data_r6w52sf
# 
_audit.revision_id     1_0 
_audit.creation_date   2020-11-11 
_audit.update_record   "Initial release" 
# 
_cell.entry_id      6w52 
_cell.length_a      190.298 
_cell.length_b      190.298 
_cell.length_c      190.298 
_cell.angle_alpha   90.000 
_cell.angle_beta    90.000 
_cell.angle_gamma   90.000 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   1.0000 
# 
_entry.id   6w52 
# 
_exptl_crystal.id   1 
# 
_reflns_scale.group_code   1 
# 
_symmetry.entry_id               6w52 
_symmetry.space_group_name_H-M   "I 21 3" 
_symmetry.Int_Tables_number      199 
# 
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.pdbx_I_plus 
_refln.pdbx_I_plus_sigma 
_refln.pdbx_I_minus 
_refln.pdbx_I_minus_sigma 
_refln.pdbx_F_calc_with_solvent 
_refln.pdbx_phase_calc_with_solvent 
_refln.pdbx_FWT 
_refln.pdbx_PHWT 
_refln.pdbx_DELFWT 
_refln.pdbx_DELPHWT 
1 1 1 4  4  4  o 0 110.1   10.8  122.5  10.8 5041.07 -156.029     1916.29  23.9709     4938.76   23.9709      
1 1 1 1  4  5  o 0 278.2   10    277.3  10   3787.75 -141.09      101.689  -141.09     1971.71   38.9099      
1 1 1 2  5  5  o 0 475.4   18.9  457.9  18.9 2850.12 47.3613      1233.35  47.3613     303.606   -132.639     
1 1 1 4  5  5  o 0 187.6   7.8   201.5  7.8  3659.03 147.349      232.31   -32.651     2299.59   -32.651      
1 1 1 2  4  6  o 0 314     11.4  298.5  11.4 5802.23 173.472      794.817  -6.52788    3917.8    -6.52788     
1 1 1 1  6  3  o 0 867.1   29.2  875    29.2 4217.43 -63.1132     1713.53  -63.1132    581.141   116.887      
1 1 1 3  6  3  o 0 69.2    3.5   72.9   3.5  2558.39 -56.5125     549.094  123.488     1969.49   123.488      
1 1 1 3  5  6  o 0 866.5   34.5  839.9  34.5 1501.66 -16.7787     2776.19  -16.7787    1965.92   -16.7787     
1 1 1 2  6  4  o 0 631.7   23.1  648.1  23.1 3699.1  39.4114      1359.03  39.4114     635.139   -140.589     
1 1 1 4  6  4  o 0 571.7   24.7  555.8  24.7 2536.73 27.5765      1752.41  27.5765     316.398   27.5765      
1 1 1 4  6  6  o 0 339.1   13.7  356.4  13.7 2138.58 92.5913      1110.16  92.5913     54.8062   -87.4087     
1 1 1 1  2  7  o 0 280.4   10.1  285.8  10.1 3576.76 -168.969     226.004  -168.969    1719.62   11.0309      
1 1 1 1  4  7  o 0 299.2   10.5  305.3  10.5 4892.44 -36.2632     350.427  143.737     3015.07   143.737      
1 1 1 1  6  7  o 0 28.4    1.2   30     1.2  301.164 90.2799      102.796  -89.7201    266.021   -89.7201     
1 1 1 2  5  7  o 0 28      1.3   25.7   1.3  1001.88 -121.551     357.54   58.4489     892.182   58.4489      
1 1 1 2  7  3  o 0 646.6   23.3  634.3  23.3 3433.62 -108.853     1483.46  -108.853    362.648   71.1471      
1 1 1 4  5  7  o 0 841.7   33.6  821.1  33.6 3814.73 124.014      1810.31  124.014     258.222   -55.9864     
1 1 1 4  7  5  o 0 930.3   38.7  903.5  38.7 3379.99 -164.536     2237.17  -164.536    393.866   -164.536     
1 1 1 5  6  7  o 0 551.7   22.6  556.5  22.6 1769.68 98.664       1672.55  98.664      836.742   98.664       
1 1 1 1  7  6  o 0 957.2   31.6  967.6  31.6 1385.64 151.627      3057.53  151.627     2307.81   151.627      
1 1 1 3  7  6  o 0 344.9   14    362.3  14   1999.49 -150.345     1149.22  -150.345    87.4304   -150.345     
1 1 1 2  7  7  o 0 651.2   20.9  648.1  20.9 3178    91.9814      1603.08  91.9814     79.0822   -88.0186     
1 1 1 4  7  7  o 0 602.9   23.4  606.2  23.4 941.127 -87.9065     1724.79  -87.9065    1294.46   -87.9065     
1 1 1 6  7  7  o 0 743.6   26.5  722.9  26.5 4061.22 -133.058     1267.06  -133.058    669.041   46.9425      
1 1 1 1  8  1  o 0 785     29.2  796.6  29.2 2864.38 163.761      2133.61  163.761     597.834   163.761      
1 1 1 1  3  8  o 0 629.6   21.3  643.7  21.3 713.583 -56.1687     1941.68  -56.1687    1554.89   -56.1687     
1 1 1 1  5  8  o 0 1030.1  33.3  1029.2 33.3 3686.62 -81.8529     2328.74  -81.8529    333.73    -81.8529     
1 1 1 1  7  8  o 0 89.2    3.2   86.1   3.2  864.842 -136.253     14.2577  -136.253    385.72    43.747       
1 1 1 2  6  8  f 1 802.5   29.3  809.6  29.3 5210.42 -133.792     1003.9   -133.792    1767.31   46.2082      
1 1 1 3  8  3  < 0 11.9    0.7   13.6   0.7  ?       ?            1237.96  130.529     ?         ?            
1 1 1 3  5  8  o 0 234.5   10.1  238.7  10.1 4933.38 10.1733      637.423  -169.827    3245.4    -169.827     
1 1 1 3  7  8  o 0 240.3   9.3   225.5  9.3  2822.93 155.252      289.301  155.252     981.688   -24.7475     
1 1 1 2  8  4  o 0 370.9   13.1  361.5  13.1 4316.72 -102.202     186.448  -102.202    2109.62   77.7979      
1 1 1 4  8  4  f 1 676.1   27    687.7  27   1803.15 42.8839      2284.26  42.8839     1297.89   42.8839      
1 1 1 1  8  5  o 0 478.8   15.5  464.5  15.5 1565.28 166.163      1689.94  166.163     846.919   166.163      
1 1 1 3  8  5  o 0 856.3   29.8  842.2  29.8 2880.62 -43.1383     2244.89  -43.1383    717.121   -43.1383     
1 1 1 5  7  8  o 0 55.5    2.9   65     2.9  1105.75 -87.2059     147.381  92.7941     653.454   92.7941      
1 1 1 4  8  6  o 0 834.8   31.5  792.8  31.5 4824.21 108.056      1064.81  108.056     1141.99   -71.9442     
1 1 1 1  8  7  o 0 15.4    0.9   15.3   0.9  1457.46 141.081      546.556  -38.9187    1219.6    -38.9187     
1 1 1 3  8  7  o 0 401.6   15.8  378.2  15.8 1519.36 -145.978     1180.89  -145.978    496.443   -145.978     
1 1 1 4  8  8  o 0 907     34.2  884.8  34.2 6135.22 -54.6924     646.116  -54.6924    2102.04   125.308      
1 1 1 6  8  8  o 0 658.6   23    611.2  23   2923.59 172.85       1456.09  172.85      113.217   172.85       
1 1 1 8  8  8  o 0 450.5   37    458.2  37   3582.21 -51.4047     389.272  -51.4047    1756.21   128.595      
1 1 1 2  7  9  o 0 152.6   5.9   160.6  5.9  2166.53 89.7972      170.33   89.7972     806.114   -90.2028     
1 1 1 2  9  3  o 0 262.1   9.8   265.9  9.8  3938.99 -172.802     31.6317  7.19751     2115.2    7.19751      
1 1 1 3  6  9  f 1 816.8   30.2  848.3  30.2 3055.66 167.852      1794.69  167.852     414.931   167.852      
1 1 1 3  9  4  o 0 445     16.3  442    16.3 2304.33 39.5278      1354.06  39.5278     136.53    39.5278      
1 1 1 4  7  9  o 0 946.5   38.3  953.8  38.3 1964.75 157.022      2390.64  157.022     1512.55   157.022      
1 1 1 5  8  9  o 0 123.5   5.5   120.6  5.5  2170.43 127.139      11.9578  -52.8607    1221.87   -52.8607     
1 1 1 3  9  6  f 1 237.9   9     237.3  9    698.112 9.86432      525.567  9.86432     209.847   9.86432      
1 1 1 6  7  9  o 0 209.2   9     209.5  9    2631.77 -110.661     331.301  -110.661    1173.28   69.339       
1 1 1 2  9  7  o 0 1065.5  33    995.2  33   5197.46 52.511       1309.73  52.511      1030.5    -127.489     
1 1 1 4  9  7  o 0 1026.1  38.4  1022.4 38.4 5208.95 -170.538     1284.5   -170.538    1048.5    9.46201      
1 1 1 6  9  7  o 0 713.1   27.6  698.1  27.6 916.311 -95.5903     2456.55  -95.5903    1930.35   -95.5903     
1 1 1 1  9  8  o 0 181.3   6.3   176.5  6.3  2265.21 -131.445     249.779  -131.445    784.331   48.5548      
1 1 1 3  9  8  o 0 1054.1  34.7  1020.1 34.7 3265.22 3.06854      2089.63  3.06854     639.769   3.06854      
1 1 1 7  9  8  o 0 256.9   10.2  244.5  10.2 2170.71 -13.1594     728.496  -13.1594    518.889   166.841      
1 1 1 2  9  9  o 0 227.4   7.7   221    7.7  1535.82 157.125      739.505  157.125     115.336   -22.8746     
1 1 1 4  9  9  o 0 591.2   23.1  575.8  23.1 4020.45 99.5516      1061.5   99.5516     1147.23   -80.4484     
1 1 1 6  9  9  o 0 260     10.5  259.9  10.5 1582.33 -51.1389     905.546  -51.1389    24.7141   -51.1389     
1 1 1 8  9  9  o 0 449.8   18.3  480.7  18.3 3290.3  105.393      1094.63  105.393     791.482   -74.6067     
1 1 1 1  7  10 o 0 610.3   20.2  601.6  20.2 3248.08 -140.279     1250.55  -140.279    231.642   39.7206      
1 1 1 2  10 2  o 0 157.9   5.6   150.8  5.6  2000.48 -90.6152     236.123  -90.6152    813.857   89.3848      
1 1 1 2  4  10 o 0 78.9    3.2   88     3.2  719.546 -100.053     3.85134  -100.053    320.976   79.9473      
1 1 1 1  10 3  f 1 982.6   29    973.2  29   5496.81 91.7226      1083.99  91.7226     1438.29   -88.2774     
1 1 1 3  5  10 o 0 1017.3  33.7  1031.9 33.7 5442.02 -55.3151     1183.66  -55.3151    1247.92   124.685      
1 1 1 3  9  10 o 0 291.1   10.5  307.5  10.5 2974.49 -104.798     577.764  -104.798    1047.83   75.2021      
1 1 1 2  10 4  o 0 667.7   23.3  640.4  23.3 3700.27 -89.6152     1168.8   -89.6152    499.033   90.3848      
1 1 1 4  10 6  o 0 51      2.3   54.6   2.3  1386.21 161.899      246.574  -18.1009    865.838   -18.1009     
1 1 1 6  10 6  o 0 406.4   17.3  427.8  17.3 4497.68 -122.896     297.434  -122.896    2278      57.1039      
1 1 1 6  8  10 o 0 161.4   6.8   149    6.8  1895.19 132.215      285.958  132.215     765.943   -47.7853     
1 1 1 7  10 7  o 0 344     14.4  348.9  14.4 2818.93 18.4677      876.675  18.4677     741.034   -161.532     
1 1 1 2  10 8  o 0 129.5   4.3   115.3  4.3  876.682 168.351      198.483  168.351     288.633   -11.6494     
1 1 1 7  10 9  o 0 127.5   5.2   135.6  5.2  2250.47 -48.3765     24.0444  -48.3765    1225.23   131.624      
1 1 1 2  10 10 o 0 125.3   4.5   122.2  4.5  3077.8  -67.7592     364.464  112.241     2053.01   112.241      
1 1 1 8  10 10 o 0 585.2   21.6  593.7  21.6 2921.44 -80.9425     1761.69  -80.9425    4.39189   -80.9425     
1 1 1 1  2  11 o 0 406.5   13.7  404.5  13.7 4202.54 141.405      326.405  141.405     1587.19   -38.5954     
1 1 1 1  4  11 o 0 49.2    2.1   50.1   2.1  2193.96 108.883      499.509  -71.1171    1499.92   -71.1171     
1 1 1 1  6  11 o 0 988.1   32.6  984.5  32.6 4246.1  -158.322     1642.09  -158.322    286.308   21.6781      
1 1 1 1  8  11 o 0 77.6    2.9   72.6   2.9  3874.33 1.88477      1125.4   -178.115    3303.32   -178.115     
1 1 1 1  11 2  o 0 345.5   10.7  335.6  10.7 1597.1  -121.907     1016.41  -121.907    295.715   -121.907     
1 1 1 2  3  11 o 0 219.2   7.2   207.8  7.2  3986.34 138.813      237.564  -41.1868    2022.79   -41.1868     
1 1 1 2  5  11 o 0 773.6   24.7  765.4  24.7 3671.45 -87.0875     1422.07  -87.0875    218.076   92.9125      
1 1 1 2  11 3  o 0 243.3   7.8   225.9  7.8  3173.33 123.454      165.416  123.454     1253.34   -56.5457     
1 1 1 3  4  11 o 0 517.6   17.4  518.8  17.4 4122.16 87.6739      655.061  87.6739     1173.88   -92.3261     
1 1 1 3  6  11 o 0 1047.9  36.8  1058.6 36.8 4500.04 170.302      2011.98  170.302     466.609   -9.69754     
1 1 1 1  11 4  o 0 163.2   5.3   148.5  5.3  1248.07 -174.028     321.17   -174.028    243.387   5.97192      
1 1 1 3  11 4  o 0 1013.2  35.9  1017.3 35.9 4932.5  -66.6419     1376.8   -66.6419    818.516   113.358      
1 1 1 4  9  11 o 0 520.8   21.8  515.9  21.8 788.936 179.389      1659.66  179.389     1234.72   179.389      
1 1 1 2  11 5  o 0 1034.1  32.6  1016.6 32.6 4125.02 -38.5935     1732.81  -38.5935    105.604   141.407      
1 1 1 4  11 5  o 0 677.4   24.3  659.5  24.3 5142.82 124.721      590.969  124.721     1694.81   -55.2786     
1 1 1 5  6  11 o 0 320.6   13.6  342.4  13.6 2706.33 74.7469      834.568  74.7469     658.793   -105.253     
1 1 1 5  10 11 o 0 201.2   8     193.2  8    2093.28 -124.844     444.88   -124.844    671.528   55.1558      
1 1 1 3  11 6  o 0 242.7   7.9   227    7.9  1663.6  -93.7392     765.188  -93.7392    152.011   86.2608      
1 1 1 6  9  11 o 0 341.7   13.7  304.5  13.7 1507.97 107.623      1162.79  107.623     347.506   107.623      
1 1 1 4  11 7  o 0 922.7   30.3  912.1  30.3 4667.26 27.7286      1606.18  27.7286     949.515   -152.271     
1 1 1 6  11 7  f 1 370.8   15.2  377.6  15.2 3809.95 136.168      470.309  136.168     1657.01   -43.8322     
1 1 1 1  11 8  o 0 210.8   7.1   200.4  7.1  1527.72 59.7999      650.141  59.7999     205.952   -120.2       
1 1 1 3  11 8  o 0 309.3   9.7   304.2  9.7  1382.64 -40.3571     1110.79  -40.3571    356.819   -40.3571     
1 1 1 5  11 8  o 0 476.4   17.4  509.3  17.4 2567.32 -57.0998     1454.54  -57.0998    56.2182   -57.0998     
1 1 1 7  11 8  o 0 290.8   11.9  282.9  11.9 1239.64 -114.163     1039.03  -114.163    351.865   -114.163     
1 1 1 8  9  11 o 0 794.4   30.5  742.8  30.5 1933.51 -31.5325     2734.11  -31.5325    1574.62   -31.5325     
1 1 1 4  11 9  o 0 50      2.5   41.1   2.5  2226.89 -83.5599     639.941  96.4401     1840.33   96.4401      
1 1 1 8  11 9  o 0 454.1   17.9  446.7  17.9 1806.47 52.3348      1750.13  52.3348     663.539   52.3348      
1 1 1 9  10 11 o 0 237.5   9.7   226.4  9.7  788.905 -161.92      723.328  -161.92     252.571   -161.92      
1 1 1 3  11 10 o 0 44.2    1.9   45.6   1.9  979.417 -17.1395     240.414  162.86      767.022   162.86       
1 1 1 5  11 10 o 0 562.9   22.4  574.5  22.4 3649.95 136.177      1166.76  136.177     781.083   -43.8231     
1 1 1 7  11 10 o 0 897.5   32.9  909.6  32.9 2478.15 57.4652      2811.23  57.4652     1357.81   57.4652      
1 1 1 1  5  12 o 0 1070.7  36.7  1048.7 36.7 4718.21 -103.604     1956.85  -103.604    699.965   76.3962      
1 1 1 1  7  12 o 0 872.3   28.3  870.2  28.3 3021.16 -12.1882     2357.23  -12.1882    667.051   -12.1882     
1 1 1 1  9  12 o 0 875.8   28.9  865.8  28.9 3049.09 -148.246     2315.69  -148.246    629.748   -148.246     
1 1 1 2  12 2  o 0 134     4.5   135    4.5  643.917 139.755      172.508  139.755     112.439   -40.2451     
1 1 1 2  8  12 o 0 817.2   27.5  827.6  27.5 3529.62 64.9857      1941.92  64.9857     13.2692   64.9857      
1 1 1 3  5  12 o 0 100.9   3.7   95     3.7  3230.93 -2.53045     611.96   177.47      2379.35   177.47       
1 1 1 2  12 4  o 0 854.6   27.9  871    27.9 2852.44 46.5806      1907.85  46.5806     647.241   46.5806      
1 1 1 4  12 4  o 0 224.5   8.4   223.4  8.4  3012.28 -47.4849     225.617  -47.4849    1434.58   132.515      
1 1 1 4  6  12 o 0 665.1   27    677.4  27   4349.5  51.7227      1132.64  51.7227     1228.5    -128.277     
1 1 1 4  10 12 o 0 547.8   20.3  554.2  20.3 3768.7  1.22265      1141.61  1.22265     1028.56   -178.777     
1 1 1 1  12 5  o 0 541.6   17.7  545    17.7 2468.95 -5.57521     1696.29  -5.57521    315.921   -5.57521     
1 1 1 3  12 5  o 0 368.6   13.6  374.3  13.6 3950.7  173.222      394.879  173.222     1769.1    -6.7778      
1 1 1 5  11 12 o 0 13.2    1.3   17.1   1.3  1419.05 173.781      655.002  -6.21897    1461.8    -6.21897     
1 1 1 2  12 6  o 0 222.3   7.2   223.2  7.2  3432.87 43.8524      23.3169  43.8524     1864.21   -136.148     
1 1 1 4  12 6  o 0 369.7   13.4  383.1  13.4 768.994 156.776      1192.13  156.776     773.204   156.776      
1 1 1 6  12 6  o 0 698.3   28.4  724.5  28.4 4602.1  -121.038     1132.51  -121.038    1408.28   58.9619      
1 1 1 6  8  12 o 0 67.3    3.6   73     3.6  1541.04 111.592      205.235  -68.4084    1034.45   -68.4084     
1 1 1 5  12 7  f 1 226.6   9.9   259.6  9.9  2638.02 -60.225      471.249  -60.225     967.995   119.775      
1 1 1 4  12 8  f 1 166.3   5.8   161.8  5.8  2619.21 162.941      72.6236  162.941     1342.98   -17.059      
1 1 1 2  12 10 o 0 646     21    643.1  21   3557.75 -144.627     1439.01  -144.627    477.704   35.3728      
1 1 1 3  12 11 o 0 407.1   14    432    14   3618    118.975      769.734  118.975     1311.58   -61.0247     
1 1 1 5  12 11 o 0 88.7    4.2   85.9   4.2  1298.04 0.726654     35.2806  -179.273    773.599   -179.273     
1 1 1 9  12 11 o 0 635.4   23.2  629.6  23.2 2776.52 23.9282      1887.87  23.9282     287.35    23.9282      
1 1 1 2  12 12 o 0 750     25.7  786.9  25.7 4770.97 18.4985      1251.34  18.4985     1501.23   -161.502     
1 1 1 4  12 12 o 0 644.2   21.7  632.6  21.7 1243.37 -155.101     2329.14  -155.101    1626.34   -155.101     
1 1 1 1  2  13 o 0 511.8   16.9  499.7  16.9 2601.19 35.5741      1512.34  35.5741     65.0484   35.5741      
1 1 1 1  4  13 o 0 178.7   6.5   167.6  6.5  600.424 -5.92512     352.435  -5.92512    17.8838   -5.92512     
1 1 1 1  6  13 o 0 891.2   29.6  886.4  29.6 4151.65 -172.981     1825.09  -172.981    479.701   7.01918      
1 1 1 1  13 2  o 0 345.6   10.8  339.1  10.8 2075.14 -135.298     1124.36  -135.298    20.2691   44.7019      
1 1 1 2  3  13 f 1 51.7    2.1   50     2.1  713.93  -139.184     146.668  40.8161     540.033   40.8161      
1 1 1 2  13 3  f 1 18.3    0.8   15.7   0.8  1408.1  100.691      612.309  -79.3093    1386.08   -79.3093     
1 1 1 3  8  13 o 0 146.2   5.6   140.7  5.6  1816.49 17.7468      225.232  17.7468     744.895   -162.253     
1 1 1 3  10 13 o 0 33.8    1.9   38.7   1.9  1836.4  -17.1216     626.297  162.878     1680.41   162.878      
1 1 1 3  12 13 f 1 121     4.8   118.3  4.8  2783.76 -165.07      277.901  14.93       1856.98   14.93        
1 1 1 1  13 4  o 0 364.1   12.2  367.2  12.2 1459.11 171.253      1361.83  171.253     555.185   171.253      
1 1 1 3  13 4  o 0 837.2   26.7  812.3  26.7 4699.99 79.8627      1354.2   79.8627     1197.69   -100.137     
1 1 1 2  13 5  o 0 604.6   19    565.8  19   2290.66 -26.456      1852.62  -26.456     603.892   -26.456      
1 1 1 4  13 5  o 0 217.9   8.3   216.9  8.3  1838.46 -71.3643     626.222  -71.3643    367.816   108.636      
1 1 1 5  6  13 o 0 162.6   6.1   153.7  6.1  2952.55 -111.963     93.5046  68.0372     1676.16   68.0372      
1 1 1 5  8  13 f 1 249.4   11    251.5  11   2798.16 -16.4693     459.531  -16.4693    1162.17   163.531      
1 1 1 5  10 13 o 0 614.2   25.1  581.5  25.1 3244.82 108.543      1531.73  108.543     308.204   -71.4568     
1 1 1 5  12 13 < 0 9.8     1.4   10.5   1.4  ?       ?            677.919  -17.4069    ?         ?            
