.87   230.50   1120.96  320.84   1015.38   331.36   183.36  31.62  171.85  34.78  11.50   47.01  
1 1 1 13  8   7  o 3  73.32   20.50  168.97    89.66    87.49    117.67   281.74    138.44   61.36   23.64  93.11   25.26  -31.75  34.60  
1 1 1 13  8   8  o 19 66.62   25.36  111.84    134.31   0.00     0.00     111.84    134.31   ?       ?      66.62   25.36  0.00    25.36  
1 1 1 13  8   9  o 9  200.40  39.06  1459.21   433.18   0.00     0.00     1459.21   433.18   ?       ?      200.40  39.06  0.00    39.06  
1 1 1 13  8   10 o 13 57.69   24.23  38.41     135.87   0.00     0.00     38.41     135.87   ?       ?      57.69   24.23  0.00    24.23  
1 1 1 13  8   11 o 3  138.36  31.26  665.26    242.46   0.00     0.00     665.26    242.46   ?       ?      138.36  31.26  0.00    31.26  
1 1 1 13  8   12 o 5  264.77  34.62  2491.30   513.58   2702.84  725.35   2278.63   727.28   246.79  52.79  216.05  57.59  30.74   78.13  
1 1 1 13  8   13 o 16 93.85   21.72  286.35    114.69   215.07   157.98   365.75    166.75   81.19   27.97  103.23  27.60  -22.05  39.30  
1 1 1 13  9   0  o 15 144.58  18.65  639.50    151.23   692.44   207.02   578.93    221.44   146.87  25.48  131.41  30.01  15.46   39.37  
1 1 1 13  9   1  o 10 177.31  21.16  972.95    211.16   991.95   291.39   951.94    306.42   172.75  30.50  167.16  33.10  5.58    45.01  
1 1 1 13  9   2  o 1  79.46   19.26  198.34    86.93    165.58   112.29   247.37    137.35   73.17   23.54  87.43   25.68  -14.26  34.84  
1 1 1 13  9   3  o 10 206.22  38.23  1509.94   435.90   1509.94  435.90   0.00      0.00     206.22  38.23  ?       ?      0.00    38.23  
1 1 1 13  9   4  o 15 219.96  43.20  1807.44   526.01   0.00     0.00     1807.44   526.01   ?       ?      219.96  43.20  0.00    43.20  
1 1 1 13  9   5  o 9  156.23  31.47  827.57    272.49   0.00     0.00     827.57    272.49   ?       ?      156.23  31.47  0.00    31.47  
1 1 1 13  9   6  o 8  72.54   26.27  151.73    140.77   0.00     0.00     151.73    140.77   ?       ?      72.54   26.27  0.00    26.27  
1 1 1 13  9   7  o 11 121.52  28.36  496.11    194.24   0.00     0.00     496.11    194.24   ?       ?      121.52  28.36  0.00    28.36  
1 1 1 13  9   8  o 12 93.28   28.58  292.17    167.47   0.00     0.00     292.17    167.47   ?       ?      93.28   28.58  0.00    28.58  
1 1 1 13  9   9  o 8  139.02  31.09  669.24    241.87   0.00     0.00     669.24    241.87   ?       ?      139.02  31.09  0.00    31.09  
1 1 1 13  9   10 o 12 173.63  22.09  955.48    215.18   1022.26  298.89   883.62    310.03   171.94  31.44  155.89  35.45  16.05   47.38  
1 1 1 13  9   11 o 15 63.49   22.01  119.95    97.85    78.36    131.90   170.84    145.92   61.23   24.59  74.69   26.79  -13.46  36.36  
1 1 1 13  10  2  o 2  60.40   24.47  65.74     132.01   0.00     0.00     65.74     132.01   ?       ?      60.40   24.47  0.00    24.47  
1 1 1 13  10  3  x 6  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 13  10  4  o 4  132.57  29.31  592.72    217.10   0.00     0.00     592.72    217.10   ?       ?      132.57  29.31  0.00    29.31  
1 1 1 13  10  5  o 9  129.53  29.38  568.41    213.42   0.00     0.00     568.41    213.42   ?       ?      129.53  29.38  0.00    29.38  
1 1 1 13  10  6  o 8  93.25   19.50  274.51    101.00   237.55   133.39   324.18    154.62   85.18   25.38  98.53   26.68  -13.35  36.83  