1 1 1 1  13 6  o 0 431.4   14.2  436.3  14.2 1419.1  155.802      1616.08  155.802     833.031   155.802      
1 1 1 5  13 6  o 0 274.4   10.5  278.9  10.5 2966.93 -29.8789     477.868  -29.8789    1121.39   150.121      
1 1 1 6  7  13 o 0 335     14.1  340.5  14.1 2656.14 156.154      852.192  156.154     566.996   -23.8463     
1 1 1 2  13 7  o 0 121.4   4.3   130.8  4.3  1957.21 125.801      82.3002  125.801     978.401   -54.199      
1 1 1 7  8  13 o 0 46      2.6   41.8   2.6  2495    117.418      822.588  -62.5821    2269.84   -62.5821     
1 1 1 1  13 8  o 0 1039.1  34.2  1081.4 34.2 3002.4  16.1824      2754.26  16.1824     1108.63   16.1824      
1 1 1 5  13 8  f 1 182.4   6.7   173.7  6.7  1496.14 -145.44      519.424  -145.44     350.214   34.5602      
1 1 1 7  13 8  o 0 332.6   13.9  339.5  13.9 4865.13 -170.271     216.177  9.72889     3052.83   9.72889      
1 1 1 2  13 9  o 0 925.6   30.2  944.4  30.2 4971.29 -125.677     1461.36  -125.677    1206.05   54.3229      
1 1 1 4  13 9  o 0 666.2   21.5  658.9  21.5 3671.25 -1.00773     1528.86  -1.00773    579.624   178.992      
1 1 1 9  10 13 o 0 579.9   24.1  585.3  24.1 2254.8  163.707      1954.15  163.707     660.544   163.707      
1 1 1 1  13 10 o 0 222.5   7.6   206.6  7.6  1274.23 64.4681      749.414  64.4681     2.35813   -115.532     
1 1 1 10 11 13 o 0 115.1   5.5   115.1  5.5  1728.84 86.8264      72.3297  86.8264     910.582   -93.1736     
1 1 1 2  13 11 o 0 110.9   4.2   110.7  4.2  3560.64 -179.464     709.436  0.536254    2760.55   0.536254     
1 1 1 4  13 11 o 0 739.6   29.3  722.1  29.3 2396.18 -53.8415     2294.97  -53.8415    941.867   -53.8415     
1 1 1 6  13 11 f 1 351.4   12.7  350.4  12.7 1659.31 66.5953      1292.91  66.5953     356.153   66.5953      
1 1 1 8  13 11 o 0 773.9   28.6  790.3  28.6 4392.06 -48.1765     1457.04  -48.1765    1019.22   131.824      
1 1 1 10 13 11 o 0 379.3   15.3  372.2  15.3 2670.61 89.0303      1052.54  89.0303     468.311   -90.9697     
1 1 1 11 12 13 o 0 154.8   6.7   141.4  6.7  1972    -155.56      243.147  -155.56     961.057   24.44        
1 1 1 3  13 12 f 1 911.4   29.4  907.7  29.4 4238.82 119.366      1847.93  119.366     556.419   -60.6341     
1 1 1 6  13 13 o 0 208.5   8.7   200.8  8.7  2820.47 62.5727      213.896  62.5727     1331.79   -117.427     
1 1 1 8  13 13 o 0 594.1   21.7  579.2  21.7 1726.39 -59.6438     2227.69  -59.6438    1200.04   -59.6438     
1 1 1 12 13 13 o 0 150     7.9   131.8  7.9  1523.88 166.151      304.821  166.151     611.631   -13.8493     
1 1 1 1  14 1  o 0 311.6   9.7   305.3  9.7  1854.12 34.9389      1037.77  34.9389     30.2428   34.9389      
1 1 1 1  3  14 o 0 378.5   12.8  381    12.8 2169.31 -45.8349     1231.63  -45.8349    38.706    -45.8349     
1 1 1 2  14 2  o 0 49.5    2     50.5   2    542.788 173.034      109.905  -6.96552    402.771   -6.96552     
1 1 1 2  4  14 o 0 311.3   10.4  307.7  10.4 2402.32 19.7933      853.677  19.7933     445.875   -160.207     
1 1 1 2  10 14 o 0 114.1   4.1   105.1  4.1  777.035 140.972      131.848  140.972     314.494   -39.0283     
1 1 1 3  7  14 o 0 521.1   16.9  507    16.9 2399.87 -57.4646     1548.27  -57.4646    275.345   -57.4646     
1 1 1 3  11 14 o 0 267.3   9.9   268.9  9.9  2741.32 -115.782     562.751  -115.782    979.976   64.2178      
1 1 1 3  13 14 o 0 607.6   21.2  616.8  21.2 3876.32 -108.834     1223.58  -108.834    916.065   71.1665      
1 1 1 4  14 4  o 0 486.8   16.3  499.5  16.3 4275.57 -167.576     637.352  -167.576    1651.67   12.424       
1 1 1 4  6  14 o 0 381.4   12.9  377.8  12.9 2646.36 -68.4666     1002.07  -68.4666    398.248   111.533      
1 1 1 4  10 14 o 0 157     6.5   161.4  6.5  2366.28 147.621      155.113  147.621     1175.97   -32.3794     
1 1 1 1  14 5  o 0 760.3   23.9  758.9  23.9 4352.43 150.518      1372.81  150.518     1002.23   -29.4821     
1 1 1 5  7  14 o 0 279.1   12.2  285.3  12.2 1344.86 19.4603      1055.38  19.4603     285.969   19.4603      
1 1 1 5  13 14 o 0 415     15.8  381.9  15.8 1633.36 -50.8315     1438.71  -50.8315    551.37    -50.8315     
1 1 1 4  14 6  o 0 158.4   6.1   147.6  6.1  2216.33 -134.352     163.728  -134.352    1012.25   45.6482      
1 1 1 6  10 14 o 0 435.9   18.6  425.6  18.6 4205.43 -136.549     488.879  -136.549    1860.2    43.4505      
1 1 1 6  12 14 o 0 194.3   9     200.4  9    2679.73 132.019      236      132.019     1230.34   -47.9808     
1 1 1 1  14 7  f 1 351.6   11.9  353.5  11.9 2757.35 -97.0214     873.699  -97.0214    633.023   82.9786      
1 1 1 3  14 7  o 0 938.9   31.7  908.9  31.7 3219.72 88.291       2266.76  88.291      559.214   88.291       
1 1 1 5  14 7  o 0 922.1   32    911.5  32   3685.91 -139.676     2200.95  -139.676    84.1154   -139.676     
1 1 1 7  13 14 o 0 478.3   18.6  442.5  18.6 2789.04 121.066      1349.78  121.066     286.484   -58.9344     
1 1 1 2  14 8  o 0 590.1   19.3  594.4  19.3 3912.52 134.818      1206.89  134.818     1065.24   -45.1824     
1 1 1 4  14 8  o 0 28.4    1.6   30.5   1.6  1699.06 38.9782      639.34   -141.022    1609.93   -141.022     
1 1 1 6  14 8  o 0 434     18.4  462.4  18.4 2464.76 -82.5648     1413.99  -82.5648    7.33888   -82.5648     
1 1 1 8  10 14 o 0 506.7   21.1  504.2  21.1 2890.39 -49.809      1391.9   -49.809     227.935   130.191      
1 1 1 1  14 9  o 0 337.1   11.9  344.8  11.9 2796.05 -136.146     884.26   -136.146    755.553   43.8543      
1 1 1 3  14 9  f 1 554.6   16.9  533.3  16.9 1759.85 -133.567     1991.42  -133.567    980.433   -133.567     
1 1 1 9  14 9  f 1 625.8   26.7  667.2  26.7 1745.67 150.678      2318.67  150.678     1313.47   150.678      
1 1 1 4  14 10 o 0 898.4   28.8  882    28.8 4315.62 -125.576     1769.54  -125.576    659.669   54.424       
1 1 1 6  14 10 o 0 350.9   12.6  338.5  12.6 2887.99 88.2064      817.31   88.2064     799.132   -91.7936     
1 1 1 8  14 10 o 0 570.8   22.6  563.1  22.6 3478.99 8.01039      1308.46  8.01039     646.87    -171.99      
1 1 1 10 14 10 o 0 86.2    4.4   82.9   4.4  1989.84 153.231      252.959  -26.7692    1480.38   -26.7692     
1 1 1 10 12 14 o 0 119.8   5.6   110.6  5.6  2232.29 15.7423      85.7289  -164.258    1417.82   -164.258     
1 1 1 5  14 11 o 0 646.5   22.6  647.1  22.6 3408.85 -21.5187     1562.02  -21.5187    330.414   158.481      
1 1 1 9  14 11 f 1 22.3    2     24.9   2    1630.81 -112.842     714.188  67.1578     1706.09   67.1578      
1 1 1 11 14 11 f 1 740.9   29.2  734.6  29.2 3819.4  -159.082     1754.31  -159.082    587.246   20.918       
1 1 1 11 13 14 o 0 41.3    2.8   46.1   2.8  594.809 -70.8814     158.667  109.119     508.64    109.119      
1 1 1 2  14 12 o 0 897     29.3  906.2  29.3 3857.8  -126.044     2038.27  -126.044    138.657   53.9559      
1 1 1 4  14 12 o 0 361.1   11.4  357.2  11.4 2055.93 175.978      1199.01  175.978     62.6254   175.978      
1 1 1 6  14 12 o 0 422.6   15.2  424.7  15.2 2788.71 -106.322     1133.19  -106.322    393.937   73.6777      
1 1 1 12 14 12 o 0 594.6   22.5  565.1  22.5 2174.23 136.454      2070.7   136.454     764.527   136.454      
1 1 1 1  14 13 o 0 207     7.6   210.2  7.6  2480.6  102.589      388.258  102.589     1018.19   -77.411      
1 1 1 3  14 13 o 0 137     4.8   124.8  4.8  2730.6  -40.2737     166.863  139.726     1674.11   139.726      
1 1 1 11 14 13 o 0 292     12.3  287.4  12.3 1547.84 46.7273      1105.15  46.7273     194.08    46.7273      
1 1 1 13 14 13 o 0 76.5    5.6   78.1   5.6  365.561 -12.9832     67.4358  -12.9832    141.463   167.017      
1 1 1 4  14 14 o 0 181.1   6.9   188.2  6.9  2123.66 -19.7078     407.672  -19.7078    840.602   160.292      
1 1 1 6  14 14 o 0 744.1   27.8  717.2  27.8 3507.58 -102.877     1825.55  -102.877    211.66    77.1225      
1 1 1 8  14 14 o 0 590.8   22    592.9  22   2064.43 -69.5194     2071.09  -69.5194    877.778   -69.5194     
1 1 1 12 14 14 o 0 126.7   7     95.4   7    1518.35 -156.746     290.092  -156.746    560.204   23.2541      
1 1 1 1  2  15 o 0 209.4   7.6   233.7  7.6  1391.1  136.087      721.549  136.087     31.5844   -43.9128     
1 1 1 1  4  15 o 0 473.1   16    476.5  16   2070.66 96.2909      1578.71  96.2909     456.012   96.2909      
1 1 1 1  6  15 f 1 285.6   10.5  286.6  10.5 1227.67 -174.149     1099.29  -174.149    372.604   -174.149     
1 1 1 1  8  15 o 0 604.2   19.1  627.9  19.1 2442.37 -62.1439     2014.68  -62.1439    589.06    -62.1439     
1 1 1 1  10 15 o 0 284.6   9.8   295.5  9.8  705.608 38.2219      882.554  38.2219     476.108   38.2219      
1 1 1 1  14 15 o 0 309.2   10.8  305.2  10.8 2172.63 -118.543     1032.77  -118.543    273.795   61.457       
1 1 1 2  3  15 o 0 248.7   8.5   252.2  8.5  2649.66 43.0205      494.608  43.0205     920.164   -136.979     
1 1 1 2  5  15 o 0 458.3   15.7  444.4  15.7 2704.73 -62.1195     1231.68  -62.1195    209.925   117.88       
1 1 1 2  9  15 o 0 55      2.3   51.3   2.3  1754.63 53.4544      429.29   -126.546    1431.18   -126.546     
1 1 1 2  13 15 o 0 214.4   7.7   204.1  7.7  1718    152.295      680.629  152.295     349.709   -27.7052     
1 1 1 3  6  15 o 0 520.1   16.8  505.3  16.8 3180.29 135.944      1307.39  135.944     513.279   -44.0564     
1 1 1 3  8  15 o 0 884.5   29.8  852.3  29.8 2432.39 -134.255     2652.88  -134.255    1272.63   -134.255     
1 1 1 3  14 15 f 1 49      2.9   45.6   2.9  373.8   99.8003      88.779   -80.1997    309.079   -80.1997     
1 1 1 1  15 4  o 0 1012.5  30.6  1028.6 30.6 5396.17 -43.6685     1441.79  -43.6685    1464.14   136.331      
1 1 1 3  15 4  o 0 913.7   28.4  937.6  28.4 6691.5  -41.6209     547.183  -41.6209    2989.6    138.379      
1 1 1 4  7  15 o 0 558.8   18.9  557.7  18.9 1222.49 72.5132      2080.12  72.5132     1388.31   72.5132      
1 1 1 4  13 15 o 0 338.3   11.7  332.5  11.7 1853.15 -110.71      1239.32  -110.71     151.44    -110.71      
1 1 1 5  8  15 o 0 369     15.6  379.2  15.6 3569.27 98.6443      605.653  98.6443     1394.18   -81.3557     
1 1 1 5  12 15 o 0 289.6   12.6  276    12.6 2302.29 96.7964      849.948  96.7964     506.348   -83.2036     
1 1 1 5  14 15 o 0 488.8   19.2  474.3  19.2 2277.39 -136.702     1621.45  -136.702    309.234   -136.702     
1 1 1 1  15 6  f 1 956.6   32.9  959.9  32.9 2381.15 -21.0319     2980.23  -21.0319    1578.38   -21.0319     
1 1 1 5  15 6  o 0 444.2   16.3  450.8  16.3 3529.11 -153.809     905.43   -153.809    1103.64   26.1914      
1 1 1 6  11 15 o 0 152.9   7.4   160.8  7.4  1832.29 78.2309      306.314  78.2309     692.55    -101.769     
1 1 1 4  15 7  o 0 516.4   18.4  512.6  18.4 3236.83 11.501       1272.69  11.501      562.301   -168.499     
1 1 1 6  15 7  o 0 369.3   13.9  370.2  13.9 3536.95 126.829      611.523  126.829     1391.39   -53.1707     
1 1 1 7  8  15 o 0 162.2   7.3   165.8  7.3  2657.23 15.6854      65.5096  15.6854     1423.17   -164.315     
1 1 1 7  10 15 o 0 448.3   19    453.3  19   2745.06 104.401      1250.71  104.401     259.002   -75.5986     
1 1 1 7  14 15 o 0 58.8    3.3   51.3   3.3  1712.02 -102.772     396.384  77.228      1373.59   77.228       
1 1 1 1  15 8  o 0 265.3   9.5   291.4  9.5  1273.5  -161.232     1055.25  -161.232    314.634   -161.232     
1 1 1 8  9  15 o 0 440.5   18.8  445.4  18.8 2664.48 -5.32052     1274.14  -5.32052    208.796   174.679      
1 1 1 8  11 15 o 0 89.2    4.7   88     4.7  1138.22 14.0303      2.73338  -165.97     676.306   -165.97      
1 1 1 2  15 9  o 0 46.5    2.1   44.7   2.1  1787.76 171.604      511.618  -8.39592    1530.92   -8.39592     
1 1 1 9  12 15 o 0 574.9   22.8  555.9  22.8 3941.62 178.534      1114.09  178.534     1191.28   -1.46579     
1 1 1 9  14 15 o 0 110.9   4.9   95.4   4.9  1604.34 62.8084      197.878  62.8084     685.068   -117.192     
1 1 1 3  15 10 o 0 381.2   12.6  379.2  12.6 3260.49 -58.5765     779.461  -58.5765    1046.72   121.424      
1 1 1 5  15 10 o 0 168.1   6.1   167.5  6.1  1088.96 138.535      450.513  138.535     151.497   -41.465      
1 1 1 7  15 10 o 0 68.2    3.7   69.7   3.7  1814.31 -139.942     298.093  40.058      1298.5    40.058       
1 1 1 10 11 15 o 0 124.2   5.8   115.7  5.8  3048.76 172.152      407.405  -7.84833    2218.52   -7.84833     
1 1 1 10 13 15 f 1 129.3   6.1   127    6.1  2197.88 -47.1786     15.6428  -47.1786    1259.49   132.821      
1 1 1 2  15 11 o 0 163.1   6.1   175.8  6.1  1493.12 125.897      458.402  125.897     380.922   -54.103      
1 1 1 10 15 11 o 0 18.2    1.8   13     1.8  588.146 -14.8816     279.698  165.118     629.806   165.118      
1 1 1 11 12 15 o 0 87.8    4.5   82.2   4.5  643.521 -72.0768     14.4085  -72.0768    363.054   107.923      
1 1 1 11 14 15 f 1 370.1   14.9  358    14.9 2527.11 -41.8278     1190.81  -41.8278    205.924   138.172      
1 1 1 1  15 12 o 0 835.1   28    837.6  28   4106.58 57.2109      1750.45  57.2109     571.181   -122.789     
1 1 1 9  15 12 o 0 466.7   18.8  468.4  18.8 3049.11 66.4967      1245.2   66.4967     540.493   -113.503     
1 1 1 11 15 12 o 0 340.2   13.7  320.9  13.7 2001.27 166.482      1172.51  166.482     2.6593    -13.5184     
1 1 1 12 13 15 o 0 450.1   17.2  411    17.2 2672.52 143.792      1404.68  143.792     89.6001   -36.2083     
1 1 1 2  15 13 o 0 703.8   23    707.7  23   3822.08 145.857      1643.88  145.857     648.074   -34.1431     
1 1 1 4  15 13 o 0 794.6   25.3  776.1  25.3 3410.63 -67.5841     2048.55  -67.5841    45.7831   -67.5841     
1 1 1 6  15 13 o 0 754.4   26.1  759.2  26.1 2740.43 153.687      2275.08  153.687     684.757   153.687      
1 1 1 1  15 14 o 0 693.9   23.4  688.4  23.4 3884.52 133.744      1570.91  133.744     764.961   -46.2564     
1 1 1 7  15 14 o 0 391.2   14.8  422.9  14.8 4365.45 160.3        330.571  160.3       2161.91   -19.6999     
1 1 1 11 15 14 f 1 387.3   15    397.5  15   607.545 -63.3638     1461.94  -63.3638    1126.09   -63.3638     
1 1 1 8  15 15 o 0 197     8.2   201.9  8.2  1964.93 90.963       680.868  90.963      386.707   -89.037      
1 1 1 14 15 15 o 0 187.1   9.9   169.3  9.9  884.205 -138.686     860.224  -138.686    270.081   -138.686     
1 1 1 1  16 1  o 0 676.9   20.4  648.8  20.4 4681.23 -115.789     1000.04  -115.789    1693.8    64.2108      
1 1 1 1  3  16 o 0 800.1   26.4  797.1  26.4 3534.59 -111.712     2000.7   -111.712    54.4545   68.2881      
1 1 1 1  5  16 o 0 173.9   6.1   171.1  6.1  3285.91 80.7301      176.325  -99.2699    2085.25   -99.2699     
1 1 1 1  7  16 < 0 11.8    1.1   9.5    1.1  ?       ?            645.206  92.8752     ?         ?            
1 1 1 1  9  16 o 0 783.8   25.6  786.6  25.6 2924.35 168.015      2231.81  168.015     560.297   168.015      
1 1 1 1  15 16 f 1 326.4   11.4  311.3  11.4 2181.68 -123.671     1048.84  -123.671    235.568   56.3292      
1 1 1 2  10 16 o 0 55.1    2.4   54     2.4  2403.91 -151.507     646.042  28.4926     1990.07   28.4926      
1 1 1 2  12 16 o 0 289.1   10.4  307.4  10.4 2118.44 61.48        1006.72  61.48       259.131   -118.52      
1 1 1 1  16 3  o 0 772     22.9  757.3  22.9 2840.78 -170.007     2240.42  -170.007    599.181   -170.007     
1 1 1 3  16 3  o 0 877.2   27.9  914    27.9 4716.98 -92.9286     1587.49  -92.9286    1092.2    87.0714      
1 1 1 3  5  16 o 0 49.6    2.2   55.9   2.2  2319.18 -85.1461     636.621  94.8539     1949.17   94.8539      
1 1 1 3  7  16 o 0 279.5   9.5   280.9  9.5  2872.48 -11.5808     557.598  -11.5808    1057.36   168.419      
1 1 1 3  11 16 o 0 40.1    2.3   43.6   2.3  1694.85 -176.997     493.654  3.00342     1422.57   3.00342      
1 1 1 3  15 16 o 0 781.2   25.9  792.6  25.9 3441.29 16.9426      1980.7   16.9426     14.8997   16.9426      
1 1 1 4  6  16 < 0 14.5    1.2   14.1   1.2  ?       ?            554.1    94.9003     ?         ?            
1 1 1 4  8  16 o 0 122.7   5     126.5  5    1578.63 -113.506     166.646  -113.506    709.201   66.4937      
1 1 1 4  10 16 o 0 329.1   12.4  346.4  12.4 2389.71 139.832      983.18   139.832     325.096   -40.1683     
1 1 1 4  12 16 f 1 521.6   19    527.5  19   2738.3  36.0365      1582.41  36.0365     28.4386   -143.963     
1 1 1 4  14 16 o 0 552.7   18.6  524.2  18.6 2877.9  79.3863      1537.32  79.3863     110.786   -100.614     
1 1 1 5  7  16 o 0 341.1   12.6  327.9  12.6 2907.06 20.4867      761.639  20.4867     852.144   -159.513     
1 1 1 5  11 16 o 0 55.1    3.1   47.5   3.1  1869.9  -89.1874     498.368  90.8126     1594.77   90.8126      
1 1 1 6  16 6  o 0 212.1   8.2   217.4  8.2  2509.16 -123.013     403.884  -123.013    1002.54   56.9865      
1 1 1 6  8  16 o 0 91.9    4.7   91.3   4.7  2661.48 62.657       416.929  -117.343    1882.11   -117.343     
1 1 1 6  10 16 o 0 543.3   22.4  517.7  22.4 2926.73 73.7096      1408.17  73.7096     177.813   -106.29      
1 1 1 1  16 7  o 0 280     9.6   289.4  9.6  2374.15 -120.156     810.064  -120.156    555.885   59.8439      
1 1 1 5  16 7  o 0 780.2   28.5  774.2  28.5 4740.73 -173.981     1245.36  -173.981    1394.81   6.01892      
1 1 1 7  16 7  o 0 186.1   7.4   182.2  7.4  534.545 -129.881     359.325  -129.881    61.2244   -129.881     
1 1 1 7  9  16 o 0 309.2   13.4  308.9  13.4 2112.49 -155.084     965.674  -155.084    187.509   24.9164      
1 1 1 7  11 16 o 0 495.6   20.8  489.3  20.8 3442.89 -23.9412     1127.15  -23.9412    877.323   156.059      
1 1 1 7  15 16 f 1 224.7   9.2   203.4  9.2  2343.25 -96.3897     597.191  -96.3897    668.672   83.6103      
1 1 1 2  16 8  o 0 1015.9  32.5  1004.3 32.5 2965.82 -49.9636     2742.59  -49.9636    1066.11   -49.9636     
1 1 1 8  16 8  o 0 453.4   19.2  481.6  19.2 3912.77 -129.201     759.293  -129.201    1408.97   50.7991      
1 1 1 8  10 16 o 0 69.7    3.9   75.2   3.9  729.922 143.671      50.6948  -36.3287    479.868   -36.3287     
1 1 1 8  12 16 o 0 486.2   19.8  447.3  19.8 1954.6  124.462      1687.02  124.462     563.274   124.462      
1 1 1 7  16 9  o 0 419.7   16.7  400    16.7 3381.95 74.0171      811.814  74.0171     1040.57   -105.983     
1 1 1 9  16 9  o 0 127.1   6.2   139    6.2  1220.09 131.761      283.578  131.761     445.514   -48.2391     
1 1 1 9  11 16 o 0 133.2   6.9   139.6  6.9  892.007 -129.518     281.714  -129.518    237.225   50.4815      
1 1 1 9  13 16 o 0 445.9   17.7  420.7  17.7 2036.63 94.1746      1662.58  94.1746     544.714   94.1746      
1 1 1 4  16 10 o 0 244.2   8.3   238.6  8.3  2192.11 127.264      643.445  127.264     557.671   -52.7357     
1 1 1 10 14 16 f 1 113.5   5.8   116.4  5.8  447.531 -112.801     223.061  -112.801    20.0892   67.1986      
1 1 1 1  16 11 o 0 165.1   6.4   175.4  6.4  1295.35 130.06       478.414  130.06      249.927   -49.9396     
1 1 1 5  16 11 o 0 105.7   4     101.5  4    1809.58 -51.101      32.0529  128.899     1094.34   128.899      
1 1 1 7  16 11 o 0 466     18.3  456.1  18.3 1819.92 -63.8864     1731.63  -63.8864    670.091   -63.8864     
1 1 1 11 16 11 o 0 172.3   7.8   170.9  7.8  898.061 -2.3515      694.79   -2.3515     186.87    -2.3515      
1 1 1 11 13 16 o 0 19.3    2.2   12.8   2.2  1748.33 45.4465      706.876  -134.554    1665.1    -134.554     
1 1 1 2  16 12 o 0 54.9    2.7   59.4   2.7  1421.47 3.79066      303.428  -176.209    1152.67   -176.209     
1 1 1 6  16 12 o 0 445.9   16.2  454.5  16.2 3220.58 -101.137     1084.95  -101.137    778.23    78.8627      
1 1 1 10 16 12 o 0 33.4    2.6   33.6   2.6  725.292 -153.495     175.669  26.5051     579.603   26.5051      
1 1 1 5  16 13 o 0 757     26    760.4  26   3151.17 30.4485      2063.16  30.4485     250.756   30.4485      
1 1 1 13 16 13 o 0 77.7    4.3   70.8   4.3  1879.67 60.1743      121.062  -119.826    1149.79   -119.826     
1 1 1 13 15 16 o 0 369.9   14.5  348.5  14.5 2400.28 -44.5825     1473.8   -44.5825    100.936   135.418      
1 1 1 2  16 14 o 0 19      2     21.3   2    513.668 -73.9921     223.839  106.008     524.334   106.008      
1 1 1 4  16 14 o 0 232.7   8.1   225.6  8.1  2537.56 26.8054      474.507  26.8054     979.217   -153.195     
1 1 1 6  16 14 o 0 463.7   16.5  471.9  16.5 3424.54 101.749      1020.38  101.749     914.951   -78.2506     
1 1 1 10 16 14 f 1 356.3   13.8  358.9  13.8 2133.52 75.7117      1314.07  75.7117     154.493   75.7117      
1 1 1 12 16 14 o 0 129     6     124.6  6    960.86  -80.0111     416.345  -80.0111    101.241   99.9889      
1 1 1 1  16 15 f 1 153.2   5.8   144.9  5.8  938.432 -153.264     357.942  -153.264    194.597   26.7361      
1 1 1 3  16 15 o 0 849.5   27.2  825.4  27.2 4153.02 -82.0113     1746.97  -82.0113    625.809   97.9887      
1 1 1 7  16 15 f 1 607.9   20.8  592.2  20.8 4100.26 79.6263      1188.91  79.6263     1026.63   -100.374     
1 1 1 11 16 15 o 0 312.1   12    286.5  12   2583.54 25.8117      877.148  25.8117     493.77    -154.188     
1 1 1 13 16 15 o 0 72.7    5.5   55.4   5.5  1145.15 -36.9709     22.5721  143.029     773.735   143.029      
1 1 1 15 16 15 o 0 391.2   18.1  364    18.1 2893.77 -41.8785     1277.17  -41.8785    606.468   138.121      
1 1 1 2  16 16 o 0 356.2   12.4  343.4  12.4 1623.37 -56.0272     1497.73  -56.0272    601.729   -56.0272     
1 1 1 4  16 16 o 0 409.3   14.4  403.5  14.4 3240.41 -94.5303     1002.97  -94.5303    748.836   85.4697      
1 1 1 6  16 16 o 0 514.4   20    491    20   3206.06 -1.38212     1329.05  -1.38212    378.542   178.618      
1 1 1 8  16 16 o 0 22.5    2.5   27     2.5  1362.22 -99.5152     432.402  80.4847     1150.51   80.4847      
1 1 1 10 16 16 o 0 288     11.3  278.8  11.3 2622.1  40.0845      970.411  40.0845     734.741   -139.916     
1 1 1 12 16 16 o 0 60.4    3.9   55.1   3.9  706.282 -89.8099     20.895   90.1901     477.191   90.1901      
1 1 1 14 16 16 o 0 56.8    5.4   51.1   5.4  1446.68 -29.216      210.476  150.784     1137.88   150.784      
1 1 1 1  6  17 o 0 706.7   22.6  680.7  22.6 5427.77 50.6297      676.431  50.6297     2418.24   -129.37      
1 1 1 1  8  17 o 0 253.6   8.4   243    8.4  1726    -130.225     837.674  -130.225    138.652   49.7754      
1 1 1 1  10 17 o 0 407.3   14    432.3  14   2493.19 -83.2546     1271.79  -83.2546    120.73    96.7454      
1 1 1 1  12 17 o 0 24.8    1.7   24.6   1.7  1679.64 -154.288     711.107  25.7117     1713.4    25.7117      