1 1 1 13  10  7  o 19 177.65  22.16  996.23    221.10   1049.86  305.24   937.04    320.70   174.84  31.57  161.34  35.58  13.50   47.57  
1 1 1 14  -7  0  o 16 108.19  31.08  419.68    203.18   419.68   203.18   0.00      0.00     108.19  31.08  ?       ?      0.00    31.08  
1 1 1 14  -7  1  o 17 156.45  34.48  895.85    301.29   895.85   301.29   0.00      0.00     156.45  34.48  ?       ?      0.00    34.48  
1 1 1 14  -7  2  o 5  122.31  21.29  479.29    144.05   447.54   204.48   510.56    202.98   112.15  30.82  120.89  29.51  -8.74   42.67  
1 1 1 14  -7  3  o 10 222.37  27.68  1654.45   345.74   1695.64  489.52   1613.46   488.39   206.40  42.72  199.57  43.83  6.83    61.21  
1 1 1 14  -6  0  o 4  64.26   26.04  85.41     149.39   85.41    149.39   0.00      0.00     64.26   26.04  ?       ?      0.00    26.04  
1 1 1 14  -6  1  o 13 107.02  30.54  402.40    196.89   402.40   196.89   0.00      0.00     107.02  30.54  ?       ?      0.00    30.54  
1 1 1 14  -6  2  o 8  141.83  21.10  636.90    166.56   642.06   238.66   632.00    232.56   135.20  31.36  134.57  30.78  0.64    43.94  
1 1 1 14  -6  3  o 8  121.75  22.01  475.62    148.18   461.29   215.82   488.40    203.81   113.91  31.80  118.46  29.96  -4.56   43.68  
1 1 1 14  -6  4  o 7  64.63   26.77  72.78     162.40   72.78    162.40   0.00      0.00     64.63   26.77  ?       ?      0.00    26.77  
1 1 1 14  -6  5  o 1  96.88   23.02  307.12    126.15   305.07   189.24   308.76    169.23   94.09   30.59  94.97   28.66  -0.89   41.91  
1 1 1 14  -6  6  o 15 60.67   21.45  106.11    93.21    142.73   163.62   88.52     113.42   72.42   27.89  60.19   23.21  12.23   36.28  
1 1 1 14  -6  7  f 0  48.19   19.33  41.74     81.41    30.34    118.14   52.05     112.35   53.49   22.54  55.12   22.49  -1.63   31.84  
1 1 1 14  -5  0  o 17 234.45  51.31  2343.63   671.38   2343.63  671.38   0.00      0.00     234.45  51.31  ?       ?      0.00    51.31  
1 1 1 14  -5  1  o 7  163.50  32.22  925.50    291.62   925.50   291.62   0.00      0.00     163.50  32.22  ?       ?      0.00    32.22  
1 1 1 14  -5  2  o 2  225.26  27.09  1658.65   343.31   1722.03  483.29   1594.10   487.77   214.37  40.76  203.03  43.18  11.34   59.38  
1 1 1 14  -5  3  o 14 135.25  20.87  575.27    156.85   659.67   223.71   493.66    219.98   139.90  28.82  118.79  31.68  21.11   42.82  
1 1 1 14  -5  4  o 17 76.01   23.71  184.61    114.68   220.88   166.43   151.82    158.24   83.05   28.71  73.54   27.64  9.51    39.85  
1 1 1 14  -5  5  o 5  137.30  21.24  595.16    162.03   518.98   228.51   672.19    229.78   121.26  32.26  140.65  29.41  -19.38  43.65  
1 1 1 14  -5  6  o 3  254.68  30.82  2200.77   441.52   2511.63  625.74   1892.57   623.07   252.54  44.80  206.54  52.46  46.00   68.99  
1 1 1 14  -5  7  o 17 83.02   20.87  221.63    99.37    194.73   146.90   244.31    134.92   78.41   26.97  85.97   25.50  -7.56   37.12  
1 1 1 14  -5  8  o 4  114.06  18.91  406.98    119.49   368.38   177.99   438.64    161.22   103.49  28.87  115.19  25.09  -11.70  38.25  
1 1 1 14  -5  9  o 3  69.49   21.31  152.93    93.06    124.16   144.23   173.44    121.82   68.46   26.23  74.03   24.57  -5.57   35.94  
1 1 1 14  -4  0  o 18 93.64   26.46  289.67    148.54   289.67   148.54   0.00      0.00     93.64   26.46  ?       ?      0.00    26.46  