1 1 1 2  5  17 o 0 956.8   30.7  944    30.7 2578.43 -83.286      2769.97  -83.286     1317.63   -83.286      
1 1 1 2  7  17 o 0 94.1    3.5   91.3   3.5  2443.3  -4.18524     327.177  175.815     1695.44   175.815      
1 1 1 2  9  17 o 0 10.7    1.1   13.1   1.1  1317.17 -85.4785     621.529  94.5215     1351.68   94.5215      
1 1 1 2  13 17 f 1 352.8   12    341.9  12   3107.98 61.4298      746.393  61.4298     1074.88   -118.57      
1 1 1 2  17 3  o 0 22.8    1.2   17.1   1.2  873.197 35.5726      367.247  -144.427    858.797   -144.427     
1 1 1 3  10 17 o 0 765.2   26.3  762.9  26.3 2123.44 -174.321     2612.07  -174.321    1355.83   -174.321     
1 1 1 3  12 17 o 0 748.2   25.7  753.9  25.7 4884.81 -2.22886     1150.03  -2.22886    1692      177.771      
1 1 1 3  16 17 o 0 238.9   8.4   232    8.4  1972.7  3.61446      851.971  3.61446     209.343   -176.386     
1 1 1 4  7  17 o 0 224     8.1   230    8.1  1131.17 161.8        745.591  161.8       124.411   161.8        
1 1 1 4  11 17 o 0 24.3    1.9   21.3   1.9  1027.78 64.8209      428.746  -115.179    1026.45   -115.179     
1 1 1 4  13 17 o 0 220.5   8.6   218.6  8.6  1407.65 -171.571     746.465  -171.571    56.7615   8.42866      
1 1 1 4  15 17 o 0 639.9   21.8  621.4  21.8 1967.79 -53.6609     2288.63  -53.6609    1226.28   -53.6609     
1 1 1 2  17 5  o 0 116.4   4.3   117.9  4.3  993.602 173.779      176.456  173.779     382.081   -6.2207      
1 1 1 4  17 5  o 0 690.3   21.4  679.5  21.4 2916.95 -94.0315     1900.87  -94.0315    283.227   -94.0315     
1 1 1 5  10 17 o 0 243.3   9.5   243.6  9.5  1898.45 -96.4959     792.241  -96.4959    313.203   83.5041      
1 1 1 5  14 17 o 0 56.1    3.4   59.5   3.4  2108.93 72.683       354.007  -107.317    1497.21   -107.317     
1 1 1 5  17 6  o 0 935.7   31.1  938.2  31.1 4162.54 -164.772     1919.86  -164.772    372.847   15.228       
1 1 1 6  13 17 o 0 47.5    3.3   38.5   3.3  365.801 -90.7187     93.2324  89.2813     299.117   89.2813      
1 1 1 2  17 7  o 0 554.3   18    544.1  18   2773.16 -91.901      1582.32  -91.901     31.6566   -91.901      
1 1 1 4  17 7  o 0 695.4   23.9  651.7  23.9 2878.2  90.1534      1872.72  90.1534     289.55    90.1534      
1 1 1 7  8  17 o 0 320.8   14    326.3  14   2427.54 136.421      977.814  136.421     448.876   -43.5792     
1 1 1 7  12 17 o 0 386.2   16.4  378.4  16.4 1928.22 55.106       1360.58  55.106      268.047   55.106       
1 1 1 7  14 17 o 0 266.7   11.7  244.2  11.7 2800.97 -4.61955     597.018  -4.61955    903.883   175.38       
1 1 1 7  16 17 o 0 518.9   20.9  530.9  20.9 3912.77 58.2113      1032.92  58.2113     1008.01   -121.789     
1 1 1 7  17 8  o 0 524.7   19    488.1  19   3264.97 -133.71      1283.9   -133.71     642.517   46.2901      
1 1 1 8  9  17 o 0 156.7   7.4   156.5  7.4  2723.36 60.369       6.95887  -119.631    1594.29   -119.631     
1 1 1 8  11 17 o 0 50.9    3.3   51.5   3.3  848.782 -51.4746     182.485  128.525     667.478   128.525      
1 1 1 8  13 17 o 0 182.8   8.6   172.8  8.6  1908.35 -132.5       579.896  -132.5      451.671   47.4996      
1 1 1 8  15 17 o 0 390.8   17    378.3  17   2968.72 -25.5193     1024.36  -25.5193    538.562   154.481      
1 1 1 8  17 9  o 0 182.5   8     184    8    1223.93 -149.614     570.628  -149.614    145.177   30.3857      
1 1 1 9  10 17 o 0 245.3   11.1  260.8  11.1 2361.7  43.0216      669.798  43.0216     693.621   -136.978     
1 1 1 9  12 17 o 0 50.4    3.4   42.6   3.4  1724.5  61.3473      334.76   -118.653    1276.55   -118.653     
1 1 1 9  14 17 f 1 41.3    3.2   41.3   3.2  480.951 -115.642     75.1797  64.3583     332.475   64.3583      
1 1 1 7  17 10 o 0 308.5   12.6  301.1  12.6 2200.22 77.8414      974.001  77.8414     300.89    -102.159     
1 1 1 9  17 10 o 0 143.1   6.5   137.2  6.5  907.573 -130.294     301.865  -130.294    223.441   49.7062      
1 1 1 10 11 17 o 0 128.2   6     111.2  6    1045.94 38.1268      389.808  38.1268     188.189   -141.873     
1 1 1 10 13 17 o 0 468.2   18.7  438.7  18.7 3220.12 1.50404      1173.32  1.50404     559.766   -178.496     
1 1 1 6  17 11 o 0 625.1   21    630.9  21   2660.95 99.9192      1924.03  99.9192     392.847   99.9192      
1 1 1 8  17 11 o 0 191.2   8.2   176.7  8.2  511.89  19.128       356.156  19.128      63.0982   19.128       
1 1 1 11 12 17 o 0 636.8   26.2  624.2  26.2 2653.85 -20.6978     2016.03  -20.6978    569.165   -20.6978     
1 1 1 11 16 17 o 0 293.5   12.6  292.5  12.6 1187.4  42.1449      1529.37  42.1449     773.311   42.1449      
1 1 1 1  17 12 o 0 341.6   12.3  344    12.3 1783.27 103.8        1311.15  103.8       247.225   103.8        
1 1 1 5  17 12 o 0 35.8    2.1   39.1   2.1  643.554 117.773      196.04   -62.2274    564.605   -62.2274     
1 1 1 7  17 12 o 0 227.7   9.1   247.2  9.1  593.562 48.9875      591.139  48.9875     254.362   48.9875      
1 1 1 11 17 12 o 0 263.6   11.1  251.8  11.1 1658.12 105.876      1073.3   105.876     168.615   105.876      
1 1 1 12 13 17 o 0 95.2    5.3   100.3  5.3  446.179 -39.7576     153.981  -39.7576    85.4159   140.242      
1 1 1 12 15 17 o 0 308.1   12.6  278.5  12.6 2470.9  154.06       1095.78  154.06      498.737   -25.9404     
1 1 1 2  17 13 f 1 627.7   20.8  632.9  20.8 2378.39 173.019      2076.15  173.019     681.93    173.019      
1 1 1 6  17 13 o 0 119.6   4.9   122.2  4.9  838.023 -17.6064     188.771  -17.6064    283.349   162.394      
1 1 1 8  17 13 o 0 730.7   26.2  740.5  26.2 4397.93 2.65621      1439.43  2.65621     940.165   -177.344     
1 1 1 10 17 13 o 0 95.1    4.8   94.3   4.8  1671.28 115.212      109.363  115.212     790.707   -64.7881     
1 1 1 13 14 17 o 0 100     5.2   91.7   5.2  1635.38 52.9857      156.187  52.9857     914.09    -127.014     
1 1 1 13 16 17 o 0 274.2   11.6  257.7  11.6 2329.86 141.251      1000.81  141.251     470.332   -38.7486     
1 1 1 3  17 14 o 0 755.4   24.6  748.6  24.6 2944.13 123.371      2126.48  123.371     448.028   123.371      
1 1 1 7  17 14 o 0 631.8   22.7  668    22.7 3146.63 -93.5387     1811     -93.5387    123.73    -93.5387     
1 1 1 13 17 14 o 0 19      2.8   12.5   2.8  917.665 10.4549      434.473  -169.545    1034.71   -169.545     
1 1 1 14 15 17 o 0 42.3    3.5   37.4   3.5  2205.24 -154.803     688.701  25.1967     2101.04   25.1967      
1 1 1 2  17 15 o 0 267     9.5   266.7  9.5  2447.83 -60.9564     827.007  -60.9564    522.683   119.044      
1 1 1 4  17 15 o 0 35.9    2.4   33.2   2.4  1170.52 -4.32246     283.534  175.678     915.759   175.678      
1 1 1 6  17 15 o 0 168.9   6.5   165.6  6.5  1873.24 -109.925     522.998  -109.925    473.827   70.0752      
1 1 1 10 17 15 o 0 460.8   17.3  447.8  17.3 2788.31 17.518       1663.88  17.518      147.327   -162.482     
1 1 1 12 17 15 o 0 320.9   13.4  306    13.4 2086.34 163.775      1385.05  163.775     39.0243   163.775      
1 1 1 14 17 15 o 0 117.6   6     111.8  6    354.857 -169.675     215.026  -169.675    12.0672   10.3255      
1 1 1 15 16 17 o 0 155.4   9.2   147.6  9.2  1823.55 88.2791      523.388  88.2791     616.034   -91.7209     
1 1 1 3  17 16 o 0 173.1   6.6   180.4  6.6  1941.62 -119.217     559.986  -119.217    484.89    60.7831      
1 1 1 5  17 16 o 0 82.8    4.1   90     4.1  2788.95 -12.2037     370.313  167.796     1844.66   167.796      
1 1 1 13 17 16 o 0 281.4   11.8  256.5  11.8 2903.74 141.817      718.252  141.817     1114.7    -38.1832     
1 1 1 2  17 17 o 0 432.6   15.1  424.8  15.1 3121.62 22.9552      1130.06  22.9552     543.705   -157.045     
1 1 1 4  17 17 o 0 294.4   11.1  299.3  11.1 2079.77 -24.7436     1062.99  -24.7436    29.857    155.256      
1 1 1 6  17 17 o 0 207.2   9.2   201.5  9.2  1354.24 142.142      1025.49  142.142     154.921   142.142      
1 1 1 8  17 17 o 0 549.4   20.2  573.1  20.2 1746.44 95.2393      2539.67  95.2393     1430.56   95.2393      
1 1 1 14 17 17 f 1 56      5.5   47.7   5.5  1277.3  68.9685      176.623  -111.032    968.022   -111.032     
1 1 1 16 17 17 o 0 145     9.5   143.1  9.5  1312.22 56.8888      716.874  56.8888     61.7997   -123.111     
1 1 1 1  18 1  o 0 101.7   3.6   101.2  3.6  1234.13 -130.582     68.064   -130.582    619.581   49.4176      
1 1 1 1  9  18 f 1 106.2   3.9   101.7  3.9  2104.08 10.9524      130.741  -169.048    1402.16   -169.048     
1 1 1 1  11 18 o 0 748.8   25.2  796.7  25.2 4899.75 125.874      1224.32  125.874     1676.68   -54.1261     
1 1 1 1  13 18 o 0 71.5    3.3   77     3.3  1163.76 -108.759     103.336  71.2414     779.193   71.2414      
1 1 1 1  15 18 o 0 248.8   9.1   245.3  9.1  2391.12 -1.2276      756.102  -1.2276     556.769   178.772      
1 1 1 1  17 18 o 0 60.5    3.6   68.1   3.6  2191.05 -128.709     393.204  51.2908     1846.97   51.2908      
1 1 1 2  4  18 o 0 445.8   14.9  438.1  14.9 2819.68 51.8271      1197.78  51.8271     365.743   -128.173     
1 1 1 2  12 18 f 1 54.5    2.7   51.6   2.7  1118.67 151.177      243.686  -28.8233    895.132   -28.8233     
1 1 1 3  18 3  o 0 1054.4  31.7  979.4  31.7 5260.45 -9.40325     1537.15  -9.40325    1355.41   170.597      
1 1 1 3  5  18 o 0 752.5   24.6  752.9  24.6 3680.83 -119.992     1696.55  -119.992    320.817   60.0083      
1 1 1 3  11 18 o 0 -1.2    1.4   3.1    1.4  243.186 -158.961     137.845  21.0389     278.321   21.0389      
1 1 1 3  13 18 f 1 194     7.3   198.8  7.3  1787.37 144.252      728.848  144.252     257.855   -35.7478     
1 1 1 3  15 18 o 0 206.1   8.1   198.6  8.1  2434.2  116.443      502.823  116.443     803.33    -63.5567     
1 1 1 3  17 18 o 0 376.9   12.9  362    12.9 2419.62 -20.2073     1495.6   -20.2073    75.0858   159.793      
1 1 1 4  18 4  o 0 593.8   20    620.1  20   3580.29 7.20147      1342.47  7.20147     614.661   -172.799     
1 1 1 4  6  18 o 0 447.8   14.3  457.6  14.3 1473.99 13.2631      1649.38  13.2631     850.013   13.2631      
1 1 1 4  8  18 o 0 703.4   23.1  721.9  23.1 3884.91 99.2813      1588.52  99.2813     681.41    -80.7187     
1 1 1 4  14 18 o 0 651.9   23.6  665.5  23.6 2512.63 65.4065      2133.87  65.4065     782.364   65.4065      
1 1 1 4  16 18 o 0 461.8   16.6  471    16.6 2078.91 160.386      1683.12  160.386     592.31    160.386      
1 1 1 5  18 5  o 0 738.9   23.7  718.8  23.7 4066.25 -91.3594     1430.78  -91.3594    779.182   88.6406      
1 1 1 5  7  18 o 0 876.3   29.6  894.9  29.6 4403.78 -109.081     1775.16  -109.081    795.725   70.9189      
1 1 1 5  13 18 o 0 123.6   5.6   124.3  5.6  2049.09 -172.269     199.898  -172.269    905.634   7.73062      
1 1 1 5  15 18 o 0 131.1   5.7   120.7  5.7  1507.6  -172.199     365.015  -172.199    429.761   7.80127      
1 1 1 5  17 18 f 1 108.6   5.1   114    5.1  182.082 -175.484     108.771  -175.484    7.99376   4.5165       
1 1 1 6  8  18 o 0 342     12.9  347.9  12.9 865.944 -116.774     1213.81  -116.774    713.078   -116.774     
1 1 1 6  12 18 o 0 124.2   6.2   107.5  6.2  1744.69 122.002      248.228  122.002     696.923   -57.9975     
1 1 1 6  14 18 o 0 81.9    4.6   83.6   4.6  1084.48 -156.837     122.646  -156.837    452.114   23.1631      
1 1 1 6  16 18 o 0 359.3   14.3  364.2  14.3 1760.75 -177.214     1747.01  -177.214    616.654   -177.214     
1 1 1 1  18 7  o 0 714.4   25.3  745.5  25.3 2997.1  23.2437      1995.54  23.2437     325.968   23.2437      
1 1 1 7  11 18 o 0 19.9    2.3   16.5   2.3  544.524 133.423      235.506  -46.5766    541.871   -46.5766     
1 1 1 7  13 18 o 0 -3.4    2     3.9    2    1559.52 -146.94      809.697  33.0601     1641.43   33.0601      
1 1 1 8  12 18 o 0 212.5   10    216.3  10   1455.84 27.7547      893.651  27.7547     111.359   27.7547      
1 1 1 8  14 18 o 0 98.5    5.3   86.2   5.3  1020.88 -39.9153     192.791  -39.9153    342.739   140.085      
1 1 1 8  16 18 o 0 341.5   15    325.4  15   3188.59 31.2144      880.162  31.2144     1142.23   -148.786     
1 1 1 1  18 9  f 1 782.1   25.3  779.2  25.3 3855.22 174.724      1830.66  174.724     496.402   -5.27609     
1 1 1 3  18 9  o 0 76.5    2.9   63.6   2.9  1748.07 65.9805      282.356  -114.02     1307.45   -114.02      
1 1 1 7  18 9  o 0 83.2    3.8   83.6   3.8  1360.19 -105.805     75.3468  74.1951     856.446   74.1951      
1 1 1 9  11 18 f 1 528     22.6  540.2  22.6 4156.76 -122.931     967.747  -122.931    1298.5    57.0687      
1 1 1 9  13 18 o 0 181.1   8.4   174.8  8.4  1876.91 110.557      578.672  110.557     414.983   -69.4435     
1 1 1 9  17 18 o 0 477.5   19    486.2  19   2146.26 39.5859      2019.83  39.5859     686.483   39.5859      
1 1 1 8  18 10 f 1 574.9   23.1  595.3  23.1 2900.02 78.9655      1651.56  78.9655     4.78253   -101.035     
1 1 1 10 18 10 o 0 114.6   5.8   119.7  5.8  2700.98 178.68       114.333  -1.32035    1596.45   -1.32035     
1 1 1 10 12 18 o 0 9.9     2.5   2.7    2.5  472.848 55.8539      220.588  -124.146    473.508   -124.146     
1 1 1 10 14 18 o 0 621.4   23.9  567.7  23.9 2355.21 5.602        2427.37  5.602       903.22    5.602        
1 1 1 10 16 18 o 0 176.8   8.1   169.3  8.1  1391.73 -102.01      796.121  -102.01     77.89     77.9897      
1 1 1 3  18 11 o 0 698     22.7  692.4  22.7 1569.07 101.068      2527.85  101.068     1620.72   101.068      
1 1 1 7  18 11 o 0 85.5    4.5   94.4   4.5  1034.1  125.922      18.2626  125.922     564.609   -54.0777     
1 1 1 11 18 11 o 0 387.5   17    401    17   2622.08 145.804      1250.02  145.804     169.675   -34.1956     
1 1 1 11 13 18 o 0 74      5     88.1   5    1183.35 -91.5331     127.537  -91.5331    647.004   88.4669      
1 1 1 11 15 18 f 1 6.4     2.9   5.5    2.9  599.955 -128.316     345.084  51.6836     728.356   51.6836      
1 1 1 11 17 18 o 0 398     16    364.4  16   2150.46 -154.677     1595.08  -154.677    273.332   -154.677     
1 1 1 4  18 12 o 0 17.5    1.9   12.7   1.9  827.558 -101.54      379.203  78.4602     849.177   78.4602      
1 1 1 8  18 12 o 0 624.9   24.2  613.7  24.2 3229.85 -150.708     1687.81  -150.708    50.0514   29.2918      
1 1 1 10 18 12 o 0 595.9   24.1  594.9  24.1 2514.62 47.1839      1939.33  47.1839     593.183   47.1839      
1 1 1 12 18 12 o 0 529.6   20.6  475.2  20.6 2109.39 -91.3095     2259.59  -91.3095    862.311   -91.3095     
1 1 1 1  18 13 o 0 815.9   27.7  836.6  27.7 3026.29 160.433      2328.18  160.433     569.443   160.433      
1 1 1 3  18 13 f 1 500.7   16.9  508.5  16.9 2216.74 -115.341     1830.08  -115.341    605.175   -115.341     
1 1 1 5  18 13 o 0 359.9   12    349.2  12   3128.38 -86.1998     862.52   -86.1998    827.218   93.8002      
1 1 1 7  18 13 o 0 636.6   23.1  680.4  23.1 2176.06 83.272       2261.83  83.272      1100      83.272       
1 1 1 9  18 13 o 0 570.6   21.9  548.7  21.9 1852.64 -86.3883     2078.38  -86.3883    1096.82   -86.3883     
1 1 1 13 18 13 o 0 213.1   9.1   183.5  9.1  1401.81 173.882      995.919  173.882     84.0645   173.882      
1 1 1 13 15 18 o 0 110.1   5.8   102.1  5.8  773.732 -61.0783     314.403  -61.0783    173.06    118.922      
1 1 1 2  18 14 o 0 593.9   19.7  599.4  19.7 2115.14 -161.971     2168.88  -161.971    1006.61   -161.971     
1 1 1 6  18 14 o 0 95.8    4.2   99.3   4.2  1355.18 89.7679      197.98   89.768      520.904   -90.232      
1 1 1 8  18 14 o 0 408.7   15.6  453.6  15.6 2636.34 132.686      1337.52  132.686     46.399    -47.3144     
1 1 1 12 18 14 o 0 23.7    3     20.1   3    694.559 36.5618      278.405  -143.438    724.754   -143.438     
1 1 1 14 16 18 o 0 335.7   13.5  311.8  13.5 2618.29 141.333      1113.74  141.333     498.134   -38.667      
1 1 1 1  18 15 o 0 206.3   7.7   205.2  7.7  2413.04 138.578      541.8    138.578     784.27    -41.4217     
1 1 1 3  18 15 o 0 313.8   10.5  288.8  10.5 2807.71 -9.79104     795.326  -9.79104    712.509   170.209      
1 1 1 7  18 15 o 0 206.5   7.9   203.4  7.9  2813.87 -53.9208     337.785  -53.9208    1127.24   126.079      
1 1 1 13 18 15 o 0 70      4.3   54.4   4.3  937.917 130.276      6.5963   -49.7242    596.959   -49.7242     
1 1 1 15 18 15 o 0 132.6   6.8   126.6  6.8  2483.45 112.835      74.7062  112.835     1471      -67.1652     
1 1 1 15 17 18 o 0 421.2   16.3  374.7  16.3 2318.8  23.5081      1633.96  23.5081     275.84    23.5081      
1 1 1 2  18 16 o 0 28.2    2.7   26.7   2.7  1406.7  -177.851     427.724  2.1487      1181.32   2.1487       
1 1 1 4  18 16 o 0 387.4   13.1  375.7  13.1 2485.71 172.434      1225.91  172.434     79.1455   -7.56566     
1 1 1 8  18 16 o 0 333.8   12.6  358.7  12.6 2165.6  -24.0654     1482.21  -24.0654    108.277   -24.0654     
1 1 1 10 18 16 o 0 248.9   10    244.8  10   2027.86 41.6884      1033.02  41.6884     240.465   -138.312     
1 1 1 12 18 16 f 1 387.1   14.5  352.7  14.5 2479.07 -83.4175     1398.89  -83.4175    151.502   96.5825      
1 1 1 14 18 16 o 0 134.1   6.6   110.7  6.6  565.806 -47.3634     345.254  -47.3634    2.72353   132.637      
1 1 1 16 18 16 o 0 114.5   7.6   77.4   7.6  1930.28 65.8428      171.118  65.8428     971.81    -114.157     
1 1 1 1  18 17 o 0 294.2   10.7  295.9  10.7 2355.81 34.3         1195.16  34.3        368.636   -145.7       
1 1 1 3  18 17 o 0 74.5    4     73.3   4    1625.09 -3.62687     56.0956  176.373     1111.42   176.373      
1 1 1 7  18 17 o 0 36.7    2.9   32.9   2.9  861.396 -97.4157     228.172  82.5843     769.772   82.5843      
1 1 1 9  18 17 o 0 162.3   7.1   167.9  7.1  1967.16 -37.1914     559.083  -37.1914    663.074   142.809      
1 1 1 11 18 17 o 0 99.9    5.4   89.7   5.4  550.056 -122.534     191.759  -122.534    146.278   57.4661      
1 1 1 15 18 17 o 0 161.5   9.7   136.2  9.7  980.954 -66.7586     763.411  -66.7586    189.265   -66.7586     
1 1 1 2  18 18 o 0 519.9   17.9  516.7  17.9 2840.9  74.9882      1878.16  74.9882     42.8233   74.9882      
1 1 1 4  18 18 o 0 245.5   9.5   239.2  9.5  1584.26 -11.8918     1183.54  -11.8918    179.854   -11.8918     
1 1 1 6  18 18 o 0 337.8   13.7  320.4  13.7 3220.2  1.40874      827.711  1.40874     1179.55   -178.591     
1 1 1 10 18 18 o 0 294.7   11.9  285    11.9 1651.39 81.1421      1358.47  81.1421     355.305   81.1421      
1 1 1 12 18 18 o 0 49.6    4.7   34.8   4.7  1270.17 63.0189      164.844  -116.981    909.266   -116.981     
1 1 1 14 18 18 o 0 294.1   12.2  247.8  12.2 1407.15 -142.115     1417.8   -142.115    604.067   -142.115     
1 1 1 16 18 18 f 1 134.6   10.4  161.2  10.4 1171.41 157.645      736.64   157.645     66.3696   157.645      
1 1 1 1  4  19 o 0 311     10.8  308.7  10.8 3263.12 85.505       491.894  85.505      1307.13   -94.495      
1 1 1 1  18 19 o 0 98.8    5.1   113.2  5.1  1304.16 -57.6443     324.002  -57.6443    513.359   122.356      
1 1 1 1  19 2  o 0 285.5   8.9   281.7  8.9  1988.86 -99.9349     902.972  -99.9349    188.532   80.0651      
1 1 1 2  3  19 o 0 32.3    1.8   27.9   1.8  654.652 -101.226     221.641  78.7735     578.168   78.7735      
1 1 1 2  5  19 f 1 685.5   22.7  696.9  22.7 3476.14 115.413      1610.65  115.413     290.708   -64.5868     
1 1 1 2  7  19 o 0 557.7   18.8  584.6  18.8 2643.5  -28.1085     1796.47  -28.1085    242.064   -28.1085     
1 1 1 2  9  19 o 0 199.5   7     200.1  7    2630.83 48.6806      286.142  48.6806     1245.65   -131.319     
1 1 1 2  11 19 o 0 556.6   19.1  569.2  19.1 2845    34.7558      1633.84  34.7558     0.720075  34.7558      
1 1 1 2  17 19 o 0 33.7    3.2   45.7   3.2  562.91  -164.595     113.419  15.4048     476.461   15.4048      
1 1 1 2  19 3  o 0 411.9   13.7  413    13.7 2503.09 -46.7258     1208.42  -46.7258    153.792   133.274      
1 1 1 3  4  19 o 0 230     8.1   237    8.1  659.103 -5.28952     589.827  -5.28952    234.391   -5.28952     
1 1 1 3  8  19 o 0 226.4   7.8   223.5  7.8  1767.21 -166.268     728.75   -166.268    294.757   13.7318      
1 1 1 3  10 19 o 0 662.1   22.6  646.7  22.6 2962.61 -42.4981     1850.44  -42.4981    155.354   -42.4981     
1 1 1 3  14 19 o 0 525.8   19.1  584    19.1 3301.61 -38.0415     1453.07  -38.0415    309.677   141.959      
1 1 1 3  16 19 o 0 208.5   8.5   214    8.5  1110.78 -177.788     1086.94  -177.788    367.854   -177.788     
1 1 1 3  18 19 o 0 553.3   18.7  535.6  18.7 1979.25 -138.704     2357.5   -138.704    1112.56   -138.704     
1 1 1 1  19 4  o 0 177.7   6     189.1  6    1952.32 -47.1766     428.23   -47.1766    645.435   132.823      
1 1 1 3  19 4  o 0 200.8   6.7   202.5  6.7  1447.33 -76.3819     614.399  -76.3819    166.945   103.618      
1 1 1 4  7  19 o 0 754     23.5  765.1  23.5 2450.92 -0.455124    2400.66  -0.455124   986.519   -0.455124    
1 1 1 4  11 19 o 0 79      3.6   74.1   3.6  1320.45 -24.2912     46.4292  -24.2912    672.818   155.709      
1 1 1 4  13 19 o 0 203.6   8.4   214    8.4  3281.56 71.8506      148.453  71.8506     1606.13   -108.149     
1 1 1 4  15 19 o 0 80.2    4.4   73.2   4.4  1433.72 -169.938     24.0748  -169.938    725.379   10.0617      
1 1 1 4  17 19 o 0 53.9    3.9   56.8   3.9  1640.87 -115.709     256.576  64.2909     1294.53   64.2909      
1 1 1 4  19 5  o 0 256.2   8.2   245.7  8.2  4242.38 -64.0858     257.416  115.914     2727.67   115.914      
1 1 1 5  6  19 o 0 800.2   25.6  782.2  25.6 5030.14 89.0808      1168.46  89.0808     1728.48   -90.9192     
1 1 1 5  8  19 o 0 205.7   7.5   208.4  7.5  2057.65 -5.43052     540.595  -5.43052    633.191   174.569      
1 1 1 5  10 19 o 0 192.7   7.8   209.3  7.8  1832.73 0.65968      568.469  0.65968     463.236   -179.34      
1 1 1 5  12 19 o 0 164.2   6.8   169.1  6.8  2123.75 62.7628      434.294  62.7628     703.55    -117.237     
1 1 1 5  14 19 o 0 496.5   18.3  494.1  18.3 3166.33 -60.8617     1303.79  -60.8617    357.483   119.138      
1 1 1 5  16 19 o 0 165.8   7.1   165.4  7.1  1563.55 122.048      716.849  122.048     277.63    -57.9516     
1 1 1 5  18 19 o 0 272.9   10.5  282.1  10.5 2825.12 -2.76207     786.733  -2.76207    959.132   177.238      
1 1 1 6  7  19 o 0 766.6   25.4  748.2  25.4 2282.94 -173.84      2440.29  -173.84     1136.65   -173.84      
1 1 1 6  9  19 o 0 172.5   7.8   181.4  7.8  382.59  43.7341      255.255  43.7341     39.4661   43.7341      
1 1 1 6  11 19 o 0 540.8   22.3  543.8  22.3 2744.01 -121.168     1682.8   -121.168    208.204   -121.168     
1 1 1 6  13 19 o 0 89.6    4.9   87.7   4.9  1684.41 -173.519     57.2911  -173.519    830.243   6.48098      
1 1 1 6  15 19 o 0 547.1   23    546.9  23   2506.02 -116.063     2146.15  -116.063    543.145   -116.063     
1 1 1 6  17 19 o 0 67      4.3   75.8   4.3  1121.61 -156.367     43.0606  -156.367    655.1     23.6331      
1 1 1 4  19 7  o 0 235     8.3   240.4  8.3  1339.59 -149.363     852.008  -149.363    77.5878   -149.363     
1 1 1 6  19 7  o 0 233.4   8.9   234.2  8.9  2108.35 -82.354      664.511  -82.354     543.43    97.646       
1 1 1 7  8  19 o 0 199.5   7.9   194.9  7.9  3133.99 -118.692     36.5676  -118.692    1737.34   61.3079      
1 1 1 7  10 19 f 1 136.6   6.9   141    6.9  1987.4  127.933      315.217  127.933     763.417   -52.0672     
1 1 1 7  12 19 o 0 426.6   18.6  438.3  18.6 3259.22 -103.275     1063.81  -103.275    662.384   76.7251      
1 1 1 7  14 19 o 0 70.4    4.5   64.8   4.5  490.264 -142.231     45.5844  -142.231    269.969   37.7692      
1 1 1 7  16 19 o 0 -10     3.3   18.7   3.3  762.678 36.6339      413.19   -143.366    891.455   -143.366     
1 1 1 7  18 19 f 1 88      5.1   94.3   5.1  1703.17 -173.572     79.787   -173.572    962.782   6.42837      
1 1 1 1  19 8  o 0 729.4   25.4  719.3  25.4 4229.32 -84.5654     1457.96  -84.5654    1048.9    95.4346      
1 1 1 5  19 8  o 0 802.7   27.6  764.8  27.6 3887.1  99.4232      1747.3   99.4232     475.439   -80.5768     
1 1 1 7  19 8  o 0 583     20.7  552.4  20.7 2385.32 163.976      1835.19  163.976     480.849   163.976      
1 1 1 8  11 19 o 0 605.4   25.2  624.2  25.2 2695.87 113.257      1907.12  113.257     470.326   113.257      
1 1 1 8  13 19 o 0 70.4    4.4   65.5   4.4  2055.67 143.848      228.811  -36.152     1300.9    -36.152      
1 1 1 8  15 19 o 0 67.4    4.8   71.1   4.8  2317.7  -33.8504     380.754  146.15      1845.59   146.15       
1 1 1 2  19 9  o 0 13.9    1.9   15.4   1.9  780.193 -20.7154     370.617  159.285     825.134   159.285      
1 1 1 6  19 9  o 0 386.4   14    385.4  14   3226.65 -130.608     824.334  -130.608    1000.03   49.392       
1 1 1 8  19 9  o 0 111.7   5.4   107.5  5.4  2256.04 94.2411      22.3855  94.2411     1205.23   -85.7589     
1 1 1 9  10 19 o 0 559.7   22.9  553.7  22.9 2501.43 -110.297     1834.66  -110.297    491.526   -110.297     
1 1 1 9  12 19 o 0 151.9   7.6   158.4  7.6  1279.19 -70.1021     577.186  -70.1021    95.2396   109.898      
1 1 1 9  14 19 o 0 152.7   7.5   141.4  7.5  787.343 128.803      591.294  128.803     89.4366   128.803      
1 1 1 9  16 19 f 1 36.4    4.1   28.9   4.1  1595.6  41.206       504.551  -138.794    1499.08   -138.794     
1 1 1 9  18 19 o 0 196.9   8     184.2  8    2073.17 147.912      656.047  147.912     589.073   -32.0876     
1 1 1 1  19 10 o 0 145.5   5.6   133    5.6  1707.19 -42.5503     248.066  -42.5503    752.6     137.45       
1 1 1 3  19 10 o 0 42.5    2.7   52.4   2.7  815.233 -31.6384     193.294  148.362     660.334   148.362      
1 1 1 7  19 10 f 1 469     16.4  430.2  16.4 3050.69 106.058      1240.65  106.058     418.638   -73.9425     
1 1 1 10 13 19 o 0 101.9   5.6   85.2   5.6  699.707 -2.08292     226.6    -2.08292    223.527   177.917      
1 1 1 10 15 19 o 0 73.9    4.6   62.7   4.6  1343.43 105.4        27.9684  -74.6004    868.717   -74.6004     
1 1 1 10 17 19 o 0 5       3.5   3.6    3.5  517.908 161.062      289.479  -18.9382    603.746   -18.9382     
1 1 1 2  19 11 o 0 491.9   16.7  505.5  16.7 2666.73 -128.95      1508.45  -128.95     24.0282   51.0501      
1 1 1 4  19 11 o 0 473.9   15.7  467.7  15.7 2683.42 -119.162     1503.61  -119.162    39.6271   -119.162     
1 1 1 8  19 11 o 0 352.3   14.5  360.8  14.5 2627.4  -71.0911     1089.97  -71.0911    312.584   108.909      
1 1 1 10 19 11 o 0 19.5    2.7   26.5   2.7  1286.65 -7.64589     424.135  172.354     1107.09   172.354      
1 1 1 11 12 19 o 0 65.4    4.7   61.1   4.7  1198.37 -81.8307     48.8226  98.1693     827.463   98.1693      
1 1 1 11 18 19 f 1 82      6     79.2   6    1142.68 79.9656      229.913  79.9656     435.411   -100.034     
1 1 1 1  19 12 o 0 408.8   14.2  429.9  14.2 3176.81 102.586      1116.66  102.586     657.513   -77.4141     
1 1 1 5  19 12 o 0 395.8   13.6  411.4  13.6 1998.64 -155.877     1534.18  -155.877    461.663   -155.877     
1 1 1 9  19 12 o 0 569.3   22.1  547.9  22.1 1982.09 50.8241      2014.1   50.8241     971.211   50.8241      
1 1 1 11 19 12 o 0 193.3   8.5   175.3  8.5  1164.63 16.385       922.297  16.385      165.646   16.385       
1 1 1 12 13 19 o 0 285     12.3  261.9  12.3 1472.31 -128.94      1396.19  -128.94     455.253   -128.94      
1 1 1 12 17 19 o 0 59.6    4.9   45.8   4.9  1868.14 -60.0873     244.655  119.913     1338.54   119.913      
1 1 1 2  19 13 f 1 13.8    2.2   23     2.2  1661.73 22.8661      635.592  -157.134    1548.55   -157.134     
1 1 1 4  19 13 o 0 144.6   5.6   142.5  5.6  957.833 -122.514     512.852  -122.514    0.0390526 57.4864      
1 1 1 8  19 13 o 0 168.7   7.7   169.9  7.7  1533.18 64.4279      615.778  64.4279     184.592   -115.572     
1 1 1 10 19 13 o 0 3.8     2.4   2.2    2.4  1224.35 -99.2791     744.649  80.7209     1532.46   80.7209      
1 1 1 12 19 13 o 0 56.1    4.1   49.2   4.1  1304.08 27.1242      180.368  -152.876    1013.01   -152.876     
1 1 1 13 14 19 o 0 397     16.1  356.3  16.1 2774.53 -171.735     1293.13  -171.735    446.607   8.26461      
1 1 1 13 16 19 o 0 346.6   14.3  300.8  14.3 1785.1  121.312      1574.15  121.312     516.875   121.312      
1 1 1 13 18 19 o 0 134.3   7.2   110.8  7.2  2003.94 132.862      325.938  132.862     818.697   -47.1383     
1 1 1 1  19 14 f 1 449     15.4  441.5  15.4 1172.23 -68.5561     1920.02  -68.5561    1275.25   -68.5561     
1 1 1 5  19 14 o 0 205.9   7.6   212.9  7.6  1621.34 -162.252     813.145  -162.252    38.617    17.7485      
1 1 1 9  19 14 o 0 269.2   10.3  272.2  10.3 2495.23 -156.502     951.778  -156.502    639.374   23.4982      
1 1 1 11 19 14 o 0 115.5   6.2   116.7  6.2  2435.58 146.943      6.70089  -33.057     1545.97   -33.057      
1 1 1 13 19 14 o 0 48.2    3.9   46     3.9  807.127 33.6119      113.996  -146.388    619.283   -146.388     
1 1 1 14 15 19 o 0 8.6     3.7   7      3.7  952.272 19.1438      508.704  -160.856    1092.99   -160.856     
1 1 1 14 17 19 o 0 182.3   9.3   178.7  9.3  1417.07 -54.8885     912.781  -54.8885    93.8569   -54.8885     
1 1 1 2  19 15 o 0 481.1   16.3  486.6  16.3 2832.87 120.222      1446.02  120.222     66.6364   -59.7779     
1 1 1 4  19 15 o 0 343.6   12    338.9  12   2014.89 9.16619      1259.89  9.16619     205.336   9.16619      
1 1 1 6  19 15 o 0 574.5   20.7  604.7  20.7 1860.65 93.0998      2616.94  93.0998     1425.6    93.0998      
1 1 1 8  19 15 o 0 644.6   22.6  645.4  22.6 2889.11 131.044      2259.55  131.044     432.561   131.044      
1 1 1 10 19 15 o 0 225.7   9.7   229.2  9.7  2273.35 -69.3752     809.723  -69.3752    612.903   110.625      
1 1 1 12 19 15 o 0 227.2   9.7   211    9.7  1616.9  88.17        1017.15  88.17       15.5426   88.17        
1 1 1 14 19 15 o 0 342.4   14.6  335.7  14.6 1943.22 -76.7708     1492.67  -76.7708    302.772   -76.7708     
1 1 1 15 16 19 f 1 49.7    4.5   32.1   4.5  1503.89 12.9925      247.373  -167.007    1131.52   -167.007     
1 1 1 15 18 19 o 0 277.2   11.3  220    11.3 1631.79 107.65       1208.5   107.65      290.904   107.65       
1 1 1 1  19 16 o 0 170.3   6.9   170.2  6.9  2024.02 -96.8849     607.552  -96.8849    733.249   83.1151      
1 1 1 3  19 16 o 0 89.5    4.2   90.3   4.2  1219.17 -0.0515676   196.702  -0.0515676  593.466   179.948      
1 1 1 5  19 16 o 0 399.2   13.6  391.5  13.6 3439.12 -45.9771     1019.21  -45.9771    1170.2    134.023      
1 1 1 9  19 16 f 1 157     6.7   150.5  6.7  3144.95 -152.741     107.505  27.2593     2068.05   27.2593      
1 1 1 11 19 16 o 0 458.3   17.3  448.8  17.3 2823.06 -36.825      1547.96  -36.825     182.612   143.175      
1 1 1 13 19 16 o 0 213.4   9.8   202.5  9.8  1699.5  74.761       1011.31  74.761      5.92355   74.761       
1 1 1 15 19 16 f 1 152.6   7.6   134.2  7.6  1998.3  -179.058     475.985  -179.058    696.348   0.942122     
1 1 1 16 17 19 o 0 348.4   14.5  305.9  14.5 2538.41 -108.097     1190.31  -108.097    253.433   71.9034      
1 1 1 2  19 17 o 0 45      3.5   45.7   3.5  494.454 63.9692      71.8828  -116.031    391.089   -116.031     
1 1 1 4  19 17 o 0 480.9   16.5  486.4  16.5 2193.73 -130.721     2043.64  -130.721    654.889   -130.721     
1 1 1 10 19 17 o 0 368.3   14.1  350.6  14.1 1313.35 -13.4599     1759.53  -13.4599    962.681   -13.4599     
1 1 1 12 19 17 o 0 326.2   12.8  308.9  12.8 1624.78 -166.186     1583.85  -166.186    633.003   -166.186     
1 1 1 14 19 17 o 0 116.2   6.9   110.2  6.9  1339.66 -75.1522     468.71   -75.1522    304.589   104.848      
1 1 1 16 19 17 o 0 139.9   8.9   98.7   8.9  574.258 46.7203      443.163  46.7202     117.148   46.7202      
1 1 1 1  19 18 o 0 15.6    3.3   14.7   3.3  1013.75 157.352      484.349  -22.6478    1135.65   -22.6478     
1 1 1 3  19 18 o 0 89.4    4.6   96.9   4.6  1975.76 -169.121     4.25023  -169.121    1239.11   10.8792      
1 1 1 5  19 18 o 0 334.3   12.8  329    12.8 2095.39 8.26591      1407.84  8.26591     112.454   8.26591      
1 1 1 7  19 18 f 1 486     17.1  487.1  17.1 2693.67 -24.7375     1721.95  -24.7375    72.6986   -24.7375     
1 1 1 9  19 18 o 0 185.9   7.7   189.6  7.7  2571.7  76.0109      410.208  76.0109     1134.38   -103.989     
1 1 1 11 19 18 f 1 183.7   8.3   176.2  8.3  2690.62 91.2633      376.295  91.2633     1190.04   -88.7367     
1 1 1 2  19 19 o 0 424.4   14.8  398.4  14.8 1872.69 -174.36      1872.74  -174.36     702.147   -174.36      
1 1 1 4  19 19 o 0 4.1     3.6   8      3.6  315.237 -57.1013     172.913  122.899     366.293   122.899      
1 1 1 6  19 19 o 0 227.5   10.1  194.8  10.1 2959.34 -87.0161     355.543  -87.0161    1430.11   92.9839      
1 1 1 8  19 19 o 0 548.1   19.5  552.7  19.5 2293.86 6.37464      2190.83  6.37464     859.09    6.37464      
1 1 1 10 19 19 o 0 323.6   12.1  305.7  12.1 1792.81 -124.246     1474.59  -124.246    448.079   -124.246     
1 1 1 12 19 19 o 0 400.5   16.6  365.2  16.6 1838.07 15.5297      1722.7   15.5297     685.037   15.5297      
1 1 1 14 19 19 o 0 200.6   10.5  194    10.5 1748.42 111.758      873.749  111.758     97.9766   -68.2421     
1 1 1 16 19 19 o 0 181.8   10.8  114.6  10.8 1298.75 -55.1091     911.871  -55.1091    19.4018   -55.1091     
1 1 1 18 19 19 o 0 152.7   11.4  127.2  11.4 1580.67 54.5019      701.805  54.5019     347.253   -125.498     
1 1 1 1  20 1  o 0 57.5    2.3   49.2   2.3  2374.86 -15.3849     672.829  164.615     2060.05   164.615      
1 1 1 1  3  20 o 0 78      3.3   83.2   3.3  1571.52 143.922      147.37   -36.0779    1070.24   -36.0779     
1 1 1 1  5  20 o 0 158.1   6     165    6    1813.21 116.638      364.344  116.638     699.859   -63.3616     
1 1 1 1  9  20 o 0 833.5   26    849.6  26   1792.74 115.955      2875.49  115.955     1838.7    115.955      
1 1 1 1  11 20 o 0 116.6   4.7   119.7  4.7  2047.9  -125.676     164.682  -125.676    965.736   54.3239      
1 1 1 1  13 20 o 0 580.3   19.7  599.7  19.7 2470.78 91.0882      1967.26  91.0882     628.727   91.0882      
1 1 1 1  15 20 o 0 94.9    4.3   99.8   4.3  1121.42 -88.8787     276.591  -88.8787    461.156   91.1213      
1 1 1 1  17 20 o 0 112.7   5.1   104.8  5.1  967.515 146.818      361.98   146.818     257.284   -33.1821     
1 1 1 1  19 20 o 0 483.1   17.1  466.7  17.1 1432.79 86.8067      2258.29  86.8067     1369.8    86.8067      
1 1 1 2  4  20 f 1 695.7   23.4  705.2  23.4 3227.65 56.0777      1872.54  56.0777     12.1467   -123.922     
1 1 1 2  10 20 o 0 308.1   10.3  299.9  10.3 2604.53 95.3596      918.115  95.3596     513.203   -84.6404     
1 1 1 2  16 20 o 0 524.2   19.6  528.4  19.6 3191.86 -130.318     1699     -130.318    351.049   49.682       
1 1 1 2  18 20 o 0 142.2   6.7   163.1  6.7  2113.6  -133.345     417.976  -133.345    900.783   46.6552      
1 1 1 1  20 3  o 0 12.7    1.3   13.4   1.3  1789.04 -109.392     883.237  70.6076     1932.49   70.6076      
1 1 1 3  20 3  o 0 927.9   28.8  913.5  28.8 4818.1  -179.148     1617.49  -179.148    1159.98   0.85243      
1 1 1 3  13 20 o 0 255.6   9.5   264.8  9.5  3492.83 167.369      286.799  167.369     1564.33   -12.6313     
1 1 1 3  15 20 o 0 158.1   6.4   154.9  6.4  1616.98 -115.394     646.435  -115.394    395.009   64.606       
1 1 1 3  17 20 o 0 331.9   13.7  362.3  13.7 1940.32 10.4692      1570.15  10.4692     353.18    10.4692      
1 1 1 4  20 4  o 0 43.4    2.2   46     2.2  560.691 -164.492     141.53   15.5076     462.623   15.5076      
1 1 1 4  6  20 o 0 867.5   27.5  906.4  27.5 2530.66 101.189      2661.24  101.189     1222.61   101.189      
1 1 1 4  8  20 o 0 6.1     1.2   6.8    1.2  815.536 -161.264     422.136  18.7358     881.845   18.7358      
1 1 1 4  12 20 o 0 666.9   24    668.4  24   3161.52 40.4858      1831.74  40.4858     155.278   40.4858      
1 1 1 4  14 20 o 0 179.2   7.3   169.8  7.3  2171.94 -150.488     554.695  -150.488    847.759   29.5119      
1 1 1 4  16 20 o 0 70.8    4.5   72.3   4.5  1499.84 58.4294      40.3305  -121.571    985.428   -121.571     
1 1 1 4  18 20 o 0 199.4   8.2   188.6  8.2  1821.42 63.235       789.73   63.235      325.78    -116.765     
1 1 1 1  20 5  o 0 739.7   22.1  714.3  22.1 2824.52 -46.5589     2176.47  -46.5589    519.841   -46.5589     
1 1 1 5  20 5  o 0 572.2   19    571.4  19   2732.7  -94.5346     1698.51  -94.5346    144.205   -94.5346     
1 1 1 5  7  20 o 0 182.3   6.7   180.2  6.7  1041.06 -105.04      522.794  -105.04     63.0569   74.9604      
1 1 1 5  9  20 o 0 98.1    4.1   93.1   4.1  1147.46 -125.726     212.506  -125.726    405.753   54.2737      
1 1 1 5  15 20 o 0 592.1   22.1  608.6  22.1 3067.03 77.4868      2010.63  77.4868     69.2911   77.4868      
1 1 1 5  17 20 f 1 260.7   10.6  267.6  10.6 1944.18 160.333      1135.53  160.333     69.5378   -19.6673     
1 1 1 5  19 20 o 0 474.5   17.3  473.2  17.3 3759.8  -106.567     1166.84  -106.567    1027.82   73.4333      
1 1 1 6  20 6  o 0 74.8    3.4   71.8   3.4  703.762 -51.722      42.1783  128.278     439.543   128.278      
1 1 1 6  8  20 o 0 44.6    2.3   38.9   2.3  1464.33 169.519      298.708  -10.4808    1088.38   -10.4808     
1 1 1 6  10 20 o 0 305     13.4  316.1  13.4 2357.96 -163.968     1021.22  -163.968    232.97    16.032       
1 1 1 6  14 20 o 0 154.3   7.2   164.6  7.2  1046.72 -76.0895     729.993  -76.0895    64.3488   -76.0895     
1 1 1 6  16 20 f 1 580.3   20.5  543.3  20.5 2814.18 57.6069      1966     57.6069     210.794   57.6069      
1 1 1 6  18 20 o 0 504     18.1  517.6  18.1 2349.54 -173.082     1970.37  -173.082    554.717   -173.082     
1 1 1 5  20 7  o 0 491.9   16.1  474.3  16.1 3319.53 -106.466     1122.76  -106.466    750.426   73.5343      
1 1 1 7  20 7  o 0 718.2   23.5  680.7  23.5 3885.85 71.5233      1605.74  71.5233     501.218   -108.477     
1 1 1 7  9  20 o 0 126.1   5.5   120.6  5.5  1692.46 -146.74      307.378  -146.74     595.625   33.2603      
1 1 1 7  11 20 o 0 504.7   21.4  503.6  21.4 3892.65 19.6843      984.265  19.6843     1058.6    -160.316     
1 1 1 7  15 20 o 0 53.3    4.2   38.6   4.2  620.403 -61.1932     81.7466  118.807     468.977   118.807      
1 1 1 7  17 20 o 0 296.5   13.4  297.7  13.4 1965.8  100.306      1276.38  100.306     82.7466   100.306      
1 1 1 7  19 20 o 0 81.5    5.2   79.2   5.2  1252.07 -107.794     210.708  -107.794    508.763   72.2064      
1 1 1 2  20 8  o 0 360.9   13.3  359.6  13.3 3762.95 2.72472      467.629  2.72472     1696.4    -177.275     
1 1 1 4  20 8  o 0 356.9   12.9  341.5  12.9 3685.2  168.484      455.758  168.484     1626.09   -11.5163     
1 1 1 8  10 20 o 0 277.6   12.5  285.1  12.5 2711.78 -147.354     738.712  -147.354    691.579   32.6459      
1 1 1 8  12 20 o 0 19      2.7   12.6   2.7  1425.24 -142.606     672.103  37.3943     1588.44   37.3943      
1 1 1 8  16 20 o 0 153.5   8.3   151.9  8.3  1891.17 -174.389     496.047  -174.389    661.291   5.61116      
1 1 1 8  18 20 o 0 103.6   7     101.3  7    907.266 113.325      415.087  113.325     110.979   -66.6746     
1 1 1 5  20 9  o 0 147.5   5.9   142.5  5.9  3214.02 164.981      170.294  -15.0194    1906.1    -15.0194     
1 1 1 9  20 9  o 0 217.9   9.9   230.9  9.9  2698.76 -14.4671     492.682  -14.4671    941.785   165.533      
1 1 1 9  11 20 f 1 363.7   16    363.8  16   3130.91 -173.985     854.954  -173.985    784.747   6.01495      
1 1 1 9  13 20 f 1 196.5   9.3   186.2  9.3  1809.25 -172.747     800.072  -172.747    351.644   7.25343      
1 1 1 9  15 20 o 0 56.3    4.7   51.1   4.7  334.517 133.017      14.8218  -46.9827    221.202   -46.9827     
1 1 1 9  19 20 o 0 239.8   11.2  239.6  11.2 2230.22 -5.93175     916.853  -5.93175    346.022   174.068      
1 1 1 4  20 10 o 0 134.8   5.5   130.3  5.5  2076.63 39.0141      247.232  39.0141     874.458   -140.986     
1 1 1 6  20 10 o 0 100.6   4.7   97.9   4.7  1296.76 -26.0049     219.882  -26.0049    471.365   153.995      
1 1 1 8  20 10 o 0 538.9   20.4  489.8  20.4 2478.82 114.608      1687.49  114.608     377.77    114.608      
1 1 1 10 20 10 o 0 171.6   8.5   189.8  8.5  1622.62 16.5912      663.585  16.5912     188.294   -163.409     
1 1 1 10 16 20 o 0 521.7   20.6  490.9  20.6 2760.36 -70.5321     1755.95  -70.5321    86.6315   -70.5321     
1 1 1 10 18 20 f 1 231.2   9.9   200.2  9.9  1803.81 9.48341      981.78   9.48341     55.7549   -170.517     
1 1 1 5  20 11 o 0 316.1   11.9  313.5  11.9 1508.33 87.143       1331.2   87.143      528.854   87.143       
1 1 1 7  20 11 o 0 657.8   22.7  606.6  22.7 3866.32 26.308       1382.28  26.308      650.348   -153.692     
1 1 1 9  20 11 f 1 165.7   7.5   154.7  7.5  1995.43 -103.914     428.544  -103.914    617.498   76.0856      
1 1 1 11 20 11 o 0 119.3   6.1   109.7  6.1  786.422 -152.605     381.349  -152.605    124.489   27.3947      
1 1 1 11 15 20 o 0 551     21.8  508.4  21.8 2549.69 156.266      1966.15  156.266     409.605   156.266      
1 1 1 11 17 20 o 0 295.2   12.6  269.6  12.6 2500.6  -103.254     1020.59  -103.254    424.11    76.7457      
1 1 1 11 19 20 o 0 18.1    5     13     5    1978.01 77.1221      784.901  -102.878    1888.75   -102.878     
1 1 1 8  20 12 o 0 575.8   22.5  571.7  22.5 2910.68 -116.188     2037.75  -116.188    164.181   -116.188     
1 1 1 12 20 12 o 0 82.5    5     83.3   5    1023.16 -15.5487     152.49   -15.5487    494.919   164.451      
1 1 1 12 14 20 o 0 156.8   8     147.1  8    1456.29 -98.3803     627.029  -98.3803    270.679   81.6197      
1 1 1 12 16 20 o 0 13.8    3.9   12.9   3.9  891.012 -171.795     374.545  8.20459     894.567   8.20459      
1 1 1 3  20 13 o 0 727.2   24.1  718.7  24.1 3252.07 140.281      1941.75  140.281     214.556   140.281      
1 1 1 5  20 13 o 0 639.8   21.4  657.1  21.4 4006.36 -55.7044     1347.65  -55.7044    743.423   124.296      
1 1 1 7  20 13 f 1 324.4   12.3  337.9  12.3 2723.54 166.993      1128.59  166.993     624.463   -13.0069     
1 1 1 9  20 13 f 1 476.3   18.4  453.1  18.4 3279.2  77.4971      1379.9   77.4971     708.57    -102.503     
1 1 1 11 20 13 f 1 215.1   9.3   202.6  9.3  485.804 135.886      709.441  135.886     402.95    135.886      
1 1 1 13 20 13 o 0 527.1   21.3  505.7  21.3 2665.58 15.2079      1889.81  15.2079     234.38    15.2079      
1 1 1 13 17 20 o 0 96.8    6.2   81.1   6.2  1721.79 -130.22      164.635  -130.22     816.918   49.7797      
1 1 1 4  20 14 o 0 140.3   5.7   127.6  5.7  1878.32 12.7507      391.169  12.7507     823.998   -167.249     
1 1 1 6  20 14 o 0 197.7   7.3   195.6  7.3  1712.47 -112.996     876.921  -112.996    213.662   67.0037      
1 1 1 8  20 14 o 0 228.7   8.8   228.3  8.8  1815.65 -126.103     1018.67  -126.103    123.144   53.8973      
1 1 1 10 20 14 o 0 129.1   6.4   128.5  6.4  698.922 144.589      433.568  144.589     1.23868   -35.4109     
1 1 1 12 20 14 o 0 379.7   15.7  365.3  15.7 3647.17 4.5293       770.821  4.5293      1474.1    -175.471     
1 1 1 14 20 14 o 0 35.6    4.5   40.3   4.5  672.193 -25.8055     86.4677  154.194     485.595   154.194      
1 1 1 14 16 20 f 1 -6.4    4.4   4.2    4.4  826.961 -126.224     452.267  53.7758     931.361   53.7758      
1 1 1 1  20 15 o 0 338.7   12.6  345.8  12.6 2826.82 -88.5376     1166.84  -88.5376    697.306   91.4624      
1 1 1 7  20 15 o 0 335.8   12.5  345.8  12.5 2293.03 -37.4134     1372.67  -37.4134    59.943    142.587      
1 1 1 11 20 15 o 0 42.4    4     42.3   4    1791.28 4.21708      452.256  -175.783    1544.98   -175.783     
1 1 1 13 20 15 o 0 254.4   10.8  220.9  10.8 2256.75 -87.5585     934.442  -87.5585    393.475   92.4415      
1 1 1 15 20 15 o 0 169.1   8.3   148.6  8.3  1869.71 106.808      633.13   106.808     451.179   -73.1915     
1 1 1 15 17 20 o 0 350.4   14.8  316.7  14.8 2085.31 -163.252     1408.17  -163.252    237.573   -163.252     
1 1 1 4  20 16 o 0 512.9   17.6  533.4  17.6 2044.57 70.1376      2257.93  70.1376     967.555   70.1376      
1 1 1 10 20 16 o 0 91.8    5     95.7   5    901.799 -33.9418     229.996  -33.9418    315.234   146.058      
1 1 1 12 20 16 o 0 194.9   9.4   196.6  9.4  2020.76 -160.253     796.917  -160.253    381.072   19.7467      
1 1 1 14 20 16 f 1 313.3   13    269.9  13   1938.73 141.192      1314.38  141.192     193.816   141.192      
1 1 1 16 18 20 o 0 19.1    5.6   23.1   5.6  401.104 111.232      150.632  -68.7679    426.184   -68.7679     
1 1 1 1  20 17 o 0 351.5   13    359.2  13   2317.07 -141.265     1464.43  -141.265    21.4452   38.7346      
1 1 1 3  20 17 o 0 97.3    4.9   102.4  4.9  701.81  -145.832     258.81   -145.832    182.026   34.1677      
1 1 1 5  20 17 f 1 210.4   7.8   198.8  7.8  1169.9  121.354      999.464  121.354     273.521   121.354      
1 1 1 7  20 17 o 0 391.9   14.3  404.7  14.3 2025.94 -41.1566     1702     -41.1566    471.042   -41.1566     
1 1 1 9  20 17 o 0 466.8   17.1  464.2  17.1 1960.11 -11.6873     1968.18  -11.6873    793.544   -11.6873     
1 1 1 11 20 17 o 0 495.6   19.4  496.7  19.4 2896.2  -124.251     1690.64  -124.251    18.3107   -124.251     