1 1 1 14  -4  1  o 17 132.70  28.32  586.68    209.20   586.68   209.20   0.00      0.00     132.70  28.32  ?       ?      0.00    28.32  
1 1 1 14  -4  2  o 15 190.35  36.43  1281.88   383.54   1281.88  383.54   0.00      0.00     190.35  36.43  ?       ?      0.00    36.43  
1 1 1 14  -4  3  o 14 79.85   26.66  200.85    143.43   200.85   143.43   0.00      0.00     79.85   26.66  ?       ?      0.00    26.66  
1 1 1 14  -4  4  o 15 175.28  22.50  965.85    221.18   858.62   306.20   1082.85   319.83   155.90  35.07  177.95  32.50  -22.06  47.81  
1 1 1 14  -4  5  o 13 156.65  20.17  761.38    177.21   905.92   255.20   626.77    246.27   165.94  27.77  134.38  32.32  31.57   42.61  
1 1 1 14  -4  6  o 6  184.73  22.12  1071.67   229.90   1246.51  327.51   901.81    322.80   192.31  30.70  158.26  36.30  34.05   47.54  
1 1 1 14  -4  7  o 9  79.77   20.42  203.01    93.90    265.16   134.99   144.75    130.71   89.75   25.18  70.46   25.34  19.28   35.73  
1 1 1 14  -4  8  o 14 139.94  19.40  608.89    151.68   714.94   218.53   510.31    210.70   147.03  26.88  121.53  30.31  25.50   40.51  
1 1 1 14  -4  9  o 18 245.81  29.81  2033.38   412.13   2188.53  583.62   1879.06   582.07   235.12  44.88  211.32  48.95  23.80   66.40  
1 1 1 14  -4  10 o 6  63.60   24.62  99.75     127.96   0.00     0.00     99.75     127.96   ?       ?      63.60   24.62  0.00    24.62  
1 1 1 14  -3  0  o 17 258.22  30.97  2211.21   450.00   2371.03  633.75   2048.69   639.08   248.94  46.04  224.49  50.78  24.45   68.55  
1 1 1 14  -3  1  o 12 239.63  48.70  2260.46   647.04   2260.46  647.04   0.00      0.00     239.63  48.70  ?       ?      0.00    48.70  
1 1 1 14  -3  2  o 16 230.10  45.50  2014.48   579.65   2014.48  579.65   0.00      0.00     230.10  45.50  ?       ?      0.00    45.50  
1 1 1 14  -3  3  o 6  206.71  24.58  1351.41   285.99   1540.16  400.76   1155.52   408.26   212.51  34.00  177.06  40.98  35.45   53.24  
1 1 1 14  -3  4  o 8  128.89  19.97  515.21    142.99   635.73   195.28   375.91    209.95   140.67  25.10  105.04  31.96  35.63   40.64  
1 1 1 14  -3  5  o 6  187.73  22.17  1099.58   234.31   1158.57  331.11   1040.41   331.62   184.99  32.36  173.27  34.55  11.72   47.34  
1 1 1 14  -3  6  o 15 186.22  22.11  1083.36   231.78   1186.06  328.06   981.00    327.50   187.59  31.58  167.24  35.23  20.35   47.31  
1 1 1 14  -3  7  o 2  187.05  22.49  1098.13   236.62   1180.48  335.86   1016.96   333.43   185.84  32.67  169.88  35.34  15.96   48.13  
1 1 1 14  -3  8  o 13 183.25  22.08  1054.17   227.63   1202.04  322.91   908.10    320.94   188.68  30.88  159.19  35.97  29.49   47.41  
1 1 1 14  -3  9  o 4  213.95  25.53  1477.40   307.37   1722.40  437.04   1237.61   432.36   220.34  35.78  178.45  42.76  41.89   55.76  
1 1 1 14  -3  10 o 15 174.79  21.74  963.03    213.47   1096.29  303.14   831.96    300.64   179.43  30.52  151.79  35.19  27.64   46.58  
1 1 1 14  -3  11 x 13 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 14  -2  0  o 4  193.71  37.25  1314.82   399.23   0.00     0.00     1314.82   399.23   ?       ?      193.71  37.25  0.00    37.25  
1 1 1 14  -2  1  o 8  256.45  53.43  2682.93   761.00   2682.93  761.00   0.00      0.00     256.45  53.43  ?       ?      0.00    53.43  