1 1 1 15 20 17 o 0 103.9   7.4   107.1  7.4  1538.11 46.6755      348.386  46.6755     513.025   -133.325     
1 1 1 17 19 20 o 0 187.7   10.9  99.8   10.9 1869.21 -55.6375     686.882  -55.6375    542.063   124.362      
1 1 1 2  20 18 o 0 331.5   12.2  326.7  12.2 1544.47 160.442      1621.28  160.442     656.406   160.442      
1 1 1 4  20 18 o 0 66.1    4.1   50.9   4.1  1039.04 68.0084      52.8633  -111.992    689.824   -111.992     
1 1 1 6  20 18 o 0 152.7   7.7   147    7.7  2769.72 -132.907     72.9531  -132.907    1596.94   47.0931      
1 1 1 8  20 18 o 0 118.4   5.8   114.7  5.8  1033.69 176.992      527.914  176.992     71.6188   -3.0083      
1 1 1 10 20 18 f 1 171.6   8.8   182.4  8.8  1705.5  114.743      792.67   114.743     188.175   -65.2572     
1 1 1 16 20 18 o 0 160.6   10.9  118.3  10.9 1124.89 87.6164      834.517  87.6164     63.2486   87.6164      
1 1 1 18 20 18 o 0 245.8   14.2  188.6  14.2 789.884 128.576      1276.17  128.576     753.342   128.576      
1 1 1 1  20 19 o 0 292.2   10.7  273    10.7 3093.4  127.835      671.745  127.835     1248.02   -52.1649     
1 1 1 3  20 19 o 0 9.7     3.8   4.1    3.8  881.788 -114.325     471.632  65.6748     1008.32   65.6748      
1 1 1 9  20 19 o 0 424.4   15.8  435.5  15.8 3102.55 -14.7989     1313.61  -14.7989    443.295   165.201      
1 1 1 11 20 19 o 0 159.5   8.3   153.1  8.3  1721.61 -174.279     644.339  -174.279    316.234   5.72116      
1 1 1 15 20 19 o 0 86.9    9.7   100.5  9.7  1139.44 -63.5829     402.982  -63.5829    370.995   116.417      
1 1 1 17 20 19 o 0 22      8.7   46.1   8.7  1253.98 -127.996     262.359  52.0043     1085.83   52.0043      
1 1 1 19 20 19 f 1 107.4   11.1  65.6   11.1 1716.27 77.0835      188.728  77.0835     915.526   -102.916     
1 1 1 2  20 20 o 0 186.5   7.8   156.3  7.8  1470.16 69.2065      866.66   69.2065     0.134203  69.2065      
1 1 1 4  20 20 o 0 250     9.6   259.1  9.6  2614.84 -166.17      829.099  -166.17     684.586   13.8295      
1 1 1 6  20 20 o 0 202.7   8.5   193.3  8.5  1303.39 134.208      1026.96  134.208     284.872   134.208      
1 1 1 8  20 20 o 0 363.5   13.8  396.2  13.8 2822.61 -35.5109     1250.08  -35.5109    332.164   144.489      
1 1 1 10 20 20 o 0 117.6   6.8   125.2  6.8  1535.99 -134.83      462.658  -134.83     385.315   45.1698      
1 1 1 12 20 20 o 0 384.1   15.6  312.6  15.6 1956.79 153.83       1869.4   153.83      530.267   153.83       
1 1 1 14 20 20 o 0 67.8    7.8   78.9   7.8  2182.9  -27.6061     187.769  152.394     1655.57   152.394      
1 1 1 16 20 20 o 0 11.7    8.7   26.9   8.7  1448.13 77.9768      576.425  -102.023    1518.82   -102.023     
1 1 1 18 20 20 o 0 22.7    9.2   -0.2   9.2  1134.53 174.436      533.229  -5.56392    1253.78   -5.56392     
1 1 1 1  6  21 o 0 355.3   12.1  341.8  12.1 2364.74 118.108      1083.93  118.108     272.312   -61.8922     
1 1 1 1  8  21 o 0 507.4   16.6  486.8  16.6 3329.24 96.993       1296.91  96.993      538.39    -83.007      
1 1 1 1  10 21 o 0 669.2   20.3  628.4  20.3 2887.89 0.745963     1961.6   0.745963    388.177   0.745963     
1 1 1 1  14 21 f 1 637.5   21.5  654.8  21.5 2941.31 -79.0074     2297.53  -79.0074    367.268   -79.0074     
1 1 1 1  16 21 o 0 214.3   8     207    8    1233.81 106.743      1066.37  106.743     281.119   106.743      
1 1 1 1  18 21 o 0 396.4   14.2  389.4  14.2 2961.88 -172.591     1241.12  -172.591    589.55    7.40904      
1 1 1 1  20 21 o 0 135     6.8   139.1  6.8  976.713 36.1452      676.067  36.1452     105.99    36.1452      
1 1 1 1  21 2  o 0 863.4   26.1  870.8  26.1 4017.39 -34.5116     1903.52  -34.5116    403.324   145.488      
1 1 1 2  5  21 o 0 409.9   14.1  425.1  14.1 3033.28 71.4774      1039.55  71.4774     684.221   -108.523     
1 1 1 2  7  21 o 0 124.5   4.7   111.3  4.7  1464.29 75.1408      147.406  75.1408     680.371   -104.859     
1 1 1 2  11 21 o 0 730.7   22.8  720.8  22.8 4619.48 154.866      1284.2   154.866     1185.66   -25.1341     
1 1 1 2  13 21 o 0 11.5    2.3   17.3   2.3  918.051 -72.5765     447.592  107.423     1046.64   107.423      
1 1 1 2  15 21 o 0 182.9   7.3   193.6  7.3  1024.68 -2.50535     918.707  -2.50535    264.903   -2.50535     
1 1 1 2  17 21 o 0 276.3   10.5  273.7  10.5 3202.49 86.5365      573.192  86.5365     1416.46   -93.4635     
1 1 1 2  19 21 o 0 493.9   17.5  485.3  17.5 2801.06 27.4674      1748.83  27.4674     101.115   27.4674      
1 1 1 3  6  21 o 0 845.4   27.1  819.3  27.1 4051.77 -70.1361     1756.86  -70.1361    519.096   109.864      
1 1 1 3  10 21 o 0 772.8   24.9  755.5  24.9 4587.95 -72.8005     1397.83  -72.8005    1048.85   107.199      
1 1 1 3  12 21 o 0 370.4   13.5  391.4  13.5 2425.35 -121.769     1249.21  -121.769    23.707    58.2311      
1 1 1 3  18 21 o 0 158.7   7.4   152.3  7.4  2606.95 -54.0333     193.08   -54.0333    1387.94   125.967      
1 1 1 3  20 21 o 0 536.6   19.5  533.9  19.5 2476.82 -115.816     2023.51  -115.816    603.696   -115.816     
1 1 1 4  5  21 o 0 98.9    4.1   109.1  4.1  523.189 -75.1296     82.2184  -75.1296    210.162   104.87       
1 1 1 4  7  21 o 0 822.3   25.4  829.2  25.4 4607.55 145.171      1557.75  145.171     919.395   -34.8287     
1 1 1 4  9  21 o 0 51.3    2.6   49.6   2.6  1655.89 -24.6253     267.451  155.375     1148.67   155.375      
1 1 1 4  13 21 o 0 60.5    3.8   56.8   3.8  1359.66 -118.832     134.214  61.1681     1004.84   61.1681      
1 1 1 4  15 21 o 0 387.4   14.5  377.4  14.5 1546.47 -39.8098     1867.6   -39.8098    899.104   -39.8098     
1 1 1 4  17 21 o 0 322.4   12.8  328.5  12.8 2682.74 -97.7295     1077.46  -97.7295    559.092   82.2705      
1 1 1 4  19 21 o 0 17.2    4.9   30.6   4.9  866.55  111.284      241.263  -68.7164    742.026   -68.7164     
1 1 1 2  21 5  o 0 499.8   15.8  514.6  15.8 1565.1  111.551      1908.03  111.551     1017.18   111.551      
1 1 1 5  6  21 f 1 272.7   9.6   284.5  9.6  3218.88 50.9192      495.223  50.9192     1240.69   -129.081     
1 1 1 5  8  21 o 0 20.7    2     16.4   2    797.402 145.375      288.325  -34.6246    712.145   -34.6246     
1 1 1 5  10 21 o 0 279.7   10.6  307.2  10.6 2334.84 17.1144      949.055  17.1144     276.244   -162.886     
1 1 1 5  12 21 o 0 -1      2.2   2      2.2  1166.83 -57.4229     726.786  122.577     1475.29   122.577      
1 1 1 5  14 21 o 0 582.7   20.8  545.4  20.8 3194.24 97.569       1799.54  97.569      207.996   -82.431      
1 1 1 5  18 21 o 0 444     16.8  435    16.8 2005.22 2.48294      1928.77  2.48294     761.456   2.48294      
1 1 1 5  20 21 o 0 132.1   6.8   124.1  6.8  1796.72 63.9877      435.833  63.9877     576.799   -116.012     
1 1 1 3  21 6  o 0 712.9   24.1  691.9  24.1 2980.17 52.5263      1948.12  52.5263     270.217   52.5263      
1 1 1 5  21 6  f 1 673.6   22    660.8  22   3687.64 -4.56889     1591.08  -4.56889    403.719   175.431      
1 1 1 6  7  21 o 0 683     23.1  705.4  23.1 3439.25 -81.1868     1776.75  -81.1868    50.8984   98.8132      
1 1 1 6  9  21 o 0 308.7   11.2  320.1  11.2 2445.66 -135.855     987.709  -135.855    296.996   44.1451      
1 1 1 6  11 21 o 0 212.9   8.5   217.1  8.5  1836.87 -74.0721     767.043  -74.0721    183.238   105.928      
1 1 1 6  13 21 o 0 107.3   5.4   113.5  5.4  137.441 135.521      79.9899  135.521     6.70929   -44.4785     
1 1 1 6  15 21 o 0 59.5    4.3   55.5   4.3  1819.12 -93.4577     290.04   86.5423     1411.63   86.5423      
1 1 1 6  19 21 o 0 25.3    3.8   14.2   3.8  1301.04 75.6487      436.39   -104.351    1176.03   -104.351     
1 1 1 2  21 7  o 0 709.9   21.6  720.4  21.6 3288.9  -139.896     1846.45  -139.896    16.5893   40.1044      
1 1 1 6  21 7  o 0 80.5    3.7   81.1   3.7  1204.43 85.6859      96.0776  85.6859     545.836   -94.3141     
1 1 1 7  8  21 o 0 348.7   12.6  364.1  12.6 2041.37 -84.4434     1315.71  -84.4434    241.308   -84.4434     
1 1 1 7  10 21 o 0 59.8    4     58.8   4    944.831 79.9357      31.3742  -100.064    521.614   -100.064     
1 1 1 7  12 21 o 0 324.7   13.8  301.3  13.8 2335.2  90.9804      1239.72  90.9804     239.378   -89.0196     
1 1 1 7  16 21 f 1 20.6    4.5   28.7   4.5  580.347 -114.05      200.637  65.9502     553.353   65.9502      
1 1 1 7  18 21 f 1 33.9    4.8   25.6   4.8  2136.53 69.5465      648.258  -110.454    1879.82   -110.454     
1 1 1 7  20 21 f 1 1.2     4.3   -1     4.3  1312.71 175.709      686.524  -4.2915     1418.69   -4.2915      
1 1 1 1  21 8  o 0 278.2   9.7   292.5  9.7  3438.71 178.144      440.188  178.144     1459.34   -1.85644     
1 1 1 5  21 8  o 0 439.2   16.2  429    16.2 2988.96 -92.898      1204.41  -92.898     388.608   87.102       
1 1 1 7  21 8  o 0 567.8   20.9  566.2  20.9 3982.44 35.781       1139.14  35.781      962.052   -144.219     
1 1 1 8  9  21 o 0 183.3   7.7   188    7.7  1188.88 144.587      745.107  144.587     125.908   144.587      
1 1 1 8  11 21 o 0 3       2.5   2.2    2.5  398.124 118.232      240.41   -61.7682    493.758   -61.7682     
1 1 1 8  15 21 o 0 129.9   7.4   129.5  7.4  1939.86 -127.243     311.048  -127.243    869.289   52.7566      
1 1 1 8  19 21 o 0 36.2    5.5   38.3   5.5  1315.97 -39.9425     236.406  140.057     973.141   140.057      
1 1 1 2  21 9  o 0 87.4    4.3   97.7   4.3  888.64  100.706      200.027  100.706     282.935   -79.2941     
1 1 1 8  21 9  o 0 280.8   10.8  277.4  10.8 822.023 -101.369     1116.81  -101.369    687.926   -101.369     
1 1 1 9  12 21 o 0 264.5   11.5  237.9  11.5 2296.94 -100.324     933.825  -100.324    506.83    79.6763      
1 1 1 9  14 21 o 0 344.9   16    363.3  16   2308.74 -125.524     1397.12  -125.524    17.5366   54.4762      
1 1 1 9  16 21 o 0 106.6   6.9   97.9   6.9  1762.38 62.5731      155.943  62.5731     895.289   -117.427     
1 1 1 9  18 21 o 0 28.3    5.5   28     5.5  759.251 -93.623      180.235  86.377      609.179   86.377       
1 1 1 9  20 21 o 0 215.7   10.2  195.1  10.2 1576.11 59.5848      960.677  59.5848     100.107   59.5848      
1 1 1 3  21 10 o 0 495     17.1  456.3  17.1 2597.86 -126.647     1529.63  -126.647    140.433   -126.647     
1 1 1 9  21 10 o 0 87.2    5.1   90.9   5.1  1319.37 87.1717      170.021  87.1717     674.767   -92.8283     
1 1 1 10 17 21 o 0 103.1   6.9   87.7   6.9  902.703 -102.608     358.308  -102.608    156.281   77.392       
1 1 1 10 19 21 f 1 26.3    5.1   29.4   5.1  2131.75 -12.9529     654.359  167.047     1836.63   167.047      
1 1 1 4  21 11 o 0 23.1    2.4   15.4   2.4  878.764 104.265      306.965  -75.7354    769.274   -75.7354     
1 1 1 6  21 11 o 0 503.7   17.5  477.1  17.5 1550.24 87.3129      1913.04  87.3129     1109.3    87.3129      
1 1 1 8  21 11 o 0 120.7   5.4   123    5.4  1383.93 -39.1193     434.506  -39.1193    447.287   140.881      
1 1 1 11 12 21 o 0 213.1   10.2  209.3  10.2 3161.15 34.4179      251.616  34.4179     1714.49   -145.582     
1 1 1 11 14 21 o 0 35.2    4.9   57     4.9  223.421 -178.485     22.323   1.51549     157.785   1.51549      
1 1 1 11 16 21 o 0 494.3   19.8  456    19.8 2934.49 159.909      1590.49  159.909     97.3747   -20.0913     
1 1 1 11 18 21 o 0 258     11.3  217.5  11.3 1098.5  53.6235      1243.99  53.6235     632.239   53.6235      
1 1 1 11 20 21 o 0 347.2   15    323.5  15   3253.87 -21.8031     1024.84  -21.8031    1177.25   158.197      
1 1 1 1  21 12 o 0 593.4   20.2  624.8  20.2 4306.61 -23.0222     1124.55  -23.0222    1191.75   156.978      
1 1 1 3  21 12 o 0 500.4   16.9  503    16.9 3793.25 -30.4033     1028.76  -30.4033    967.846   149.597      
1 1 1 5  21 12 o 0 137.8   5.4   133.5  5.4  1321.21 65.1172      557.069  65.1172     292.485   -114.883     
1 1 1 7  21 12 o 0 308.8   11.3  294.5  11.3 1758.94 0.452073     1441.7   0.452073    325.803   0.452073     
1 1 1 9  21 12 o 0 393.6   16    385.8  16   1339.85 -98.4522     1950.6   -98.4522    1109.85   -98.4522     
1 1 1 11 21 12 o 0 215.8   9.9   216    9.9  2103.4  -31.6143     815.598  -31.6143    491.08    148.386      
1 1 1 12 13 21 o 0 407.8   17.1  369    17.1 1413.41 -152.173     1883.48  -152.173    1019.29   -152.173     
1 1 1 12 15 21 o 0 481     19.8  422.3  19.8 1957.76 20.2445      1993.91  20.2445     857.711   20.2445      
1 1 1 12 19 21 o 0 21.9    5.8   18.5   5.8  806.398 -94.2351     319.288  85.7649     870.703   85.7649      
1 1 1 2  21 13 o 0 378.3   13.1  384    13.1 1703.55 -60.5755     1893.67  -60.5755    778.521   -60.5755     
1 1 1 4  21 13 o 0 257     9.1   254    9.1  2214.76 -127.057     1017.58  -127.057    404.299   52.9435      
1 1 1 6  21 13 o 0 306     11    329.6  11   3825.08 -11.5539     439.715  -11.5539    1977.79   168.446      
1 1 1 10 21 13 o 0 33.2    3.1   22.4   3.1  1537.4  -63.6786     531.357  116.321     1479.93   116.321      
1 1 1 13 14 21 o 0 109.8   6.9   118.6  6.9  1926.1  -45.1834     297.637  -45.1834    830.211   134.817      
1 1 1 13 16 21 o 0 274.2   12.2  247.1  12.2 2372.02 -46.7026     960.148  -46.7026    386.242   133.297      
1 1 1 13 18 21 o 0 139.4   8.4   128.8  8.4  2066    83.8504      455.468  83.8504     971.544   -96.1496     
1 1 1 13 20 21 o 0 30.6    7.1   6      7.1  1276.66 -115.722     483.349  64.2776     1332.52   64.2776      
1 1 1 1  21 14 f 1 204.1   8     218.9  8    1720.19 -62.0312     990.879  -62.0312    141.985   117.969      
1 1 1 3  21 14 f 1 20.3    2.7   22.3   2.7  959.566 132.137      397.113  -47.8632    1015.76   -47.8632     
1 1 1 5  21 14 o 0 114.5   5     114.3  5    1171.62 7.59621      397.589  7.59621     340.363   -172.404     
1 1 1 7  21 14 o 0 41      3.1   40.8   3.1  1715.73 -97.5135     448.295  82.4865     1513.23   82.4865      
1 1 1 9  21 14 o 0 203.5   9.6   210.5  9.6  2057.82 103.843      773.188  103.843     488.028   -76.1573     
1 1 1 11 21 14 o 0 85.9    5.2   71     5.2  1437.46 167.079      46.3951  167.079     824.13    -12.921      
1 1 1 13 21 14 o 0 22.7    4.3   19.2   4.3  958.206 -74.1154     318.639  105.885     878.057   105.885      
1 1 1 14 15 21 o 0 402.4   16    332.4  16   3061.86 -53.5083     1111.51  -53.5083    642.582   126.492      
1 1 1 14 19 21 o 0 337.2   14.7  284.3  14.7 2380.27 -173.073     1412.82  -173.073    186.857   6.9273       
1 1 1 2  21 15 o 0 496.2   17.6  539.3  17.6 2146.47 -174.83      2223.19  -174.83     849.394   -174.83      
1 1 1 4  21 15 o 0 677.7   22.9  697    22.9 2747.17 -17.6698     2458.84  -17.6698    734.271   -17.6698     
1 1 1 8  21 15 o 0 444.1   16.4  464.5  16.4 2294.92 -73.0181     1806.7   -73.0181    409.306   -73.0181     
1 1 1 15 16 21 o 0 240.2   10.9  200.7  10.9 1919.45 -29.3368     945.74   -29.3368    127.229   150.663      
1 1 1 15 18 21 o 0 206.7   11.2  183.1  11.2 1842.46 -177.294     1010.68  -177.294    239.833   2.70589      
1 1 1 15 20 21 o 0 259.5   13.4  226.7  13.4 1743.56 74.8626      1312.62  74.8626     189.293   74.8626      
1 1 1 1  21 16 o 0 30      3.5   35.2   3.5  512.824 134.654      143.34   -45.3456    470.78    -45.3456     
1 1 1 3  21 16 o 0 125.2   5.5   126.6  5.5  2198.31 -69.9092     181.683  -69.9092    1193.4    110.091      
1 1 1 5  21 16 o 0 421.9   14.8  435    14.8 1658.44 36.8642      1989.53  36.8642     970.476   36.8642      
1 1 1 7  21 16 f 1 113.7   5.5   121.2  5.5  519.727 122.265      293.09   122.265     23.1228   -57.7354     
1 1 1 9  21 16 o 0 193     7.9   186.7  7.9  293.349 -84.8226     386.579  -84.8226    211.575   -84.8226     
1 1 1 13 21 16 o 0 390.4   16.4  363    16.4 3191.08 69.5208      1061.41  69.5208     745.671   -110.479     
1 1 1 15 21 16 o 0 191.3   10    170.3  10   2455.98 4.85071      486.69   4.85071     880.803   -175.149     
1 1 1 16 17 21 o 0 81.9    7.3   77.6   7.3  1410.12 67.8326      204.082  67.8326     761.96    -112.167     
1 1 1 16 19 21 o 0 235.9   11.6  210.3  11.6 1198.53 25.0865      1355.35  25.0865     575.551   25.0865      
1 1 1 2  21 17 o 0 326.3   12.1  339.9  12.1 2756    -121.234     1097.84  -121.234    618.799   58.7663      
1 1 1 4  21 17 o 0 71.7    4.2   62.1   4.2  1057.8  27.0832      13.0154  27.0832     633.522   -152.917     
1 1 1 6  21 17 o 0 134.9   7.3   119.8  7.3  1180.02 178.785      475.669  178.785     233.602   -1.21516     
1 1 1 8  21 17 o 0 498.6   18.1  510.3  18.1 1498    -133.268     2352.21  -133.268    1486.19   -133.268     
1 1 1 10 21 17 o 0 93      5.8   96.2   5.8  1110.87 -10.1333     347.207  -10.1333    285.847   169.867      
1 1 1 12 21 17 o 0 22.2    4.6   26.1   4.6  1497.56 -148.164     460.175  31.8356     1301.08   31.8356      
1 1 1 14 21 17 o 0 196     10.1  182.4  10.1 2643.44 -22.0795     440.955  -22.0795    1019.21   157.92       
1 1 1 1  21 18 o 0 32.6    4.2   24     4.2  299.752 -143.458     92.8612  36.5423     278.575   36.5423      
1 1 1 3  21 18 o 0 150.4   6.9   151.3  6.9  729.238 79.6596      563.569  79.6596     120.495   79.6596      
1 1 1 7  21 18 f 1 218     8.9   228.3  8.9  2530.31 83.0567      694.672  83.0567     764.976   -96.9433     
1 1 1 9  21 18 o 0 197.2   8.2   187.1  8.2  1493.68 178.145      942.232  178.145     98.2726   178.145      
1 1 1 11 21 18 o 0 54.1    5.5   59.7   5.5  1748.26 -18.4298     151.367  161.57      1124.36   161.57       
1 1 1 13 21 18 o 0 385.1   16.8  373.2  16.8 1805.33 -115.514     2099.63  -115.514    854.513   -115.514     
1 1 1 15 21 18 o 0 387.1   16.4  331.1  16.4 2669.67 -165.393     1502.9   -165.393    304.576   14.6067      
1 1 1 18 19 21 o 0 21.8    9.3   -6.4   9.3  554.618 -43.2958     274.502  136.704     626.799   136.704      
1 1 1 2  21 19 o 0 162.7   7.5   164.7  7.5  843.972 -35.9076     835.386  -35.9076    338.154   -35.9076     
1 1 1 4  21 19 o 0 134.5   6.6   132.7  6.6  2631.59 137.886      114.402  137.886     1408.1    -42.1136     
1 1 1 6  21 19 o 0 131     7.8   134.9  7.8  1526.27 139.44       561.858  139.44      306.481   -40.5601     
1 1 1 8  21 19 o 0 27.4    4.3   42.2   4.3  1456.25 146.847      294.153  -33.1535    1109.69   -33.1535     
1 1 1 12 21 19 o 0 231.9   11.5  247.2  11.5 1192.12 51.5008      1524.1   51.5008     709.503   51.5008      
1 1 1 14 21 19 o 0 227.1   11.3  217.8  11.3 2314.57 -112.016     935.064  -112.016    618.389   67.9842      
1 1 1 16 21 19 o 0 206.6   12.4  142.3  12.4 1492.02 25.8644      996.777  25.8644     28.0025   25.8644      
1 1 1 18 21 19 o 0 197.5   13.9  187.6  13.9 1911.68 -31.6999     906.655  -31.6999    304.216   148.3        
1 1 1 19 20 21 o 0 34.3    10.4  -3.4   10.4 331.208 98.3241      118.48   -81.6759    321.407   -81.6759     
1 1 1 1  21 20 o 0 214.1   9.4   239.6  9.4  725.67  87.7425      1144.65  87.7425     720.697   87.7425      
1 1 1 5  21 20 o 0 389.7   14.9  408.4  14.9 2683.72 49.5306      1400.1   49.5306     113.233   -130.469     
1 1 1 7  21 20 f 1 340.2   14.7  333.4  14.7 2598.2  81.5588      1161.87  81.5588     287.726   -98.4412     
1 1 1 9  21 20 o 0 45.9    4.7   45.3   4.7  424.453 103.726      8.47695  -76.2735    240.245   -76.2735     
1 1 1 11 21 20 o 0 79.1    6.4   80.2   6.4  955.504 -43.9757     275.315  -43.9757    371.197   136.024      
1 1 1 13 21 20 o 0 150.8   9.4   163.3  9.4  2102.13 -116.86      597.378  -116.86     800.146   63.14        
1 1 1 15 21 20 o 0 178.1   10.7  137    10.7 958.218 85.6444      899.855  85.6444     283.027   85.6444      
1 1 1 17 21 20 o 0 38.3    11.8  55.5   11.8 770.857 -88.1843     31.6952  91.8157     516.468   91.8157      
1 1 1 2  21 21 o 0 438.2   15.5  398.7  15.5 2724.57 -158.986     1467.59  -158.986    80.0947   21.014       
1 1 1 4  21 21 f 1 110.8   6.5   109.6  6.5  835.346 171.471      446.603  171.471     22.4579   -8.52887     
1 1 1 6  21 21 o 0 113.8   6.8   109.6  6.8  957.668 -0.57083     462.675  -0.57083    63.2847   179.429      
1 1 1 8  21 21 f 1 212.6   10.7  200.8  10.7 1551.32 -54.1925     1209.91  -54.1925    148.083   -54.1925     
1 1 1 10 21 21 f 1 104.7   6.7   98.8   6.7  1111.89 173.553      474.031  173.553     274.66    -6.4466      
1 1 1 12 21 21 f 1 212.5   11.6  202.5  11.6 1535.3  133.987      1179.5   133.987     163.508   133.987      
1 1 1 14 21 21 f 1 269.8   14.3  262.7  14.3 978.348 -65.5375     1570.7   -65.5375    943.399   -65.5375     
1 1 1 18 21 21 f 1 27.1    13    7      13   698.796 -25.0332     268.525  154.967     695.51    154.967      
1 1 1 1  22 1  o 0 377.7   12.1  377    12.1 1529.47 121.437      1420.13  121.437     561.998   121.437      
1 1 1 1  3  22 o 0 197.2   7.2   196.7  7.2  780.324 -179.084     527.607  -179.084    88.9214   -179.084     
1 1 1 1  7  22 o 0 690.7   23.1  708.2  23.1 3560.34 -135.174     1764.82  -135.174    162.865   44.8263      
1 1 1 1  9  22 o 0 474.2   15.8  457.6  15.8 3368.67 -80.4326     1139.64  -80.4326    667.406   99.5674      
1 1 1 1  11 22 o 0 116.8   4.3   110.9  4.3  922.039 -118.609     407.151  -118.609    199.135   61.391       
1 1 1 1  15 22 o 0 217.2   8.2   221.7  8.2  1719.64 120.714      1004.73  120.714     80.8246   -59.2858     
1 1 1 1  17 22 o 0 23.4    3.7   15     3.7  1653.07 95.8408      698.083  -84.1592    1713.92   -84.1592     
1 1 1 1  19 22 o 0 180.9   8.1   188.2  8.1  2198.94 -172.687     650.386  -172.687    628.681   7.31289      
1 1 1 1  21 22 o 0 178.1   8.6   151.1  8.6  1749.35 -93.5415     695.478  -93.5415    286.826   86.4585      
1 1 1 2  22 2  o 0 835.4   25.9  822.5  25.9 3089.98 126.514      2210.54  126.514     487.785   126.514      
1 1 1 2  4  22 o 0 497.2   16.7  482.7  16.7 1931.02 103.529      1864.86  103.529     824.068   103.529      
1 1 1 2  6  22 o 0 510     16.8  486.2  16.8 2260.32 -129.671     1756.27  -129.671    541.666   -129.671     
1 1 1 2  12 22 o 0 666.6   22.6  665.3  22.6 1723.16 158.476      2958.05  158.476     1846.36   158.476      
1 1 1 2  16 22 o 0 30.4    3.3   37.3   3.3  1128.88 -171.795     315.267  8.20528     1011.94   8.20528      
1 1 1 2  20 22 o 0 45.1    5.4   41.3   5.4  692.562 13.7721      46.6714  -166.228    439.25    -166.228     
1 1 1 1  22 3  o 0 181.1   6.2   180.8  6.2  1379.03 116.091      534.228  116.091     242.691   -63.9085     
1 1 1 3  22 3  o 0 713.3   23.1  699.7  23.1 4348.94 35.3639      1373.79  35.3639     958.063   -144.636     