1 1 1 14  -2  2  o 16 258.95  54.39  2761.14   782.71   2761.14  782.71   0.00      0.00     258.95  54.39  ?       ?      0.00    54.39  
1 1 1 14  -2  3  o 10 228.13  26.94  1664.30   346.03   1747.01  484.70   1578.33   494.17   221.70  39.53  206.78  43.03  14.92   58.44  
1 1 1 14  -2  4  o 10 93.15   19.85  271.94    102.87   251.53   151.48   289.41    140.14   88.23   27.21  94.42   25.33  -6.19   37.17  
1 1 1 14  -2  5  f 0  98.37   19.20  301.35    104.54   404.34   149.14   201.87    146.58   112.30  23.87  80.53   26.95  31.77   36.00  
1 1 1 14  -2  6  o 11 101.54  19.24  321.05    108.03   401.53   155.10   245.22    150.56   111.36  24.89  87.10   27.17  24.26   36.85  
1 1 1 14  -2  7  o 17 244.06  28.83  1944.62   396.20   2344.20  561.36   1548.01   559.26   255.68  39.52  194.52  49.86  61.16   63.62  
1 1 1 14  -2  8  o 10 160.90  20.42  802.47    184.38   960.22   262.59   649.06    258.95   171.34  27.64  136.42  33.35  34.92   43.31  
1 1 1 14  -2  9  o 13 168.83  21.05  889.03    199.63   872.81   281.47   905.44    283.19   159.61  31.84  162.99  31.41  -3.38   44.72  
1 1 1 14  -2  10 o 6  54.97   23.34  25.25     128.31   25.25    128.31   0.00      0.00     54.97   23.34  ?       ?      0.00    23.34  
1 1 1 14  -2  11 o 11 127.71  29.15  556.84    208.95   0.00     0.00     556.84    208.95   ?       ?      127.71  29.15  0.00    29.15  
1 1 1 14  -2  12 o 8  106.95  27.38  388.03    168.83   0.00     0.00     388.03    168.83   ?       ?      106.95  27.38  0.00    27.38  
1 1 1 14  -1  0  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 14  -1  1  o 16 88.65   25.88  253.11    139.84   253.11   139.84   0.00      0.00     88.65   25.88  ?       ?      0.00    25.88  
1 1 1 14  -1  2  o 19 163.91  30.83  890.46    279.47   890.46   279.47   0.00      0.00     163.91  30.83  ?       ?      0.00    30.83  
1 1 1 14  -1  3  o 2  403.06  64.34  7275.09   1438.65  7233.95  2033.49  7316.32   2035.62  293.20  100.38 296.09  100.45 -2.88   142.01 
1 1 1 14  -1  4  o 4  234.03  45.10  2040.31   583.95   2040.31  583.95   0.00      0.00     234.03  45.10  ?       ?      0.00    45.10  
1 1 1 14  -1  5  o 1  131.08  18.34  525.04    134.21   570.01   191.06   481.24    188.56   132.95  25.97  121.02  27.74  11.92   37.99  
1 1 1 14  -1  6  o 9  91.44   19.71  262.05    100.40   262.85   140.76   261.22    143.25   90.05   25.87  89.76   26.19  0.29    36.81  
1 1 1 14  -1  7  o 8  207.66  24.38  1360.31   285.10   1412.32  402.73   1308.07   403.65   201.57  36.13  192.11  37.95  9.46    52.40  
1 1 1 14  -1  8  o 17 139.00  19.06  594.46    148.06   606.50   206.72   581.77    212.18   135.86  27.45  132.20  28.78  3.67    39.77  
1 1 1 14  -1  9  o 15 157.27  20.11  765.74    177.45   733.28   252.99   797.17    248.95   146.95  30.97  154.77  29.09  -7.82   42.49  
1 1 1 14  -1  10 x 9  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 14  -1  11 o 6  191.56  37.60  1338.40   398.69   0.00     0.00     1338.40   398.69   ?       ?      191.56  37.60  0.00    37.60  
1 1 1 14  -1  12 o 4  198.08  40.19  1485.07   441.40   0.00     0.00     1485.07   441.40   ?       ?      198.08  40.19  0.00    40.19  
1 1 1 14  -1  13 o 13 167.63  21.82  891.16    205.00   973.61   290.62   809.49    289.22   167.43  31.39  149.60  34.40  17.84   46.57  
1 1 1 14  0   0  o 2  219.35  41.01  1719.81   497.44   1719.81  497.44   0.00      0.00     219.35  41.01  ?       ?      0.00    41.01  
1 1 1 14  0   1  o 3  103.60  26.66  349.72    159.47   349.72   159.47   0.00      0.00     103.60  26.66  ?       ?      0.00    26.66  
1 1 1 14  0   2  o 2  123.57  26.87  495.74    185.17   495.74   185.17   0.00      0.00     123.57  26.87  ?       ?      0.00    26.87  
1 1 1 14  0   3  o 16 168.06  20.40  866.52    192.78   825.82   276.84   904.83    268.61   157.24  31.77  166.56  29.15  -9.32   43.12  
1 1 1 14  0   4  o 7  198.59  23.02  1226.22   257.56   1224.49  362.14   1228.00   366.39   189.98  34.47  189.91  34.89  0.07    49.05  
1 1 1 14  0   5  o 12 135.37  18.38  559.07    139.16   550.31   192.77   568.62    201.09   130.31  26.67  132.11  27.41  -1.80   38.24  
1 1 1 14  0   6  o 6  85.26   20.44  229.15    98.75    234.63   135.16   222.87    144.62   85.54   25.56  83.79   26.69  1.74    36.96  
1 1 1 14  0   7  o 10 73.89   20.35  171.59    89.03    227.93   122.93   109.43    129.12   84.32   24.16  65.88   24.92  18.44   34.71  
1 1 1 14  0   8  o 7  235.16  27.81  1788.13   368.18   1942.15  521.21   1634.73   520.15   231.54  40.70  207.03  45.05  24.51   60.71  
1 1 1 14  0   9  o 15 102.54  26.10  346.11    154.03   346.11   154.03   0.00      0.00     102.54  26.10  ?       ?      0.00    26.10  
1 1 1 14  0   10 o 6  188.40  36.69  1266.47   382.54   0.00     0.00     1266.47   382.54   ?       ?      188.40  36.69  0.00    36.69  
1 1 1 14  0   11 o 19 103.42  27.59  360.42    166.79   0.00     0.00     360.42    166.79   ?       ?      103.42  27.59  0.00    27.59  
1 1 1 14  0   12 o 10 171.22  34.16  1041.29   323.95   0.00     0.00     1041.29   323.95   ?       ?      171.22  34.16  0.00    34.16  
1 1 1 14  0   13 o 3  218.81  47.62  1997.03   581.18   0.00     0.00     1997.03   581.18   ?       ?      218.81  47.62  0.00    47.62  
1 1 1 14  1   0  o 10 236.52  45.13  2069.08   590.48   2069.08  590.48   0.00      0.00     236.52  45.13  ?       ?      0.00    45.13  
1 1 1 14  1   1  o 5  303.43  97.04  6830.48   1909.58  6830.48  1909.58  0.00      0.00     303.43  97.04  ?       ?      0.00    97.04  
1 1 1 14  1   2  o 1  223.16  26.16  1574.94   328.72   1560.65  458.75   1590.02   471.27   210.67  39.38  211.85  40.22  -1.18   56.29  
1 1 1 14  1   3  o 15 69.74   20.73  150.52    89.06    188.32   116.35   97.02     138.41   77.59   23.83  65.62   25.55  11.97   34.94  
1 1 1 14  1   4  o 3  341.76  44.21  4257.07   847.06   4287.35  1196.66  4226.67   1199.19  294.74  71.47  290.94  72.15  3.80    101.56 
1 1 1 14  1   5  o 1  207.64  24.28  1351.39   283.98   1422.87  399.65   1278.49   403.60   204.15  35.38  190.83  38.18  13.33   52.05  
1 1 1 14  1   6  o 8  121.82  18.96  456.33    128.26   517.37   176.36   387.79    186.87   126.98  25.08  107.89  29.38  19.09   38.63  
1 1 1 14  1   7  o 17 292.25  35.98  2931.14   590.87   3169.68  835.01   2691.92   836.22   277.42  54.38  245.92  59.81  31.49   80.84  
1 1 1 14  1   8  o 7  185.19  22.21  1068.79   231.40   1152.35  326.07   984.02    328.44   185.24  31.81  168.19  35.15  17.05   47.41  
1 1 1 14  1   9  x 10 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 14  1   10 o 14 221.96  26.66  1594.87   332.88   1789.24  469.91   1399.09   471.62   223.17  38.04  189.93  44.10  33.24   58.24  