1 1 1 3  5  22 o 0 355.7   12    342.7  12   2962.22 -136.03      909.725  -136.03     671.259   43.9698      
1 1 1 3  7  22 o 0 80.1    3.5   76.6   3.5  1632.04 -169.895     10.3359  10.1049     876.556   10.1049      
1 1 1 3  9  22 o 0 62.6    2.8   52.3   2.8  954.254 94.7861      43.6522  -85.2139    545.289   -85.2139     
1 1 1 3  11 22 o 0 48.8    2.9   51.6   2.9  2078.19 93.9164      499.392  -86.0836    1838.59   -86.0836     
1 1 1 3  13 22 o 0 240.5   9.1   237.7  9.1  2208.74 -140.982     915.985  -140.982    482.142   39.0176      
1 1 1 3  15 22 o 0 239.6   9.3   247.6  9.3  3274.37 -124.234     368.882  -124.234    1658.66   55.7657      
1 1 1 3  17 22 o 0 36.2    4     59.6   4    1134.06 -23.3919     154.308  156.608     838.415   156.608      
1 1 1 3  21 22 o 0 263.5   11    248.6  11   2251.41 99.0816      1215.67  99.0816     350.063   -80.9184     
1 1 1 4  22 4  f 1 52.9    2.6   59.2   2.6  918.123 -72.2457     51.5724  107.754     543.172   107.754      
1 1 1 4  8  22 f 1 15.8    1.8   19.1   1.8  1269.89 117.42       475.299  -62.5804    1144.75   -62.5804     
1 1 1 4  10 22 o 0 118     4.7   112.5  4.7  1323.82 -73.5302     318.861  -73.5302    366.837   106.47       
1 1 1 4  12 22 o 0 36.5    3.5   36.6   3.5  1343.15 -174.258     371.141  5.74203     1222.06   5.74203      
1 1 1 4  14 22 o 0 174.6   7.3   159.4  7.3  803.445 50.3347      704.324  50.3347     205.402   50.3347      
1 1 1 4  16 22 o 0 244.2   10.3  244.5  10.3 1783.58 72.3214      1078.88  72.3214     2.36623   -107.679     
1 1 1 4  18 22 o 0 378.3   13.7  385.3  13.7 3071.96 -171.39      1161.66  -171.39     606.398   8.60972      
1 1 1 1  22 5  o 0 568.7   17.9  586.5  17.9 2195.96 -73.0944     2062.43  -73.0944    864.588   -73.0944     
1 1 1 3  22 5  o 0 386.1   13    414.6  13   2994.91 138.375      1089.4   138.375     514.043   -41.6254     
1 1 1 5  22 5  o 0 789     24.8  787.5  24.8 3655.74 -78.3569     1907.76  -78.3569    24.0467   101.643      
1 1 1 5  9  22 o 0 19      2.1   18.3   2.1  2305.25 128.206      867.815  -51.7936    2061.09   -51.7936     
1 1 1 5  11 22 o 0 221.2   9     231.7  9    883.597 18.8372      1103.04  18.8372     542.735   18.8372      
1 1 1 5  13 22 o 0 250.9   10.2  259.2  10.2 2142.41 -20.766      1017.57  -20.766     316.344   159.234      
1 1 1 5  15 22 o 0 362.3   13.9  341    13.9 2606.51 -11.0265     1232.36  -11.0265    354.844   168.973      
1 1 1 5  17 22 o 0 103.8   6.3   114.2  6.3  2053.74 68.8074      202.065  68.8074     987.536   -111.193     
1 1 1 5  21 22 o 0 23.8    5.6   22.7   5.6  360.713 -162.496     124.023  17.5043     370.782   17.5043      
1 1 1 2  22 6  o 0 127.8   5     130.5  5    2271.39 127.368      149.655  127.368     1074.66   -52.6316     
1 1 1 4  22 6  o 0 692.5   23.3  717.6  23.3 3459.47 101.746      1792.2   101.746     41.9602   -78.2543     
1 1 1 6  22 6  o 0 338.8   12.2  361.7  12.2 2037.06 98.7622      1289.11  98.7622     221.494   98.7622      
1 1 1 6  8  22 o 0 458.4   15.6  473.9  15.6 3018.95 -83.1059     1261.72  -83.1059    300.997   96.8941      
1 1 1 6  10 22 o 0 189.6   7.2   192.1  7.2  2298.93 -35.4816     590.295  -35.4816    869.396   144.518      
1 1 1 6  12 22 o 0 385.7   14.8  401.9  14.8 3006.33 -55.8457     1233.93  -55.8457    643.007   124.154      
1 1 1 6  14 22 o 0 372.9   14.3  369.8  14.3 2567.05 -130.147     1342.34  -130.147    227.553   49.8527      
1 1 1 6  16 22 o 0 12.9    3.9   13.7   3.9  1260.25 159.308      584.915  -20.6917    1336.95   -20.6917     
1 1 1 6  18 22 o 0 81      5.9   68.6   5.9  665.182 64.2681      181.27   64.2681     195.464   -115.732     
1 1 1 6  20 22 o 0 183.5   8.7   184.1  8.7  2137.52 98.7257      634.744  98.7257     537.349   -81.2743     
1 1 1 1  22 7  o 0 392.3   12.8  400.6  12.8 2272.13 -73.1402     1416.43  -73.1402    182.183   -73.1402     
1 1 1 3  22 7  o 0 308.9   10.2  275.4  10.2 1866.52 -25.3016     1137.95  -25.3016    143.977   -25.3016     
1 1 1 5  22 7  o 0 132.2   5.1   129.6  5.1  2374.29 88.781       116.103  88.781      1129.87   -91.219      
1 1 1 7  22 7  o 0 272     10    282.8  10   1854.85 82.0817      1048.66  82.0817     85.4078   82.0817      
1 1 1 7  15 22 f 1 310.7   14.1  296.8  14.1 737.515 30.2489      1347.97  30.2489     902.832   30.2489      
1 1 1 7  19 22 o 0 85.6    7.6   101.9  7.6  2900.87 -32.4252     305.303  147.575     1910.1    147.575      
1 1 1 7  21 22 o 0 240.3   11.4  217.7  11.4 1873.94 9.67498      1207.54  9.67498     53.7447   -170.325     
1 1 1 4  22 8  f 1 360.9   12    352.5  12   2520.9  116.102      1114.99  116.102     218.371   -63.8977     
1 1 1 6  22 8  o 0 271.5   9.6   273.3  9.6  1616.01 124.966      1096.47  124.966     257.66    124.966      
1 1 1 8  22 8  o 0 525.1   18.3  537.6  18.3 2826.15 91.0273      1914.85  91.0273     109.564   91.0273      
1 1 1 8  10 22 o 0 170.7   7.1   171.8  7.1  2385.98 -142.994     416.727  -142.994    1082.74   37.0056      
1 1 1 8  12 22 o 0 315.3   14.2  321.9  14.2 2465.91 110.144      1168.01  110.144     353.555   -69.8556     
1 1 1 8  14 22 o 0 258.4   11.9  246.2  11.9 1155.47 51.494       1241.86  51.494      544.382   51.494       
1 1 1 8  18 22 o 0 67.1    6.4   58.8   6.4  698.928 -152.842     98.0053  -152.842    291.903   27.1576      
1 1 1 1  22 9  o 0 367.5   13.3  358.2  13.3 2779.05 -177.632     1055.09  -177.632    441.577   2.3677       
1 1 1 5  22 9  o 0 232.3   9     228.4  9    951.741 93.272       940.535  93.272      446.383   93.272       
1 1 1 9  22 9  o 0 120.7   5.8   118.9  5.8  1060.41 -51.1042     442.834  -51.1042    226.657   128.896      
1 1 1 9  13 22 o 0 49.6    4.7   33.7   4.7  814.836 -85.3587     145.428  94.6413     640.193   94.6413      
1 1 1 9  15 22 o 0 66      5.3   49.1   5.3  1523.3  -151.866     66.784   28.1345     948.006   28.1345      
1 1 1 9  19 22 o 0 280.6   13.8  262.4  13.8 2751.75 138.245      793.619  138.245     705.392   -41.755      
1 1 1 9  21 22 o 0 307.2   13.7  299.5  13.7 1896.95 -87.3254     1595.15  -87.3254    339.15    -87.3254     
1 1 1 4  22 10 o 0 403.3   14    360.3  14   2118.25 -52.6543     1365.92  -52.6543    265.035   -52.6543     
1 1 1 8  22 10 o 0 562.3   21.5  564.9  21.5 3517.14 -134.229     1614.93  -134.229    598.248   45.7708      
1 1 1 10 22 10 o 0 382.5   16.8  407.9  16.8 1890.73 83.5335      1790.17  83.5335     612.231   83.5335      
1 1 1 10 12 22 o 0 313.7   13.4  289.8  13.4 2127.54 11.8595      1238.49  11.8595     61.2393   -168.141     
1 1 1 10 16 22 o 0 168.5   9.2   156    9.2  2133.33 54.3358      528.945  54.3358     680.37    -125.664     
1 1 1 10 20 22 o 0 168.2   11    146.6  11   788.948 -8.56303     884.334  -8.56303    356.643   -8.56303     
1 1 1 1  22 11 o 0 596.6   20.2  603.4  20.2 3315.26 2.25204      1951.73  2.25204     238.038   -177.748     
1 1 1 3  22 11 o 0 466.6   15.8  465.5  15.8 2137.08 -134.498     2045.62  -134.498    663.28    -134.498     
1 1 1 5  22 11 o 0 62.8    3.6   62.6   3.6  1733.82 -23.8756     209.561  156.124     1312.25   156.124      
1 1 1 7  22 11 o 0 378.9   13.3  328.5  13.3 3266.04 -168.99      925.851  -168.99     1123.29   11.0103      
1 1 1 9  22 11 o 0 89      5.2   90.3   5.2  593.539 -170.355     173.455  -170.355    194.708   9.64497      
1 1 1 11 22 11 o 0 52.1    4.5   49.7   4.5  2351.58 -44.1092     588.6    135.891     2031.66   135.891      
1 1 1 11 13 22 o 0 78.4    5.1   61.4   5.1  1102.07 53.415       36.1984  53.415      625.911   -126.585     
1 1 1 11 15 22 o 0 25.5    4.8   15.4   4.8  1246    -4.05432     412.238  175.946     1124.1    175.946      
1 1 1 11 17 22 o 0 196     9.7   175.9  9.7  1662.41 117.025      839.632  117.025     82.1154   -62.9747     
1 1 1 11 21 22 o 0 319     14.3  293.3  14.3 1596.35 -100.162     1710.75  -100.162    684.474   -100.162     
1 1 1 2  22 12 o 0 105     4.8   111.6  4.8  1390.55 155.807      328.528  155.807     572.391   -24.193      
1 1 1 4  22 12 o 0 232.8   8.4   246.2  8.4  2153.22 88.4763      949.141  88.4763     419.584   -91.5237     
1 1 1 6  22 12 o 0 564.6   20.2  561.2  20.2 3855.74 -83.6589     1409.13  -83.6589    1003.83   96.3411      
1 1 1 8  22 12 o 0 295.2   11.6  309.8  11.6 2123.08 46.5656      1257.61  46.5656     53.8017   -133.434     
1 1 1 10 22 12 o 0 27.1    3.7   38.6   3.7  285.055 44.7629      72.4117  -135.237    246.432   -135.237     
1 1 1 12 22 12 o 0 18.9    3.8   22.4   3.8  830.838 -105.311     324.847  74.689      826.045   74.689       
1 1 1 12 14 22 o 0 6.2     4.6   19.2   4.6  1084.95 -19.2331     436.785  160.767     1061.46   160.767      
1 1 1 12 16 22 o 0 154.5   8     120.6  8    1219.34 -159.294     656.354  -159.294    25.4909   20.7065      
1 1 1 1  22 13 o 0 358.3   12.9  365.3  12.9 1795.67 128.823      1752.18  128.823     587.205   128.823      
1 1 1 3  22 13 o 0 101.2   4.9   115.6  4.9  1154.11 -162.752     357.318  -162.752    376.025   17.2484      
1 1 1 5  22 13 o 0 343     12    337.9  12   2238.19 -7.37485     1396.55  -7.37485    0.951756  172.625      
1 1 1 7  22 13 o 0 506.8   17.6  477.2  17.6 2918.08 -124.258     1651.33  -124.258    144.006   55.7422      
1 1 1 9  22 13 o 0 255.1   10.9  236.6  10.9 1373.33 123.407      1200.93  123.407     366.888   123.407      
1 1 1 11 22 13 o 0 101.6   6     107.9  6    908.432 -92.4435     306.526  -92.4435    238.324   87.5565      
1 1 1 13 15 22 o 0 7.1     5     7.3    5    855.762 100.026      408.44   -79.9738    890.94    -79.9738     
1 1 1 13 17 22 o 0 85.4    6.9   65.2   6.9  489.129 -97.1123     190.195  -97.1123    146.23    82.8877      
1 1 1 13 21 22 o 0 132.6   10.2  115    10.2 1230.6  51.1953      616.874  51.1953     159.561   -128.805     
1 1 1 2  22 14 f 1 53.7    3.6   46.4   3.6  1129.25 161.747      160.976  -18.2535    882.123   -18.2535     
1 1 1 4  22 14 o 0 208.6   8.5   231.9  8.5  2342.54 -136.99      735.037  -136.99     724.374   43.0102      
1 1 1 6  22 14 o 0 274.8   9.8   269.3  9.8  2101.35 24.7974      1107.37  24.7974     180.536   -155.203     
1 1 1 8  22 14 o 0 80.8    5.5   95.4   5.5  1239.13 155.151      168.872  155.151     579.789   -24.8491     
1 1 1 10 22 14 f 1 117.6   6     100.1  6    2430.55 -43.5994     62.5942  136.401     1519.84   136.401      
1 1 1 14 22 14 o 0 369     16.1  366.1  16.1 2729.54 88.4582      1254.56  88.4582     289.036   -91.5418     
1 1 1 14 16 22 o 0 262.1   12.4  220.7  12.4 1060.61 168.463      1571.97  168.463     836.197   168.463      
1 1 1 14 20 22 o 0 203     11.8  182.3  11.8 1932.12 -115.292     907.281  -115.292    324.011   64.7076      
1 1 1 1  22 15 o 0 18.5    3.2   14.3   3.2  1339.54 179.298      617.519  -0.701666   1467.06   -0.701666    
1 1 1 3  22 15 o 0 277     10.3  280.4  10.3 2201.56 -48.7664     1110.77  -48.7664    257.435   131.234      
1 1 1 5  22 15 o 0 422     16.1  398.7  16.1 2947.75 -143.568     1305.64  -143.568    494.06    36.4322      
1 1 1 9  22 15 o 0 193.3   9.1   191.7  9.1  2208.24 164.08       688.919  164.08      588.733   -15.9202     
1 1 1 11 22 15 o 0 400.1   16    363.3  16   1327.87 -178.159     1905.23  -178.159    1147.68   -178.159     
1 1 1 15 22 15 f 1 108.3   7.7   108.4  7.7  334.869 139.16       295.388  139.16      61.1868   139.16       
1 1 1 15 21 22 f 1 240.5   14.2  237.5  14.2 1906.99 -84.5765     1158.5   -84.5765    26.0974   95.4235      
1 1 1 2  22 16 o 0 75.9    4.6   72.5   4.6  758.103 -20.2829     90.7014  -20.2829    378.982   159.717      
1 1 1 4  22 16 o 0 359.1   12.9  379.1  12.9 1898.73 156.17       1633.99  156.17      479.56    156.17       
1 1 1 6  22 16 o 0 315.4   11.2  307.2  11.2 1462.26 80.1068      1490.18  80.1068     615.92    80.1068      
1 1 1 8  22 16 o 0 98.5    5.5   99.1   5.5  1894.51 -140.55      182.092  -140.55     907.158   39.4497      
1 1 1 10 22 16 o 0 149.5   7.7   156.8  7.7  1792.51 150.263      608.815  150.263     406.765   -29.7374     
1 1 1 12 22 16 o 0 377.1   15.7  341.4  15.7 1696.75 -90.0476     1662.17  -90.0476    715.34    -90.0476     
1 1 1 14 22 16 o 0 157.7   8.9   143.6  8.9  1761.08 61.3315      737.561  61.3315     479.389   -118.669     
1 1 1 16 22 16 o 0 56.1    6.7   50.3   6.7  1477.81 -51.7457     128.591  128.254     1129.66   128.254      
1 1 1 16 18 22 o 0 48.2    7.4   44.4   7.4  912.042 157.949      68.5682  -22.0515    660.398   -22.0515     
1 1 1 1  22 17 o 0 241.9   10    248.4  10   1874.25 -45.4381     1068.55  -45.4381    87.8674   134.562      
1 1 1 3  22 17 o 0 444.7   15.2  429.8  15.2 2676.64 109.428      1541.21  109.428     78.468    -70.5721     
1 1 1 7  22 17 o 0 213.4   8.9   221.3  8.9  2104.91 -17.0819     864.703  -17.0819    337.616   162.918      
1 1 1 9  22 17 o 0 89.1    5.4   99.6   5.4  1479.29 66.3934      278.186  66.3934     553.903   -113.607     
1 1 1 13 22 17 o 0 84.8    7     76     7    893.6   -80.1109     288.045  -80.1109    325.034   99.8891      
1 1 1 15 22 17 o 0 59.8    6.8   47.6   6.8  656.447 59.6189      42.0235  59.6189     399.877   -120.381     
1 1 1 17 22 17 o 0 70      7.8   70.2   7.8  1764.8  -74.0742     34.3821  105.926     1181.75   105.926      
1 1 1 17 19 22 o 0 312.2   14.7  259.1  14.7 1451.25 46.9384      1621.26  46.9384     708.617   46.9384      
1 1 1 17 21 22 o 0 44      9.9   20.6   9.9  992.923 94.4114      191.464  -85.5886    789.907   -85.5886     
1 1 1 2  22 18 o 0 585.7   20    582    20   3168.63 -110.56      1882.62  -110.56     21.0622   -110.56      
1 1 1 4  22 18 o 0 14.5    4.4   42     4.4  937.977 -14.9084     179.561  165.092     720.667   165.092      
1 1 1 6  22 18 o 0 407.1   17.3  386.9  17.3 2980.59 -153.698     1250.75  -153.698    439.907   26.3021      
1 1 1 8  22 18 o 0 239.7   10.1  257.7  10.1 1167.17 33.005       1294.83  33.005      643.283   33.005       
1 1 1 18 22 18 o 0 201.8   11.2  153.7  11.2 2454.14 -138.463     560.4    -138.463    985.951   41.5369      
1 1 1 1  22 19 o 0 -1.4    4.5   5.5    4.5  543.313 -11.5535     290.589  168.446     607.529   168.446      
1 1 1 3  22 19 o 0 33      4.8   20.8   4.8  1329.77 11.9138      359.551  -168.086    1121.16   -168.086     
1 1 1 5  22 19 o 0 233.1   9.5   228    9.5  1877.2  -20.3309     1015.61  -20.3309    41.0751   159.669      
1 1 1 7  22 19 o 0 320.7   14.5  324.6  14.5 2566.96 154.882      1121.71  154.882     299.634   -25.1179     
1 1 1 9  22 19 o 0 307.8   12.3  298.4  12.3 2858.71 39.4284      883.018  39.4284     674.531   -140.572     
1 1 1 13 22 19 o 0 57.8    6.6   48.4   6.6  910.713 32.5129      12.8291  32.5129     590.901   -147.487     
1 1 1 17 22 19 o 0 147.2   10    129.2  10   1280.87 -23.5965     719.195  -23.5965    83.333    156.403      
1 1 1 2  22 20 o 0 281.8   11.8  293.3  11.8 1936.93 173.389      1280.64  173.389     180.689   173.389      
1 1 1 4  22 20 o 0 196.7   9.2   214.6  9.2  1315.77 172.521      1048.29  172.521     313.962   172.521      
1 1 1 6  22 20 o 0 370.1   16.4  366.4  16.4 3236.8  -165.638     971.52   -165.638    804.946   14.3622      
1 1 1 8  22 20 o 0 89.3    6     75.9   6    871.669 140.572      307.841  140.572     284.892   -39.4282     
1 1 1 10 22 20 o 0 14.1    5.1   22.3   5.1  2093.14 -57.7651     937.541  122.235     2337.37   122.235      
1 1 1 14 22 20 o 0 75      7.7   43.5   7.7  1292.97 61.6828      29.6171  61.6828     793.229   -118.317     
1 1 1 16 22 20 o 0 76.6    9     48.5   9    1640.27 158.994      45.1592  -21.0058    1065.75   -21.0058     
1 1 1 18 22 20 o 0 61.4    13.4  45.6   13.4 767.359 -20.3314     22.2822  -20.3314    442.713   159.669      
1 1 1 1  22 21 o 0 46.7    6.1   54.5   6.1  1445.15 -129.298     123.396  50.7022     935.786   50.7022      
1 1 1 5  22 21 o 0 90      7     79.4   7    1529.13 156.087      222.146  156.087     824.549   -23.913      
1 1 1 9  22 21 o 0 280.6   11.9  282.5  11.9 1919.19 -99.6451     1467.95  -99.6451    197.105   -99.6451     
1 1 1 13 22 21 o 0 341     15.2  297.7  15.2 2869.69 41.9334      1128.24  41.9334     681.437   -138.067     
1 1 1 17 22 21 o 0 90.7    13.4  31.1   13.4 1587.09 -172.641     55.9649  -172.641    899.398   7.35904      
1 1 1 2  22 22 o 0 195.7   9.8   191.6  9.8  1407.53 75.9487      1183.33  75.9487     214.722   75.9487      
1 1 1 4  22 22 o 0 161.8   8.8   156.6  8.8  1740.45 -127.569     795.274  -127.569    383.017   52.4305      
1 1 1 6  22 22 o 0 103     7.7   113.2  7.7  777.871 64.5012      502.378  64.5012     15.7045   -115.499     
1 1 1 8  22 22 o 0 187.7   10.6  188    10.6 2215.7  -85.5626     750.904  -85.5626    682.836   94.4374      
1 1 1 10 22 22 o 0 111.5   7.6   102.8  7.6  2081.46 75.0963      197.832  75.0963     1126.01   -104.904     
1 1 1 14 22 22 o 0 9.2     9.7   -0.4   9.7  979.663 177.622      497.753  -2.37764    1096.81   -2.37764     
1 1 1 16 22 22 o 0 -22.1   10.7  5.7    10.7 792.919 -172.325     424.87   7.67532     898.385   7.67532      
1 1 1 1  4  23 o 0 339.6   11.7  327.5  11.7 3118.85 -60.6915     772.43   -60.6915    886.279   119.309      
1 1 1 1  6  23 o 0 767     25.8  762.1  25.8 4505.1  -104.497     1432.66  -104.497    957.316   75.5034      
1 1 1 1  8  23 o 0 89.8    3.9   96.4   3.9  481.292 -16.8585     141.908  -16.8585    111.665   163.141      
1 1 1 1  10 23 o 0 56.4    3     64.6   3    582.435 82.8675      6.79165  82.8675     370.272   -97.1325     
1 1 1 1  12 23 o 0 205.7   7.2   209.6  7.2  450.481 -29.8925     672.241  -29.8925    385.164   -29.8925     
1 1 1 1  14 23 o 0 7.9     2.5   10.3   2.5  849.868 -58.5334     446.538  121.467     977.328   121.467      
1 1 1 1  16 23 o 0 84.7    4.8   88.6   4.8  2279.31 57.2367      85.5233  -122.763    1441.96   -122.763     
1 1 1 1  18 23 o 0 519.9   19.2  541.7  19.2 3091.93 -44.7889     1713.9   -44.7889    74.0088   135.211      
1 1 1 1  20 23 o 0 416.8   15.9  413    15.9 1052.78 -73.2413     2556.1   -73.2413    1814.2    -73.2413     
1 1 1 1  22 23 o 0 318.8   13.1  301.2  13.1 2919.62 -114.248     1100.6   -114.248    882.065   65.7522      
1 1 1 1  23 2  o 0 621.8   18.9  615.8  18.9 3772.69 -160.081     1407.85  -160.081    602.731   19.9185      
1 1 1 2  5  23 o 0 170.4   6.3   160.9  6.3  1205.23 -85.2867     643.285  -85.2867    8.88397   -85.2867     
1 1 1 2  7  23 o 0 230.7   8     212.4  8    3332.84 -177.595     183.849  -177.595    1561.74   2.40509      
1 1 1 2  9  23 o 0 145.4   5.5   136.9  5.5  1301.04 122.062      603.621  122.062     235.474   -57.9379     
1 1 1 2  13 23 o 0 27.7    2.8   25.8   2.8  371.203 133.709      124.288  -46.2913    356.336   -46.2913     
1 1 1 2  15 23 o 0 582.9   20.1  595    20.1 3798.49 148.594      1498.41  148.594     824.478   -31.4064     
1 1 1 2  17 23 o 0 172.8   8.1   197.8  8.1  1970.27 -71.3094     759.34   -71.3094    386.754   108.691      
1 1 1 2  19 23 o 0 91.3    6.1   84.9   6.1  2036.82 -154.894     34.2499  -154.894    1115.11   25.1064      
1 1 1 2  21 23 o 0 150.6   8.8   159.7  8.8  2085.95 129.634      610.501  129.634     821.743   -50.3659     
1 1 1 3  4  23 o 0 89.7    3.7   92.5   3.7  1065.02 -53.5476     180.22   -53.5476    376.37    126.452      
1 1 1 3  6  23 o 0 213.2   7.5   203.1  7.5  1537.04 -76.0953     819.728  -76.0953    19.1839   -76.0953     
1 1 1 3  8  23 o 0 507.8   16.5  478.4  16.5 2389.46 57.9901      1621.23  57.9901     385.911   57.9901      
1 1 1 3  12 23 o 0 211.6   8.2   206.1  8.2  2487.59 23.478       597.43   23.478      958.095   -156.522     
1 1 1 3  14 23 o 0 617.1   21.1  620.9  21.1 3302.13 20.6869      1880.88  20.6869     143.598   -159.313     
1 1 1 3  16 23 o 0 204.9   8.1   194.5  8.1  2485.33 127.873      606.533  127.873     846.179   -52.1271     
1 1 1 3  18 23 o 0 34.3    4.2   32.5   4.2  868.238 -47.3112     161.592  132.689     655.07    132.689      
1 1 1 3  20 23 o 0 361.4   14.9  347.9  14.9 2537.65 117.189      1588.6   117.189     170.542   -62.8113     
1 1 1 3  22 23 o 0 59.1    7.6   58.9   7.6  1063.55 -33.4045     48.7941  -33.4045    662.264   146.595      
1 1 1 1  23 4  o 0 235.2   7.7   241.1  7.7  517.788 16.5536      743.566  16.5536     467.02    16.5536      
1 1 1 3  23 4  o 0 519.1   16.9  534.9  16.9 2072.59 -26.5494     1879.4   -26.5494    791.856   -26.5494     
1 1 1 4  7  23 o 0 122.2   5     132.6  5    1028.97 25.9863      407.457  25.9863     122.672   -154.014     
1 1 1 4  9  23 o 0 413.7   13.5  416.8  13.5 3176.68 13.5284      1249.22  13.5284     764.885   -166.472     
1 1 1 4  11 23 f 1 118.3   5.1   120    5.1  890.779 -73.5572     421.008  -73.5572    139.186   106.443      
1 1 1 4  13 23 o 0 -5.4    2.7   6      2.7  839.357 -40.9546     496.431  139.045     1012.06   139.045      
1 1 1 4  19 23 o 0 16.6    5.4   13.9   5.4  476.096 -74.2102     178.689  105.79      442.936   105.79       
1 1 1 4  21 23 o 0 348.1   14.9  359.4  14.9 2863.45 11.5775      1351.82  11.5775     582.977   -168.422     
1 1 1 2  23 5  o 0 846     26.1  863.4  26.1 3648.74 121.148      2076.86  121.148     147.941   121.148      
1 1 1 4  23 5  o 0 80.2    3.5   79.2   3.5  1989.54 66.9485      106.795  -113.052    1141.92   -113.052     
1 1 1 5  6  23 o 0 563.3   18.5  553    18.5 3986.82 70.2125      1081.54  70.2125     966.618   -109.787     
1 1 1 5  8  23 o 0 136.4   5.4   144.7  5.4  1656.16 153.863      508.798  153.863     539.737   -26.1369     
1 1 1 5  10 23 o 0 556     18.6  560.2  18.6 2423.21 -19.3623     2181.68  -19.3623    666.171   -19.3623     
1 1 1 5  12 23 o 0 221.9   9.2   214.6  9.2  778.413 -9.21434     975.757  -9.21434    496.71    -9.21434     
1 1 1 5  14 23 o 0 145.1   7.2   132.4  7.2  1246.98 -93.6177     553.328  -93.6177    198.854   86.3823      
1 1 1 5  22 23 o 0 222     11.3  209.1  11.3 1195.6  -158.9       1303.83  -158.9      526.719   -158.9       
1 1 1 1  23 6  o 0 23.8    2.2   23     2.2  1728.57 0.357177     590.823  -179.643    1512.22   -179.643     
1 1 1 3  23 6  o 0 256.4   9.3   266.4  9.3  2009.91 63.1322      932.952  63.1322     118.344   -116.868     
1 1 1 5  23 6  o 0 246.8   8.2   238.5  8.2  3294.01 -55.2922     294.379  -55.2922    1403.86   124.708      
1 1 1 6  7  23 o 0 647.5   21.1  623.9  21.1 3092.51 28.4208      2117.6   28.4208     161.493   28.4208      
1 1 1 6  9  23 o 0 54.7    3.2   54.4   3.2  1150.68 135.874      120.301  -44.1259    840.237   -44.1259     
1 1 1 6  13 23 f 1 284.8   11.4  294.4  11.4 1399.97 32.6919      1414.89  32.6919     562.791   32.6919      
1 1 1 6  15 23 f 1 172.1   7.9   159.7  7.9  2194.74 -112.076     529.728  -112.076    745.836   67.9242      
1 1 1 6  19 23 o 0 258.1   11.5  241.1  11.5 2012.58 -150.516     1025.77  -150.516    73.5762   29.4844      
1 1 1 6  21 23 o 0 111.4   7     108.1  7    1233.97 -120.282     528.778  -120.282    291.719   59.7185      
1 1 1 2  23 7  o 0 321.2   10.6  320.9  10.6 2349.34 -155.172     1056.1   -155.172    180.193   24.8275      
1 1 1 4  23 7  o 0 176.6   6.9   190.2  6.9  2169.19 25.498       493.259  25.498      628.797   -154.502     
1 1 1 6  23 7  o 0 697.2   22.7  645.6  22.7 2652.32 153.614      2486.55  153.614     803.919   153.614      
1 1 1 7  12 23 o 0 28.8    4     22.2   4    1407.01 106.219      505.494  -73.7807    1359.94   -73.7807     
1 1 1 7  16 23 o 0 130.7   8.1   123.5  8.1  2040.55 107.165      334.927  107.165     821.071   -72.8346     
1 1 1 7  18 23 o 0 75.8    6.7   76.6   6.7  1048.35 55.8952      191.509  55.8952     385.679   -124.105     
1 1 1 7  22 23 o 0 35.2    7.5   36.8   7.5  154.294 50.3693      23.9563  -129.631    122.625   -129.631     
1 1 1 1  23 8  o 0 162.2   6.2   159.6  6.2  1190.87 21.9357      619.955  21.9357     10.833    -158.064     
1 1 1 7  23 8  o 0 77.3    4.1   87.4   4.1  721.429 -54.7131     148.067  -54.7131    304.651   125.287      
1 1 1 8  9  23 o 0 438.8   15.1  418.3  15.1 2223.06 -35.0735     1769.95  -35.0735    393.244   -35.0735     
1 1 1 8  11 23 o 0 461.7   19.1  462    19.1 2735.92 123.468      1615.49  123.468     51.8184   -56.5323     
1 1 1 8  13 23 o 0 300     12.8  261.2  12.8 2946.38 4.1922       716.849  4.1922      1043.64   -175.808     
1 1 1 8  15 23 o 0 -12.9   4.1   21.2   4.1  781.076 99.4777      365.834  -80.5223    810.992   -80.5223     
1 1 1 8  17 23 o 0 23.9    6     6.7    6    1044.2  -23.4338     369.358  156.566     948.528   156.566      
1 1 1 8  21 23 o 0 322.3   15.4  283.8  15.4 2279.13 149.129      1393.55  149.129     79.211    -30.8709     
1 1 1 2  23 9  o 0 738.6   23.6  741.3  23.6 3008.88 167.33       2564.63  167.33      614.107   167.33       
1 1 1 4  23 9  o 0 216.2   8.8   216.9  8.8  1427.85 -143.771     1077.42  -143.771    168.38    -143.771     
1 1 1 9  10 23 f 1 98      5.7   85     5.7  912.971 25.3041      218.828  25.3041     342.789   -154.696     
1 1 1 9  12 23 o 0 241.8   11    228.3  11   2890.74 -28.7863     514.766  -28.7863    1220.73   151.214      
1 1 1 9  16 23 o 0 256.8   12.4  237.8  12.4 2603.59 -70.9733     769.757  -70.9733    684.588   109.027      
1 1 1 9  20 23 o 0 56.6    8.1   79.2   8.1  1883.52 21.1181      92.4536  -158.882    1336.65   -158.882     
1 1 1 9  22 23 o 0 55.2    7.2   46.8   7.2  1496.29 -164.816     156.177  15.1842     1096.95   15.1842      
1 1 1 1  23 10 o 0 316.2   11.2  320.9  11.2 1737.55 145.945      1573.08  145.945     441.583   145.945      
1 1 1 3  23 10 o 0 57      4.2   65.8   4.2  494.048 -42.417      14.079   -42.417     301.211   137.583      
1 1 1 5  23 10 o 0 8       2.9   20.8   2.9  635.494 -85.2799     283.152  94.7201     682.01    94.7201      
1 1 1 9  23 10 f 1 484     18.6  504.7  18.6 1502.35 168.226      2281.61  168.226     1357.39   168.226      
1 1 1 10 11 23 o 0 88.1    5.9   99.6   5.9  615.506 16.3648      197.576  16.3648     173.757   -163.635     
1 1 1 10 15 23 o 0 32.7    5.1   16     5.1  190.344 -65.271      45.7485  114.729     152.804   114.729      
1 1 1 10 17 23 o 0 317.5   14.5  291.3  14.5 3055.5  -139.719     796.403  -139.719    873.737   40.2811      
1 1 1 10 21 23 o 0 216     13.7  214    13.7 1643.44 -151.492     1159.65  -151.492    115.536   -151.492     
1 1 1 2  23 11 o 0 360.3   12.5  364.8  12.5 2767.56 -0.43536     1257.78  -0.43536    512.849   179.565      
1 1 1 4  23 11 f 1 569.7   19.8  541.5  19.8 2425.8  9.04861      2173.79  9.04861     641.825   9.04861      
1 1 1 6  23 11 o 0 479.2   17.1  454.2  17.1 2480.7  -164.5       1791.32  -164.5      257.564   -164.5       
1 1 1 8  23 11 o 0 57.3    4.1   56.2   4.1  1206.53 -67.3475     109.28   112.652     845.356   112.652      
1 1 1 10 23 11 o 0 128.6   7.1   128.6  7.1  1221.96 112.374      480.879  112.374     255.482   -67.6258     
1 1 1 11 12 23 o 0 430.9   18.6  433    18.6 2579.72 -144.848     1619.89  -144.848    123.681   -144.848     
1 1 1 11 18 23 o 0 41      7.1   32.3   7.1  217.095 -4.07384     29.9407  175.926     175.922   175.926      
1 1 1 11 20 23 o 0 365.8   15.1  297.8  15.1 2256.72 129.08       1549.01  129.08      101.196   129.08       
1 1 1 1  23 12 o 0 335.4   12.1  338.5  12.1 3464.52 -105.569     747.586  -105.569    1473.95   74.4314      
1 1 1 3  23 12 o 0 149.1   6.4   144.2  6.4  1718.23 -139.479     529.094  -139.479    550.582   40.5215      
1 1 1 5  23 12 o 0 673.9   22.7  598.6  22.7 3273.35 8.53504      1973.22  8.53504     48.3489   -171.465     
1 1 1 7  23 12 o 0 46      4.1   45     4.1  838.208 122.628      129.572  -57.3717    639.599   -57.3717     
1 1 1 9  23 12 o 0 5.3     3.5   12.3   3.5  1042.5  -150.436     523.417  29.5637     1149.33   29.5637      
1 1 1 11 23 12 o 0 22.3    3.7   16.7   3.7  1078.8  -166.533     374.036  13.4672     998.264   13.4672      
1 1 1 12 13 23 o 0 6.1     4.6   17.8   4.6  652.597 -7.04214     264.963  172.958     636.876   172.958      
1 1 1 12 15 23 o 0 404.8   17.3  335.2  17.3 2567.59 -47.4989     1327.95  -47.4989    96.6722   132.501      
1 1 1 12 17 23 o 0 78      7.2   65.9   7.2  825.633 12.1394      205.232  12.1394     354.541   -167.861     
1 1 1 12 19 23 o 0 122.1   9     105    9    447.812 -4.31345     366.993  -4.31345    77.0402   -4.31345     
1 1 1 12 21 23 o 0 73.9    8.5   80.8   8.5  2442.66 -57.5409     257.512  122.459     1781.24   122.459      
1 1 1 4  23 13 o 0 104.7   5.1   92.5   5.1  906.068 -73.1369     272.348  -73.1369    286.595   106.863      
1 1 1 6  23 13 f 1 628.9   21.6  585.1  21.6 3649.91 -94.1498     1620.47  -94.1497    607.143   85.8503      
1 1 1 8  23 13 o 0 518.5   18.3  478    18.3 2839.02 -81.4991     1669.37  -81.4991    28.7332   98.5009      
1 1 1 10 23 13 o 0 163.2   8.7   180.5  8.7  2071.57 -89.7121     625.704  -89.7121    567.654   90.2879      
1 1 1 12 23 13 o 0 169.9   9.1   180.4  9.1  1810.02 -158.843     741.086  -158.843    286.848   21.1571      
1 1 1 13 14 23 f 1 15      5.6   38.6   5.6  747.96  -152.221     150.653  27.7786     570.945   27.7786      
1 1 1 13 16 23 o 0 77.2    7.2   62.6   7.2  471.851 -132.029     146.766  -132.029    175.658   47.9714      
1 1 1 13 20 23 o 0 151.4   10.1  115.7  10.1 2004.26 151.642      459.855  151.642     802.447   -28.3581     
1 1 1 13 22 23 o 0 62      11.6  68.5   11.6 834.921 176.128      113.037  176.128     392.275   -3.87223     
1 1 1 1  23 14 o 0 426.2   15.3  449.4  15.3 2645.69 -29.6246     1619.85  -29.6246    42.7821   150.375      
1 1 1 3  23 14 o 0 443.3   15.4  426.7  15.4 2533.5  -95.8335     1633.61  -95.8335    72.9006   -95.8335     
1 1 1 5  23 14 o 0 261     9.4   248.9  9.4  3603.53 103.235      239.496  103.235     1941.57   -76.7647     
1 1 1 9  23 14 f 1 511.7   20.5  510.8  20.5 2595.54 60.2399      1875.37  60.2399     378.808   60.2399      
1 1 1 11 23 14 o 0 11.1    4.1   11.1   4.1  1201.76 136.208      529.039  -43.7916    1208.12   -43.7916     
1 1 1 13 23 14 f 1 207.1   10.3  184.7  10.3 1306    -61.8151     991.375  -61.8151    260.809   -61.8151     
1 1 1 14 15 23 o 0 2.3     5.8   -0.5   5.8  443.717 179.521      277.749  -0.478891   583.191   -0.478891    
1 1 1 14 17 23 o 0 41.1    6.8   39.2   6.8  535.891 70.1013      57.9471  -109.899    415.171   -109.899     
1 1 1 14 19 23 o 0 338.1   15.4  274.7  15.4 1524.91 35.3991      1727.22  35.3991     758.184   35.3991      
1 1 1 2  23 15 o 0 230.3   8.6   220.6  8.6  2303.7  137.22       770.63   137.22      645.687   -42.7798     
1 1 1 4  23 15 o 0 317.5   11.4  299.3  11.4 1171.92 -130.192     1525.16  -130.192    817.974   -130.192     
1 1 1 8  23 15 o 0 36.9    4.5   43.7   4.5  1405.67 151.035      229.424  -28.9646    1031.37   -28.9646     
1 1 1 10 23 15 o 0 136     7.8   139.3  7.8  922.128 20.8458      648.257  20.8458     130.028   20.8458      
1 1 1 12 23 15 o 0 126.8   7.3   117.8  7.3  764.478 -10.7653     506.836  -10.7653    83.8887   -10.7653     
1 1 1 14 23 15 o 0 200.9   10.7  185.9  10.7 2375.02 154.446      729.708  154.446     896.479   -25.5539     
1 1 1 15 16 23 o 0 162.4   9.6   146.5  9.6  2056.07 82.3518      607.952  82.3518     772.996   -97.6482     
1 1 1 1  23 16 o 0 76.1    5.2   68.3   5.2  1691.22 -127.133     21.1188  -127.133    991.152   52.8673      
1 1 1 5  23 16 o 0 500.6   17.2  487.9  17.2 3774.57 -129.173     1219.28  -129.173    958.031   50.8266      
1 1 1 7  23 16 o 0 343.1   12.6  354.4  12.6 2386.75 -109.891     1348.85  -109.891    5.62937   70.1088      
1 1 1 9  23 16 o 0 484.8   18.5  511.9  18.5 3084.69 120.281      1549.87  120.281     173.555   -59.7188     
1 1 1 11 23 16 o 0 63      5.6   46.6   5.6  1495.02 4.16576      83.5501  -175.834    905.704   -175.834     
1 1 1 13 23 16 o 0 134.8   8.5   147.4  8.5  1718.57 -139.048     668.239  -139.048    501.867   40.9523      
1 1 1 15 23 16 o 0 102.9   7.7   90.5   7.7  915.176 -137.66      429.89   -137.66     181.147   42.3398      
1 1 1 16 17 23 o 0 84.4    8.1   70.3   8.1  1540.71 -64.0525     128.799  -64.0525    865.912   115.948      
1 1 1 2  23 17 o 0 34.7    4.6   48     4.6  1085.36 -144.069     128.991  35.9313     763.334   35.9313      
1 1 1 4  23 17 o 0 191.7   8.1   198.7  8.1  2053.41 104.063      767.976  104.063     410.5     -75.9368     
1 1 1 8  23 17 o 0 201.1   8.6   188.7  8.6  2067.4  45.1089      735.786  45.1089     412.01    -134.891     
1 1 1 10 23 17 o 0 158     8     170.7  8    1440.67 -84.9234     763.261  -84.9234    23.8034   95.0766      
1 1 1 12 23 17 o 0 177     9.8   184.1  9.8  1737.25 94.6943      952.271  94.6943     222.993   -85.3057     
1 1 1 14 23 17 o 0 138.1   9.6   157.3  9.6  1851.89 -104.124     647.355  -104.124    582.07    75.8757      
1 1 1 16 23 17 o 0 266.5   13.5  237.6  13.5 2348.6  40.3424      1071.41  40.3424     435.465   -139.658     
1 1 1 17 18 23 o 0 205     12.2  168.6  12.2 2798.21 -168.13      425.598  -168.13     1327.64   11.8704      
1 1 1 17 22 23 o 0 45.1    12.6  58.7   12.6 807.081 57.1283      35.9787  -122.872    496.578   -122.872     
1 1 1 1  23 18 o 0 39.7    5     39.6   5    900.475 60.6842      113.581  -119.316    636.804   -119.316     
1 1 1 3  23 18 o 0 115.1   6.2   113.2  6.2  1899.67 18.6441      299.099  18.6441     784.627   -161.356     
1 1 1 5  23 18 o 0 47.1    5     47.3   5    411.204 -76.9588     0.537477 103.041     231.075   103.041      
1 1 1 7  23 18 o 0 57.2    4.9   63.7   4.9  1469.81 -156.192     27.6959  23.8079     838.133   23.8079      
1 1 1 9  23 18 o 0 14.4    4.4   18     4.4  720.53  -38.9312     322.761  141.069     815.002   141.069      
1 1 1 11 23 18 o 0 175.8   8.5   161.6  8.5  1383.12 -179.013     986.27   -179.013    57.2225   -179.013     
1 1 1 13 23 18 o 0 22.9    6.4   -11.6  6.4  1418.02 -115.415     745.071  64.5852     1680.23   64.5852      
1 1 1 17 23 18 o 0 22.8    8.6   -2.8   8.6  872.409 -106.394     408.355  73.6058     951.588   73.6058      
1 1 1 2  23 19 o 0 193.9   8.6   195.7  8.6  1944.42 51.8523      800.74   51.8523     300.521   -128.148     
1 1 1 4  23 19 o 0 228.7   9.7   228.7  9.7  2033.37 -35.2212     931.29   -35.2212    200.381   144.779      
1 1 1 8  23 19 o 0 138.2   7.5   133    7.5  1906.26 3.44012      536.369  3.44012     755.783   -176.56      
1 1 1 10 23 19 o 0 24.1    5.3   32.1   5.3  1320.85 42.2827      406.818  -137.717    1287.12   -137.717     
1 1 1 12 23 19 o 0 211.5   10.4  204.2  10.4 2563.66 95.8376      697.478  95.8376     960.068   -84.1624     
1 1 1 14 23 19 o 0 248.9   12.7  198    12.7 2307.76 -141.775     923.652  -141.775    538.828   38.2248      
1 1 1 16 23 19 o 0 238.2   13.7  217.5  13.7 2853.18 -16.465      632.12   -16.465     1134.86   163.535      
1 1 1 18 23 19 o 0 264.8   13.6  202.8  13.6 1407.89 138.975      1296.55  138.975     447.818   138.975      
1 1 1 1  23 20 o 0 83.1    6.6   72.2   6.6  735.537 -179.882     260.1    -179.882    259.977   0.118133     
1 1 1 3  23 20 o 0 52.5    6     48.9   6    1455.95 -23.8201     157.445  156.18      1169.34   156.18       
1 1 1 5  23 20 o 0 310     12    301.1  12   1663.97 -52.1548     1767.25  -52.1548    630.167   -52.1548     
1 1 1 7  23 20 o 0 127.9   9     126.4  9    2257.66 90.807       285.029  90.807      1232.2    -89.193      
1 1 1 9  23 20 o 0 241.2   11.1  273.2  11.1 1577.7  -119.511     1480.15  -119.511    437.69    -119.511     
1 1 1 13 23 20 o 0 242.2   12.2  202.4  12.2 1722.34 -71.3353     1171.75  -71.3353    88.6842   -71.3353     
1 1 1 15 23 20 f 1 169.5   11.2  135.5  11.2 875.082 -90.8232     804.374  -90.8232    263.006   -90.8232     
1 1 1 17 23 20 o 0 69.4    10.1  48.4   10.1 1769.18 142.298      139.309  -37.7023    1200.37   -37.7023     
1 1 1 2  23 21 o 0 257.8   11.6  260.9  11.6 978.209 77.0414      1654.1   77.0414     981.035   77.0414      
1 1 1 4  23 21 o 0 89.9    7.4   81.7   7.4  1388.16 -113.445     272.493  -113.445    666.949   66.5551      
1 1 1 6  23 21 o 0 48.8    6.7   48.7   6.7  2149.18 105.914      473.182  -74.0856    1903.72   -74.0856     
1 1 1 8  23 21 o 0 82.3    6.6   79.7   6.6  2163.16 -124.931     89.558   55.0695     1488.09   55.0695      
1 1 1 12 23 21 o 0 207.5   10.8  179.6  10.8 1873.71 104.789      921.006  104.789     247       -75.2109     
1 1 1 14 23 21 o 0 193.9   11.8  169    11.8 1691.14 165.856      894.713  165.856     137.495   -14.1444     
1 1 1 1  23 22 o 0 30.7    6.8   40.1   6.8  1284.54 114.547      296.592  -65.4535    1170.01   -65.4535     
1 1 1 3  23 22 o 0 219.1   10.8  235.1  10.8 1692.34 -40.6377     1268.66  -40.6377    136.102   -40.6377     
1 1 1 7  23 22 o 0 310     15.1  279.5  15.1 1521.07 -86.8305     1669.23  -86.8305    696.109   -86.8305     
1 1 1 9  23 22 o 0 366.5   15.2  372.8  15.2 1999.77 150.975      1809.52  150.975     552.021   150.975      
1 1 1 11 23 22 o 0 266.8   12.2  262    12.2 3178.39 -18.6521     652.224  -18.6521    1309.89   161.348      
1 1 1 2  23 23 o 0 136.8   9.6   130    9.6  672.832 -60.3628     625.226  -60.3628    186.163   -60.3628     
1 1 1 6  23 23 o 0 57.9    8.2   74     8.2  604.042 53.1136      121.862  53.1136     260.071   -126.886     
1 1 1 10 23 23 o 0 265.1   13    258.8  13   1941.49 39.2531      1261.25  39.2531     75.5744   39.2531      
1 1 1 1  24 1  o 0 509     16.5  526.3  16.5 3532.07 83.9606      1190.39  83.9606     645.108   -96.0394     
1 1 1 1  5  24 o 0 21.7    2.2   18.8   2.2  588.426 123.693      198.272  -56.3072    503.42    -56.3072     
1 1 1 1  7  24 f 1 421.8   14.3  408.3  14.3 2788.6  95.9484      1472.14  95.9484     326.996   -84.0516     
1 1 1 1  9  24 o 0 282.7   10    282.7  10   2576.05 93.1851      969.27   93.1851     668.677   -86.8149     
1 1 1 1  11 24 o 0 31.4    2.5   29.2   2.5  1263.48 87.5477      410.172  -92.4523    1202.89   -92.4523     
1 1 1 1  13 24 o 0 145.9   6.2   140.2  6.2  2128.23 -43.1507     336.02   -43.1507    975.786   136.849      
1 1 1 1  17 24 o 0 199     8.7   223.8  8.7  669.716 127.179      1006.01  127.179     621.971   127.179      
1 1 1 1  19 24 o 0 49.4    6.3   45.6   6.3  79.8711 -86.5852     1.54658  -86.5852    54.4013   93.4148      
1 1 1 1  23 24 o 0 199.6   11.4  198    11.4 1961.12 152.251      939.781  152.251     320.94    -27.7486     
1 1 1 2  24 2  o 0 216.8   7.5   218.4  7.5  2721.06 -145.612     436.747  -145.612    968.864   34.3884      
1 1 1 2  6  24 o 0 417.7   14.6  440.9  14.6 1768.06 -99.0038     2028.56  -99.0038    901.34    -99.0038     
1 1 1 2  8  24 o 0 137.8   5.5   144.2  5.5  723.49  -123.986     525.764  -123.986    67.7007   -123.986     
1 1 1 2  10 24 f 1 87.5    4.1   91     4.1  357.214 134.575      117.892  134.575     107.021   -45.4246     
1 1 1 2  12 24 o 0 387.4   12.5  374.3  12.5 2149.59 29.0694      1598.2   29.0694     272.952   29.0694      
1 1 1 2  14 24 o 0 88.5    4.9   88.9   4.9  2466.91 -29.5798     248.092  150.42      1739.36   150.42       
1 1 1 2  16 24 o 0 280.5   10.7  287    10.7 2074.93 -39.9033     1222.1   -39.9033    26.2172   -39.9033     
1 1 1 2  18 24 o 0 114.9   6.6   129.8  6.6  1114.5  -124.836     552.24   -124.836    72.3207   55.1643      
1 1 1 2  20 24 o 0 260.9   11.6  260.8  11.6 430.039 43.327       1159.33  43.327      865.426   43.327       
1 1 1 2  22 24 o 0 16.5    8.2   41     8.2  740.173 -34.2031     165.764  145.797     647.62    145.797      
1 1 1 1  24 3  f 1 746.8   22.7  751.8  22.7 4351.61 -156.404     1434.46  -156.404    849.33    23.5961      
1 1 1 3  5  24 o 0 545.8   18.5  558.2  18.5 3016.03 -10.1424     1870.9   -10.1424    40.4497   169.858      
1 1 1 3  7  24 o 0 287.7   10.2  290.2  10.2 1497.3  -2.94692     1450.79  -2.94692    506.88    -2.94692     
1 1 1 3  11 24 o 0 24.3    2.3   17.3   2.3  1032.29 -28.5977     410.517  151.402     1046.69   151.402      
1 1 1 3  13 24 o 0 190.3   8.1   200    8.1  1370.33 6.11558      908.893  6.11558     79.0495   6.11558      
1 1 1 3  15 24 o 0 549.2   19.8  569.2  19.8 3877.71 -126.262     1392.64  -126.262    851.247   53.7379      
1 1 1 3  19 24 o 0 124.1   7.8   148.2  7.8  1010.15 -3.36073     799.855  -3.36073    103.492   -3.36073     
1 1 1 3  21 24 o 0 106.1   8.7   116.8  8.7  663.042 -42.6396     490.654  -42.6396    48.8372   -42.6396     
1 1 1 3  23 24 o 0 20.7    8.5   43.1   8.5  467.781 -106.84      81.9648  73.16       378.374   73.16        
1 1 1 4  24 4  o 0 25.1    2.2   24.9   2.2  1116.37 -67.8326     416.495  112.167     1123.29   112.167      
1 1 1 4  8  24 f 1 528.1   17.4  506.4  17.4 2397.02 -107.125     2032.42  -107.125    530.499   -107.125     
1 1 1 4  10 24 o 0 319.3   10.6  314.5  10.6 2917.36 -76.821      925.541  -76.821     871.156   103.179      
1 1 1 4  12 24 o 0 115     6     121.6  6    1273.23 -12.8837     403.093  -12.8837    368.894   167.116      
1 1 1 4  14 24 o 0 190.6   7.9   174    7.9  1836.65 29.4026      792.396  29.4026     273.852   -150.597     
1 1 1 4  18 24 o 0 135.2   8.1   122.8  8.1  1565.72 64.7202      507.801  64.7202     355.616   -115.28      
1 1 1 4  20 24 o 0 63.5    7.5   64.5   7.5  1342.58 14.3397      43.5519  14.3397     859.758   -165.66      
1 1 1 4  22 24 o 0 298.7   13.8  292.7  13.8 1566.6  158.046      1660.61  158.046     656.08    158.046      
1 1 1 1  24 5  o 0 502.2   15.4  476.1  15.4 3399.09 -59.7331     1169.81  -59.7331    604.369   120.267      
1 1 1 5  7  24 o 0 374.8   12.9  374    12.9 2478.95 -76.0315     1423.46  -76.0315    117.667   103.969      
1 1 1 5  9  24 o 0 219.7   8     242.4  8    1530.17 39.9564      1104.08  39.9564     162.348   39.9564      
1 1 1 5  13 24 o 0 93.4    5.4   93     5.4  759.805 -174.513     212.062  -174.513    240.906   5.48693      
1 1 1 5  15 24 o 0 31.2    4.8   41     4.8  2046.18 -179.768     511.741  0.232452    1677.18   0.232452     
1 1 1 5  17 24 o 0 192.1   9.3   176.9  9.3  1215.3  117.599      936.79   117.599     262.22    117.599      
1 1 1 5  19 24 o 0 80.8    6.8   66     6.8  1677.14 -133.525     46.5969  -133.525    1091.48   46.4751      
1 1 1 5  23 24 o 0 153.6   11    169.8  11   1671.37 -34.2176     784.86   -34.2176    258.116   145.782      
1 1 1 2  24 6  o 0 46.7    3.2   48.3   3.2  1116.95 18.3065      185.119  -161.694    901.573   -161.694     
1 1 1 4  24 6  o 0 256.3   9.4   268.1  9.4  2325.04 -28.8115     982.951  -28.8115    483.8     151.188      
1 1 1 6  8  24 o 0 336.8   11.6  324.9  11.6 1451.44 -84.8282     1628.73  -84.8282    735.89    -84.8282     
1 1 1 6  10 24 o 0 39.7    3.3   37.8   3.3  580.567 -125.748     120.055  54.2518     472.741   54.2518      
1 1 1 6  12 24 o 0 247.3   10.5  264.9  10.5 1595.8  -2.81481     1185.78  -2.81481    232.055   -2.81481     
1 1 1 6  14 24 o 0 248.7   10.5  258.5  10.5 2996.4  13.2757      622.691  13.2757     1090.99   -166.724     
1 1 1 6  18 24 o 0 10.3    6     9.5    6    537.916 -70.1177     291.723  109.882     659.544   109.882      
1 1 1 6  22 24 o 0 83.4    8.1   109.8  8.1  1389.03 146.714      362.577  146.714     514.168   -33.2862     
1 1 1 1  24 7  f 1 22.7    2.5   17.1   2.5  1515.9  -37.0755     667.577  142.924     1652.45   142.924      
1 1 1 3  24 7  o 0 567.3   19.5  549.1  19.5 3490.75 36.0309      1624.07  36.0309     588.842   -143.969     
1 1 1 7  15 24 o 0 212.9   10.9  203.9  10.9 2342.72 6.00711      694.924  6.00711     620.073   -173.993     
1 1 1 7  19 24 o 0 295.5   14.9  289.8  14.9 1677.67 176.97       1650.26  176.97      529.483   176.97       
1 1 1 7  23 24 o 0 223.7   13.1  193.3  13.1 2077.02 29.273       908.959  29.273      366.315   -150.727     
1 1 1 2  24 8  o 0 733.9   24.1  738.7  24.1 3745.23 -110.866     2084.81  -110.866    301.792   69.1337      
1 1 1 4  24 8  f 1 386.3   13.2  373.2  13.2 2660.98 178.914      1355.2   178.914     320.372   -1.0856      
1 1 1 6  24 8  o 0 112     5.1   114.2  5.1  2134.91 84.0947      106.77   84.0947     1210.7    -95.9053     
1 1 1 8  24 8  o 0 389.7   14.3  412.6  14.3 1356.79 105.142      1941.62  105.142     1114.67   105.142      
1 1 1 8  10 24 o 0 71.8    4.3   68.6   4.3  257.253 108.201      33.3121  108.201     121.183   -71.7992     
1 1 1 8  12 24 o 0 285.2   13.2  303.3  13.2 2849.09 86.8691      817.922  86.8691     863.419   -93.1309     
1 1 1 8  14 24 o 0 220.3   10.8  205.8  10.8 1428.44 -144.416     1074.86  -144.416    269.016   -144.416     
1 1 1 8  18 24 f 1 151.9   9.8   138.9  9.8  695.478 -137.671     760.172  -137.671    289.21    -137.671     
1 1 1 1  24 9  o 0 107.6   5     113.3  5    1034.91 -1.53251     377.382  -1.53251    285.578   178.467      