1 1 1 14  1   11 o 16 70.44   25.93  140.68    137.98   0.00     0.00     140.68    137.98   ?       ?      70.44   25.93  0.00    25.93  
1 1 1 14  1   12 o 10 131.06  29.65  589.62    217.86   0.00     0.00     589.62    217.86   ?       ?      131.06  29.65  0.00    29.65  
1 1 1 14  1   13 o 2  164.84  21.96  863.10    202.63   934.97   285.12   789.75    288.04   163.95  31.44  147.48  34.62  16.47   46.76  
1 1 1 14  2   0  o 4  77.96   26.80  182.84    145.00   182.84   145.00   0.00      0.00     77.96   26.80  ?       ?      0.00    26.80  
1 1 1 14  2   1  o 8  226.36  26.21  1621.34   334.27   1566.82  465.21   1679.53   480.62   210.42  39.97  218.15  39.85  -7.73   56.44  
1 1 1 14  2   2  o 3  261.65  30.72  2232.13   452.71   2332.05  638.79   2131.30   641.68   250.19  46.18  235.31  49.09  14.88   67.40  
1 1 1 14  2   3  o 17 271.64  31.98  2428.99   489.09   2405.50  692.17   2452.41   691.18   248.82  50.19  252.23  49.50  -3.41   70.50  
1 1 1 14  2   4  o 9  152.35  20.14  713.01    171.86   800.91   239.15   619.15    247.13   157.50  27.45  135.27  32.28  22.24   42.37  
1 1 1 14  2   5  o 10 122.94  19.00  464.44    129.78   491.27   179.68   435.17    187.67   123.17  26.22  114.69  28.60  8.48    38.80  
1 1 1 14  2   6  f 0  238.62  27.94  1831.81   375.50   1891.09  528.73   1771.47   533.37   228.35  41.88  218.37  44.07  9.97    60.79  
1 1 1 14  2   7  o 8  96.17   20.45  290.96    109.40   384.82   145.40   168.48    166.10   109.53  23.81  77.16   28.44  32.37   37.09  
1 1 1 14  2   8  o 19 126.17  27.49  524.44    193.45   524.44   193.45   0.00      0.00     126.17  27.49  ?       ?      0.00    27.49  
1 1 1 14  2   9  o 17 115.17  29.21  447.42    193.35   0.00     0.00     447.42    193.35   ?       ?      115.17  29.21  0.00    29.21  
1 1 1 14  2   10 o 14 116.05  20.46  423.30    131.31   384.05   179.28   468.73    192.88   106.56  28.68  117.79  28.77  -11.23  40.63  
1 1 1 14  2   11 o 3  117.57  28.53  469.06    190.54   0.00     0.00     469.06    190.54   ?       ?      117.57  28.53  0.00    28.53  
1 1 1 14  2   12 o 8  73.90   27.40  158.97    154.46   0.00     0.00     158.97    154.46   ?       ?      73.90   27.40  0.00    27.40  
1 1 1 14  2   13 o 7  206.89  25.43  1396.46   295.71   1379.79  416.81   1413.36   419.60   190.75  39.37  193.42  39.14  -2.67   55.51  
1 1 1 14  3   0  o 17 150.48  19.74  694.42    166.43   688.39   232.70   700.74    238.14   144.78  29.01  145.83  29.46  -1.05   41.35  
1 1 1 14  3   1  o 17 235.38  27.79  1774.63   368.27   1832.22  519.45   1716.43   522.20   225.75  41.62  216.21  43.58  9.54    60.26  
1 1 1 14  3   2  o 13 209.87  24.14  1378.44   285.56   1379.85  401.52   1377.00   406.22   200.28  36.26  199.57  36.81  0.71    51.67  
1 1 1 14  3   3  o 10 216.65  25.05  1477.81   305.85   1500.18  430.77   1455.08   434.33   207.74  37.50  203.49  38.59  4.25    53.81  
1 1 1 14  3   4  o 10 235.98  28.09  1790.49   373.10   2018.36  526.99   1561.50   528.29   238.73  39.86  202.27  46.47  36.46   61.23  
1 1 1 14  3   5  o 13 65.66   21.48  129.30    93.28    189.68   130.18   65.58     133.72   78.09   25.37  60.95   24.66  17.14   35.38  
1 1 1 14  3   6  o 19 176.81  22.06  972.15    219.01   1118.01  309.64   826.14    309.80   183.87  30.40  153.56  35.80  30.31   46.97  
1 1 1 14  3   7  o 13 56.18   21.40  74.08     95.64    207.44   133.59   -66.18    136.99   80.86   25.64  48.67   22.19  32.19   33.91  
1 1 1 14  3   8  x 19 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 14  3   9  o 12 261.16  31.79  2298.47   466.79   2346.91  657.09   2249.12   663.25   241.07  49.15  233.02  51.00  8.05    70.83  
1 1 1 14  3   10 o 8  180.33  36.80  1171.74   368.01   0.00     0.00     1171.74   368.01   ?       ?      180.33  36.80  0.00    36.80  
1 1 1 14  3   11 o 17 77.07   28.58  175.31    168.19   0.00     0.00     175.31    168.19   ?       ?      77.07   28.58  0.00    28.58  
1 1 1 14  3   12 o 6  194.09  40.91  1446.87   441.38   0.00     0.00     1446.87   441.38   ?       ?      194.09  40.91  0.00    40.91  
1 1 1 14  3   13 o 6  104.01  21.62  349.15    124.87   392.71   166.78   293.60    188.35   107.47  27.06  92.34   30.54  15.12   40.80  
1 1 1 14  4   0  o 18 158.16  20.38  770.71    180.74   769.12   253.48   772.34    257.78   152.27  30.07  152.26  30.55  0.00    42.87  
1 1 1 14  4   1  o 18 127.84  19.00  502.02    135.17   538.27   195.61   468.90    187.01   128.32  27.39  119.37  27.81  8.95    39.03  
1 1 1 14  4   2  o 1  208.95  24.44  1372.95   287.68   1439.62  402.72   1303.49   411.08   204.77  35.55  191.78  38.68  12.99   52.53  
1 1 1 14  4   3  o 13 162.34  19.71  807.95    179.89   745.72   251.15   873.51    257.77   149.75  30.26  163.60  28.48  -13.85  41.55  
1 1 1 14  4   4  o 11 125.81  18.12  484.07    127.07   456.69   174.37   515.07    185.55   118.38  26.34  125.80  26.53  -7.42   37.38  
1 1 1 14  4   5  o 1  69.67   23.90  143.71    115.31   143.71   115.31   0.00      0.00     69.67   23.90  ?       ?      0.00    23.90  
1 1 1 14  4   6  o 19 114.07  19.15  403.04    120.95   505.27   167.61   291.97    174.71   125.59  24.12  94.02   29.26  31.57   37.92  
1 1 1 14  4   7  o 1  233.77  47.58  2146.97   616.73   2146.97  616.73   0.00      0.00     233.77  47.58  ?       ?      0.00    47.58  
1 1 1 14  4   8  f 0  194.83  37.89  1365.40   408.57   0.00     0.00     1365.40   408.57   ?       ?      194.83  37.89  0.00    37.89  
1 1 1 14  4   9  o 13 198.87  39.36  1456.04   433.41   0.00     0.00     1456.04   433.41   ?       ?      198.87  39.36  0.00    39.36  
1 1 1 14  4   10 o 13 127.10  29.29  551.11    209.30   0.00     0.00     551.11    209.30   ?       ?      127.10  29.29  0.00    29.29  
1 1 1 14  4   11 o 6  173.50  35.61  1088.70   342.83   0.00     0.00     1088.70   342.83   ?       ?      173.50  35.61  0.00    35.61  
1 1 1 14  4   12 o 3  221.20  27.41  1624.08   340.56   1634.22  477.48   1613.58   485.88   204.50  42.08  201.49  43.30  3.01    60.37  
1 1 1 14  5   0  o 17 60.49   22.94  89.37     109.60   119.73   134.46   29.26     189.20   67.77   25.47  65.20   28.03  2.56    37.88  
1 1 1 14  5   1  o 17 150.25  19.62  694.88    165.20   673.77   231.99   716.59    235.30   142.33  29.37  147.22  28.87  -4.89   41.18  
1 1 1 14  5   2  o 11 267.00  31.86  2376.50   478.73   2353.83  675.16   2399.41   678.90   242.80  50.10  245.56  49.86  -2.76   70.69  
1 1 1 14  5   3  o 14 204.95  24.11  1324.77   278.20   1324.01  392.02   1325.54   394.85   194.44  36.46  194.27  36.75  0.16    51.77  
1 1 1 14  5   4  o 15 287.37  35.84  2855.78   578.40   2996.45  816.14   2713.84   819.84   265.76  55.30  246.35  58.79  19.40   80.71  
1 1 1 14  5   5  o 8  193.18  22.85  1170.74   248.47   1194.11  346.33   1145.95   356.67   186.57  33.57  180.85  35.62  5.73    48.95  
1 1 1 14  5   6  o 10 188.87  23.00  1122.94   244.18   1218.69  341.04   1022.22   349.79   189.03  32.61  168.80  37.11  20.23   49.40  
1 1 1 14  5   7  x 4  ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 14  5   8  f 0  259.39  65.57  3447.70   976.65   0.00     0.00     3447.70   976.65   ?       ?      259.39  65.57  0.00    65.57  
1 1 1 14  5   9  o 11 175.98  35.51  1109.50   346.35   0.00     0.00     1109.50   346.35   ?       ?      175.98  35.51  0.00    35.51  
1 1 1 14  5   10 o 6  189.41  38.52  1334.01   404.57   0.00     0.00     1334.01   404.57   ?       ?      189.41  38.52  0.00    38.52  
1 1 1 14  5   11 o 11 140.82  21.14  628.28    165.65   693.75   234.19   562.72    234.33   142.05  29.68  125.58  32.32  16.47   43.88  
1 1 1 14  6   0  o 4  89.07   21.52  253.39    108.79   269.29   154.85   237.89    152.87   90.48   27.43  85.71   27.46  4.76    38.82  
1 1 1 14  6   1  o 12 110.19  18.98  377.15    115.72   447.11   158.99   298.32    168.75   117.62  24.35  94.68   28.63  22.94   37.58  
1 1 1 14  6   2  f 0  138.61  19.07  592.46    147.70   556.73   203.39   632.33    214.83   129.31  28.20  138.13  28.05  -8.82   39.77  
1 1 1 14  6   3  o 9  99.47   20.09  311.64    110.74   273.77   150.04   356.95    164.13   91.15   26.86  103.54  27.25  -12.40  38.26  
1 1 1 14  6   4  o 15 92.20   20.88  270.52    107.96   319.94   146.71   212.15    159.44   98.55   25.68  82.02   28.11  16.53   38.07  
1 1 1 14  6   5  o 18 48.82   20.04  32.80     89.96    98.37    124.28   -39.38    130.39   63.37   24.33  49.31   22.14  14.06   32.90  
1 1 1 14  6   6  x 12 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 14  6   7  o 8  124.93  29.23  531.23    205.89   0.00     0.00     531.23    205.89   ?       ?      124.93  29.23  0.00    29.23  
1 1 1 14  6   8  o 2  256.94  69.09  3673.76   1041.11  0.00     0.00     3673.76   1041.11  ?       ?      256.94  69.09  0.00    69.09  
1 1 1 14  6   9  o 3  78.67   27.67  194.28    155.02   0.00     0.00     194.28    155.02   ?       ?      78.67   27.67  0.00    27.67  
1 1 1 14  6   10 o 17 97.77   21.17  307.35    115.37   334.52   155.49   274.07    172.09   99.51   26.68  89.99   29.16  9.52    39.52  
1 1 1 14  7   1  o 13 192.71  23.62  1175.90   255.84   1298.24  356.55   1046.05   367.33   194.45  33.13  168.96  38.71  25.49   50.95  
1 1 1 14  7   2  o 1  131.83  19.38  538.98    142.29   625.29   192.87   435.91    210.78   138.94  25.11  112.22  31.46  26.72   40.25  
1 1 1 14  7   3  o 4  135.15  19.45  566.69    146.56   607.83   197.70   516.48    218.39   136.16  26.24  122.34  31.05  13.82   40.65  
1 1 1 14  7   4  o 13 141.98  30.72  689.47    243.06   0.00     0.00     689.47    243.06   ?       ?      141.98  30.72  0.00    30.72  
1 1 1 14  7   5  o 4  91.05   28.64  276.94    166.96   0.00     0.00     276.94    166.96   ?       ?      91.05   28.64  0.00    28.64  
1 1 1 14  7   6  x 18 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
1 1 1 14  7   7  x 17 ?       ?      ?         ?        ?        ?        ?         ?        ?       ?      ?       ?      ?       ?      
# 
#END OF REFLECTIONS