1 1 1 3  24 9  o 0 653.9   19.4  607.4  19.4 2068.57 167.376      2618.72  167.376     1319.17   167.376      
1 1 1 7  24 9  o 0 338.7   11.7  327.4  11.7 2376.09 -56.6372     1264.64  -56.6372    183.478   123.363      
1 1 1 9  11 24 o 0 47.8    4.9   44.5   4.9  1366.85 45.1304      252.177  -134.87     1061.76   -134.87      
1 1 1 9  13 24 o 0 179.9   9.4   168.2  9.4  1343.31 -132.631     873.107  -132.631    111.627   -132.631     
1 1 1 9  17 24 o 0 296.2   15.1  298    15.1 2764.71 -171.239     1120.88  -171.239    754.574   8.76104      
1 1 1 9  21 24 f 1 61.4    10.5  113.9  10.5 1247.51 -178.011     346.189  -178.011    440.721   1.98944      
1 1 1 2  24 10 f 1 565.2   19.7  529.5  19.7 2921.67 -22.2429     1887.28  -22.2429    35.1777   -22.2429     
1 1 1 4  24 10 o 0 492.6   17.2  445.9  17.2 2344.76 110.335      1873.33  110.335     421.894   110.335      
1 1 1 6  24 10 o 0 72.6    4.4   66.6   4.4  713.601 -98.6909     58.8486  -98.6909    376.065   81.3091      
1 1 1 8  24 10 o 0 123.1   6     125.3  6    687.755 -32.8839     388.606  -32.8839    24.8559   147.116      
1 1 1 10 14 24 o 0 385.4   16.6  341.2  16.6 2606.84 -82.2096     1281.07  -82.2096    170.361   97.7904      
1 1 1 10 16 24 o 0 53.7    6.7   40.4   6.7  1414.87 -105.691     180.323  74.3093     1146.77   74.3093      
1 1 1 3  24 11 o 0 238.6   9.9   256.8  9.9  2124.96 171.284      983.007  171.284     334.466   -8.71554     
1 1 1 5  24 11 o 0 42.6    3.7   36.1   3.7  1557.04 -113.909     397.697  66.0912     1346.7    66.0912      
1 1 1 7  24 11 o 0 97      4.9   85.9   4.9  224.58  34.5204      79.2092  34.5204     55.6323   -145.48      
1 1 1 9  24 11 o 0 515.3   18.7  483    18.7 2558.89 -118.122     1795.34  -118.122    279.991   -118.122     
1 1 1 11 24 11 o 0 148.8   8.1   143.7  8.1  1142.4  -56.24       724.936  -56.24      73.3839   -56.24       
1 1 1 11 17 24 o 0 126.7   9.6   135.3  9.6  1521.42 120.143      644.433  120.143     371.886   -59.8566     
1 1 1 6  24 12 o 0 175.7   7.4   160.9  7.4  1628.11 -84.6691     677.172  -84.6691    299.052   95.3309      
1 1 1 8  24 12 o 0 15.5    3.6   12.5   3.6  833.215 -93.9591     373.454  86.0409     865.716   86.0409      
1 1 1 10 24 12 o 0 82.9    5.6   72     5.6  1049.17 128.14       211.262  128.14      385.417   -51.86       
1 1 1 12 14 24 f 1 85.4    7.1   82.1   7.1  1839.41 -161.953     66.2821  -161.953    949.79    18.0469      
1 1 1 12 16 24 o 0 187.4   10.4  161.2  10.4 1445.39 97.7301      1014.23  97.7301     41.78     97.7301      
1 1 1 12 20 24 o 0 93.6    8.9   66     8.9  617.13  -37.6458     225.2    -37.6458    158.584   142.354      
1 1 1 3  24 13 o 0 460.8   15.6  444.2  15.6 3256.27 26.0192      1303.32  26.0192     680.555   -153.981     
1 1 1 5  24 13 o 0 18.9    3.7   14.7   3.7  1505.52 123.579      653.59   -56.4212    1554.93   -56.4212     
1 1 1 7  24 13 o 0 84.6    5.1   93.8   5.1  1597.99 55.9306      206.271  55.9306     713.224   -124.069     
1 1 1 9  24 13 o 0 464.5   19    466    19   3359.85 17.3285      1311.4   17.3285     593.195   -162.672     
1 1 1 13 24 13 o 0 171     9.9   195.1  9.9  2734.92 -108.868     363.229  -108.868    1139.04   71.1323      
1 1 1 13 15 24 o 0 104.3   8.3   94.1   8.3  1803.75 98.1582      258.903  98.1582     962.767   -81.8418     
1 1 1 13 17 24 o 0 145.8   9.8   125.8  9.8  1748.75 71.4096      591.013  71.4096     543.802   -108.59      
1 1 1 13 21 24 o 0 79.9    10.3  80.2   10.3 1178.85 129.02       220.866  129.02      491.329   -50.9804     
1 1 1 6  24 14 o 0 238.4   9.5   222.9  9.5  1854.21 57.7511      1046.07  57.7511     17.8113   -122.249     
1 1 1 8  24 14 o 0 69.5    5     76.6   5    1881.04 -19.5295     39.4123  160.471     1101.87   160.471      
1 1 1 10 24 14 o 0 211.6   10.1  200.7  10.1 2411.29 146.5        645.63   146.5       695.45    -33.5        
1 1 1 12 24 14 f 1 316.7   14.5  327.6  14.5 1622.42 97.2189      1497.23  97.2189     604.402   97.2189      
1 1 1 14 24 14 f 1 311.6   13.9  283.9  13.9 1070.56 99.7058      1859.41  99.7058     1130.78   99.7058      
1 1 1 1  24 15 o 0 392.2   14.3  404.1  14.3 2448.52 173.753      1588.91  173.753     136.392   173.753      
1 1 1 5  24 15 o 0 220.8   9.9   193.9  9.9  1715.76 33.6281      971.419  33.6282     9.80055   -146.372     
1 1 1 7  24 15 o 0 192     8.1   194.9  8.1  1959.79 -45.6974     781.561  -45.6974    320.941   134.303      
1 1 1 9  24 15 o 0 211.1   10    199.3  10   1190.74 137.263      1053.36  137.263     394.076   137.263      
1 1 1 11 24 15 o 0 334.7   14.7  325.1  14.7 2635.35 29.6451      1101.91  29.6451     333.686   -150.355     
1 1 1 13 24 15 o 0 23.5    5.5   5.7    5.5  908.928 -73.686      392.762  106.314     1005.44   106.314      
1 1 1 15 24 15 o 0 316.3   15.2  291.1  15.2 2868.96 139.295      1067.21  139.295     827.987   -40.7049     
1 1 1 15 17 24 o 0 206.6   12.9  189.5  12.9 1455.01 -162.867     1117.37  -162.867    190.909   -162.867     
1 1 1 15 19 24 o 0 96.3    10.4  103.8  10.4 340.781 156.965      219.518  156.965     10.1383   156.965      
1 1 1 15 21 24 f 1 74      12.2  86.4   12.2 2987.72 -97.657      495.924  82.343      2271.15   82.343       
1 1 1 2  24 16 o 0 49.8    4.6   47.6   4.6  483.802 -48.1203     5.55708  -48.1203    275.078   131.88       
1 1 1 6  24 16 o 0 535.4   18.3  526.1  18.3 3282.47 -96.5626     1562.69  -96.5626    275.584   83.4374      
1 1 1 12 24 16 o 0 65.4    7     80.8   7    1256.9  -3.37394     173.366  -3.37394    669.726   176.626      
1 1 1 16 24 16 o 0 270.9   13.9  251.6  13.9 1978.52 52.3914      1292.17  52.3914     34.964    52.3914      
1 1 1 5  24 17 o 0 423.5   15.2  404.7  15.2 3588.27 -85.0611     985.614  -85.0611    1013.5    94.9389      
1 1 1 11 24 17 o 0 278.3   13.7  313.2  13.7 2031.4  -104.998     1503.78  -104.998    148.916   -104.998     
1 1 1 13 24 17 o 0 275.2   13.1  251.5  13.1 2435.29 83.0932      1096.37  83.0932     478.099   -96.9068     
1 1 1 15 24 17 o 0 137     9.9   124.3  9.9  1397.16 -151.178     643.005  -151.178    241.203   28.8218      
1 1 1 17 24 17 o 0 9       9     15.6   9    1114.89 -25.7492     513.935  154.251     1202.16   154.251      
1 1 1 17 19 24 o 0 160.4   11.8  110    11.8 1875.18 -165.476     515.555  -165.476    609.277   14.5242      
1 1 1 2  24 18 o 0 6.1     5.2   10.7   5.2  477.377 172.035      220.559  -7.96527    489.573   -7.96527     
1 1 1 4  24 18 o 0 150.6   7.5   148.8  7.5  1852.34 -142.434     550.896  -142.434    474.805   37.5657      
1 1 1 6  24 18 o 0 66.9    6.4   55.4   6.4  1884.23 -87.9041     189.045  92.0959     1480.94   92.0959      
1 1 1 10 24 18 f 1 311.6   13.2  318.1  13.2 1582.79 145.379      1790.62  145.379     735.859   145.379      
1 1 1 12 24 18 o 0 19      6.3   21     6.3  663.449 152.386      252.832  -27.6145    679.168   -27.6145     
1 1 1 14 24 18 o 0 85.9    9.1   90.8   9.1  1800    153.393      140.469  153.393     992.74    -26.6074     
1 1 1 16 24 18 o 0 166.8   12.7  151.3  12.7 2370.08 -30.839      449.056  -30.839     1008.35   149.161      
1 1 1 18 24 18 o 0 198.3   12.6  154.7  12.6 2198.61 91.9986      643.506  91.9986     671.786   -88.0014     
1 1 1 1  24 19 o 0 12.5    5.8   21.2   5.8  1272.11 128.009      582.717  -51.9911    1478.82   -51.9911     
1 1 1 3  24 19 o 0 160.1   7.9   145.2  7.9  1742.98 137.908      763.394  137.908     443.368   -42.0916     
1 1 1 5  24 19 o 0 224.8   9.5   195.4  9.5  1433.82 -81.8957     1279.93  -81.8957    303.969   -81.8957     
1 1 1 7  24 19 o 0 132.8   10.1  140.9  10.1 1772.34 158.066      598.094  158.066     588.053   -21.9336     
1 1 1 9  24 19 o 0 13.9    5.4   19.7   5.4  1110.63 -106.171     477.524  73.8288     1208.14   73.8288      
1 1 1 11 24 19 o 0 50.3    6.7   52.8   6.7  1053.9  21.5172      38.5895  -158.483    711.119   -158.483     
1 1 1 13 24 19 o 0 18.7    8     23.2   8    1428.83 -102.146     551.227  77.854      1445.1    77.854       
1 1 1 15 24 19 o 0 57.2    9.1   28.8   9.1  1867.28 6.76801      344.468  -173.232    1486.74   -173.232     
1 1 1 17 24 19 o 0 194.4   13.1  144.2  13.1 704.906 39.1211      824.82   39.1211     404.633   39.1211      
1 1 1 19 24 19 o 0 57.9    12.1  70.9   12.1 654.748 135.728      58.1905  135.728     316.646   -44.2715     
1 1 1 2  24 20 o 0 341     13.4  359.4  13.4 3375.6  66.7518      1039.13  66.7518     1277.65   -113.248     
1 1 1 4  24 20 o 0 105.7   7.5   112.9  7.5  1277.43 148.963      525.329  148.963     336.871   -31.0368     
1 1 1 6  24 20 f 1 269.7   12.3  231.8  12.3 2171.76 -143.063     1169.33  -143.063    280.238   36.9373      
1 1 1 8  24 20 o 0 46.8    5.8   51.3   5.8  855.825 116.901      30.6266  -63.0991    582.211   -63.0991     
1 1 1 10 24 20 o 0 217.1   11.1  236.5  11.1 1239.9  140.034      1336     140.034     551.017   140.034      
1 1 1 14 24 20 f 1 18.5    9.1   42.5   9.1  1700.52 -43.1562     448.765  136.844     1488.2    136.844      
1 1 1 18 24 20 o 0 115.5   12.8  118.3  12.8 1304.81 -52.234      437.26   -52.234     307.325   127.766      
1 1 1 1  24 21 o 0 130.1   8.9   145.3  8.9  2442.67 -58.5185     276.309  -58.5185    1382.64   121.482      
1 1 1 3  24 21 o 0 242.9   11.7  269.3  11.7 1785.42 -14.0382     1402.47  -14.0382    209.237   -14.0382     
1 1 1 5  24 21 o 0 429.9   16.4  434    16.4 2747.59 103.641      1754.58  103.641     29.7419   -76.3593     
1 1 1 9  24 21 f 1 108.2   8.1   103.5  8.1  1350.64 84.9603      438.218  84.9603     414.084   -95.0397     
1 1 1 11 24 21 f 1 194.2   10.4  159.7  10.4 1579.33 -123.093     912.916  -123.093    65.1704   56.9074      
1 1 1 2  24 22 o 0 260     12.1  241.7  12.1 2214.48 81.2494      1151.29  81.2494     293.795   -98.7506     
1 1 1 4  24 22 o 0 193.3   10.7  205.2  10.7 1743.35 -77.4423     1036.63  -77.4423    83.248    102.558      
1 1 1 10 24 22 o 0 114.9   9.4   116.1  9.4  1938.46 -44.4217     318.514  -44.4217    863.982   135.578      
1 1 1 14 24 22 o 0 134.1   12.8  139.1  12.8 1552.42 55.9235      546.489  55.9235     352.163   -124.077     
1 1 1 1  24 23 o 0 194.6   11.4  184    11.4 2013.74 22.4155      855.224  22.4155     441.162   -157.585     
1 1 1 3  24 23 o 0 234.3   12.5  231.2  12.5 1239.56 -40.3151     1372.09  -40.3151    585.775   -40.3151     
1 1 1 13 24 23 o 0 46.8    10.5  45.1   10.5 1214.56 175.398      169.02   -4.60171    865.817   -4.60171     
1 1 1 2  24 24 o 0 29      9.3   46.6   9.3  854.494 -31.3623     124.53   148.638     658.789   148.638      
1 1 1 4  24 24 o 0 136.9   10.7  125.7  10.7 2242.69 26.6465      311.115  26.6465     1070.76   -153.353     
1 1 1 6  24 24 o 0 226.8   13.3  183    13.3 2060.77 -178.166     889.654  -178.166    360.343   1.83418      
1 1 1 8  24 24 o 0 25.6    10    46.7   10   841.919 -38.2981     123.098  141.702     625.206   141.702      
1 1 1 10 24 24 o 0 57.8    10.6  53.1   10.6 1003.5  8.41834      37.2378  -171.582    618.839   -171.582     
1 1 1 1  2  25 o 0 160.6   6.2   176.4  6.2  1489.21 -101.854     747.262  -101.854    186.99    78.1455      
1 1 1 1  4  25 o 0 7.3     2.4   14.3   2.4  1067.35 12.598       537.756  -167.402    1208.66   -167.402     
1 1 1 1  6  25 o 0 119.1   4.9   106.6  4.9  1985.38 153.324      171.542  153.324     1073.54   -26.6755     
1 1 1 1  8  25 o 0 197.2   7.3   191.9  7.3  1416.99 -36.2713     923.285  -36.2714    40.5124   -36.2714     
1 1 1 1  10 25 o 0 309.8   10.4  304.3  10.4 1401.22 38.0115      1528.27  38.0115     664.847   38.0115      
1 1 1 1  12 25 o 0 141.3   5.7   139.7  5.7  2026.5  -22.4786     354.954  -22.4786    874.768   157.521      
1 1 1 1  14 25 o 0 45.5    3.8   35.7   3.8  661.842 -64.9257     60.2213  115.074     444.75    115.074      
1 1 1 1  16 25 f 1 322.5   12.2  338.3  12.2 2774.48 -133.881     1074.4   -133.881    508.294   46.119       
1 1 1 1  18 25 o 0 68.4    5.1   74.2   5.1  1124.87 -6.12707     180.511  -6.12707    600.775   173.873      
1 1 1 1  20 25 o 0 125.7   8.9   151.2  8.9  804.357 -50.0265     758.138  -50.0265    217.269   -50.0265     
1 1 1 1  22 25 o 0 22.2    8.8   27.8   8.8  491.393 91.6518      152.574  -88.3482    467.258   -88.3482     
1 1 1 1  25 2  o 0 195.3   6.6   184.5  6.6  1343.72 179.542      920.551  179.542     70.7499   179.542      
1 1 1 2  3  25 o 0 19      2.3   14.2   2.3  1253.62 -79.3631     563.167  100.637     1344.7    100.637      
1 1 1 2  5  25 o 0 14.6    2.5   18.6   2.5  570.298 4.58116      252.29   -175.419    607.601   -175.419     
1 1 1 2  7  25 o 0 37.9    2.9   43.2   2.9  1293.51 -39.926      300.422  140.074     1102.51   140.074      
1 1 1 2  9  25 o 0 78.4    3.9   72.4   3.9  362.57  -118.99      65.2676  -118.99     157.562   61.0096      
1 1 1 2  11 25 o 0 93.8    4.2   76.4   4.2  1406.94 44.101       114.72   44.101      738.684   -135.899     
1 1 1 2  13 25 o 0 64.7    4.3   76     4.3  2031.33 -162.936     125.014  17.0645     1307.45   17.0645      
1 1 1 2  15 25 o 0 333.4   12.8  335.7  12.8 2577.96 -120.929     1200.91  -120.929    267.696   59.0705      
1 1 1 2  17 25 o 0 49.8    4.7   49.3   4.7  1992.43 106.838      321.383  -73.1621    1427.56   -73.1621     
1 1 1 2  19 25 o 0 232.7   11.2  251.1  11.2 1966.12 84.1429      1251.25  84.1429     83.0223   -95.8571     
1 1 1 2  21 25 f 1 21.8    7.7   1.3    7.7  759.086 113.39       361.857  -66.6104    856.451   -66.6104     
1 1 1 2  23 25 o 0 79.3    10.8  112.7  10.8 1166    128.145      396.291  128.145     330.899   -51.8546     
1 1 1 2  25 3  o 0 290.5   9.7   286.5  9.7  2781.64 57.2271      878.522  57.2271     868.211   -122.773     
1 1 1 3  4  25 o 0 669.3   22.4  695    22.4 1701.22 -32.1683     2899.33  -32.1683    1846.18   -32.1683     
1 1 1 3  6  25 o 0 283.5   10.2  293    10.2 810.803 -168.024     1360.07  -168.024    859.7     -168.024     
1 1 1 3  8  25 o 0 398.4   13.4  383.8  13.4 1449.92 -40.142      1890.17  -40.142     1001.72   -40.142      
1 1 1 3  12 25 o 0 294.7   10.1  281.1  10.1 1813.49 117.207      1271.02  117.207     188.796   117.207      
1 1 1 3  14 25 f 1 560.9   19.3  535.3  19.3 3200.7  -100.592     1687.47  -100.592    152.136   79.4085      
1 1 1 3  16 25 o 0 270.5   11    273.7  11   2059.36 150.616      1135.98  150.616     13.6375   -29.3842     
1 1 1 3  18 25 o 0 406     15.1  404.1  15.1 2079.28 46.7675      2068.04  46.7675     645.962   46.7675      
1 1 1 3  20 25 o 0 236.8   11.2  262.6  11.2 2925.46 -57.6523     758.251  -57.6523    1156.4    122.348      
1 1 1 1  25 4  o 0 430.3   13.6  428.4  13.6 3026.98 -57.4843     1391.36  -57.4843    527.344   122.516      
1 1 1 3  25 4  o 0 43.3    2.8   41.9   2.8  1097.3  -131.078     222.524  48.9216     906.19    48.9216      
1 1 1 4  5  25 o 0 183.9   6.7   178.8  6.7  621.154 11.2337      678.944  11.2337     297.38    11.2337      
1 1 1 4  7  25 o 0 395.1   13.7  409.2  13.7 2893.42 -76.6798     1302.1   -76.6798    465.459   103.32       
1 1 1 4  9  25 o 0 385     13    370    13   2054.64 -151.154     1596.56  -151.154    353.226   -151.154     
1 1 1 4  11 25 o 0 624.8   19.4  586.9  19.4 2835.95 112.246      2036.51  112.246     343.271   112.246      
1 1 1 4  13 25 o 0 241.7   9.7   236.3  9.7  1594.78 -74.8581     1182.27  -74.858     268.578   -74.858      
1 1 1 4  15 25 o 0 167.6   7.7   146.5  7.7  1633.21 108.177      685.021  108.177     230.806   -71.8231     
1 1 1 4  17 25 o 0 137.1   7.8   115.5  7.8  659.392 -31.735      620.906  -31.735     166.941   -31.735      
1 1 1 5  8  25 o 0 43.8    2.9   31.6   2.9  1022.87 120.972      234.34   -59.0282    852.432   -59.0282     
1 1 1 5  10 25 o 0 25.5    2.9   32.2   2.9  1706.69 -133.366     575.194  46.6339     1594.4    46.6339      
1 1 1 5  12 25 o 0 15.3    3.7   9.7    3.7  948.281 114.508      396.896  -65.4923    941.239   -65.4923     
1 1 1 5  16 25 o 0 409.4   15.3  376.6  15.3 2275.92 -58.2358     1532.7   -58.2358    281.548   -58.2358     
1 1 1 5  18 25 o 0 362.5   15.7  372.8  15.7 2619.79 30.3278      1558.71  30.3278     205.799   -149.672     
1 1 1 5  20 25 o 0 198.8   11.4  195.4  11.4 1760.09 78.0336      1018.07  78.0336     116.524   -101.966     
1 1 1 5  24 25 o 0 112.9   12.6  82.3   12.6 2371.04 -140.933     14.4769  39.067      1432.26   39.067       
1 1 1 1  25 6  o 0 146.4   5.8   154.7  5.8  1388.53 109.008      647.244  109.008     231.25    -70.9922     
1 1 1 3  25 6  o 0 293.7   9.8   276.5  9.8  920.935 158.61       1407.98  158.61      835.794   158.61       
1 1 1 5  25 6  o 0 198.4   7.6   199.5  7.6  2804.88 -168.636     366.348  -168.636    1349.94   11.3643      
1 1 1 6  7  25 o 0 54.7    3.5   46.3   3.5  477.221 112.826      38.4691  -67.174     326.454   -67.174      
1 1 1 6  9  25 o 0 43.8    3.5   45.7   3.5  1019.38 73.6716      173.801  -106.328    782.607   -106.328     
1 1 1 6  11 25 o 0 11.2    3     7.5    3    903.997 -70.2733     444.678  109.727     976.972   109.727      
1 1 1 6  13 25 o 0 240.7   10.3  228.2  10.3 1698.17 95.1659      1106.95  95.1659     148.01    95.1659      
1 1 1 6  15 25 o 0 285.9   11.9  267    11.9 1260.24 50.5969      1404.44  50.5969     708.209   50.5969      
1 1 1 6  17 25 o 0 134.8   8.6   143.7  8.6  1523.72 -14.8404     722.93   -14.8404    310.29    165.16       
1 1 1 6  19 25 o 0 88.3    8.2   84     8.2  921.197 151.973      327.348  151.973     279.011   -28.0275     
1 1 1 6  23 25 f 1 137.1   11.7  158.8  11.7 1921.73 7.4326       567.74   7.4326      602.354   -172.567     
1 1 1 6  25 7  o 0 68      4     73     4    2523.13 110.263      446.242  -69.7371    1974.14   -69.7371     
1 1 1 7  8  25 o 0 185     7.6   192.3  7.6  1820.1  40.6705      738.525  40.6705     348.62    -139.329     
1 1 1 7  10 25 o 0 95.5    5.1   98.7   5.1  736.15  -33.0933     231.502  -33.0933    202.597   146.907      
1 1 1 7  12 25 o 0 245.6   10.6  251.2  10.6 2535.93 -122.758     818.309  -122.758    617.886   57.2416      
1 1 1 7  14 25 f 1 240.8   10.8  256.5  10.8 2144.64 15.2803      976.008  15.2803     220.813   -164.72      
1 1 1 7  16 25 o 0 122.3   7.7   116.9  7.7  1763.24 -59.0911     467.252  -59.0911    735.62    120.909      
1 1 1 7  18 25 o 0 197.3   10.9  190.8  10.9 956.184 -165.11      1179.21  -165.11     544.947   -165.11      
1 1 1 7  20 25 o 0 7.7     8     -17.1  8    508.966 95.4257      295.867  -84.5743    618.874   -84.5743     
1 1 1 7  22 25 o 0 21      10.4  28.2   10.4 1797.78 -141.658     643.873  38.3422     1744.65   38.3422      
1 1 1 1  25 8  o 0 42.7    3.2   37.3   3.2  1643.16 -4.31928     435.516  175.681     1468.7    175.681      
1 1 1 5  25 8  o 0 155.6   6.4   152    6.4  2641.53 -116.157     164.938  -116.157    1438.96   63.8428      
1 1 1 7  25 8  o 0 71.3    4.4   72.9   4.4  2222.58 -18.7052     291.226  161.295     1621.74   161.295      
1 1 1 8  9  25 f 1 78.2    4.4   75.5   4.4  1089.51 -83.5831     87.7857  -83.5831    559.229   96.4169      
1 1 1 8  11 25 o 0 242.1   9.9   255.5  9.9  2662.56 -177.23      761.776  -177.23     750.21    2.77008      
1 1 1 8  13 25 o 0 152.6   8.9   157.8  8.9  787.469 147.769      720.996  147.769     282.242   147.769      
1 1 1 8  15 25 o 0 360     16.3  359.4  16.3 1739.61 -78.5989     1605.97  -78.5989    658.531   -78.5989     
1 1 1 8  17 25 o 0 76.2    7.8   60.4   7.8  1210.72 153.496      130.788  153.496     677.938   -26.5035     
1 1 1 2  25 9  o 0 467.4   15.7  471.5  15.7 3533.9  -72.0125     1235.96  -72.0125    954.005   107.988      
1 1 1 4  25 9  o 0 73.7    4     72.2   4    1490.69 -124.951     22.9975  55.0495     930.552   55.0495      
1 1 1 6  25 9  o 0 57.1    3.7   52.7   3.7  786.015 115.071      48.0731  -64.9286    519.234   -64.9286     
1 1 1 8  25 9  f 1 155.4   6.8   145.4  6.8  3120.46 -50.1756     111.175  129.824     1965.95   129.824      
1 1 1 9  10 25 o 0 256.6   10.3  274.3  10.3 2635    177.091      859.45   177.091     640.728   -2.90856     
1 1 1 9  12 25 f 1 475.4   17.4  434.5  17.4 2527.08 48.8277      1667.52  48.8277     246.191   48.8277      
1 1 1 9  16 25 o 0 55.9    6.9   116.2  6.9  2749.46 48.5847      283.047  -131.415    2131.38   -131.415     
1 1 1 9  18 25 o 0 106.2   9.9   88.3   9.9  1983.81 167.497      157.191  167.497     1122.57   -12.5025     
1 1 1 1  25 10 o 0 538.1   17.5  521.2  17.5 1599.96 130.59       2425.63  130.59      1430.26   130.59       
1 1 1 5  25 10 o 0 154.1   6.9   144.8  6.9  1719.41 77.191       524.514  77.191      507.414   -102.809     
1 1 1 7  25 10 o 0 436.1   16    412.5  16   2064.14 -79.2633     1742.49  -79.2633    522.317   -79.2633     
1 1 1 10 11 25 o 0 47.3    5.2   51.9   5.2  2100.98 89.0143      367.382  -90.9857    1546.59   -90.9857     
1 1 1 10 13 25 o 0 428.4   18.5  423.7  18.5 3398.19 45.8535      1111.98  45.8535     756.889   -134.146     
1 1 1 10 17 25 o 0 42      7.7   11.7   7.7  1351.69 83.1297      355.068  -96.8703    1244.17   -96.8703     
1 1 1 2  25 11 o 0 38.8    4.2   29.2   4.2  1313.65 178.608      371.354  -1.39188    1174.98   -1.39188     
1 1 1 4  25 11 o 0 234.8   9.6   243.8  9.6  2905.46 -137.471     530.024  -137.471    1215.53   42.5286      
1 1 1 6  25 11 o 0 410     15    385    15   2884.71 166.359      1245.8   166.359     459.297   -13.6413     
1 1 1 10 25 11 o 0 10.4    4.7   11.8   4.7  1340.24 -74.167      587.275  105.833     1338.02   105.833      
1 1 1 11 12 25 o 0 84.9    6.9   90.7   6.9  1658.17 95.6319      166.415  95.6319     749.49    -84.3681     
1 1 1 11 14 25 o 0 339.4   15.6  331    15.6 2268.92 -56.4268     1610.96  -56.4268    68.2727   -56.4268     
1 1 1 11 24 25 f 1 36.8    12.6  12.9   12.6 967.398 -160.047     293.019  19.9529     839.096   19.9529      
1 1 1 5  25 12 o 0 142.7   6.7   123.6  6.7  1483.5  49.3012      586.988  49.3012     268.922   -130.699     
1 1 1 7  25 12 o 0 246.7   10.2  241.6  10.2 2437.42 40.5851      846.331  40.5851     537.673   -139.415     
1 1 1 9  25 12 f 1 523.1   18.9  484.9  18.9 2440.49 99.6803      1880.61  99.6803     508.232   99.6803      
1 1 1 11 25 12 o 0 394.5   17.1  370.9  17.1 2410.55 126.405      1431.88  126.405     104.925   126.405      
1 1 1 12 13 25 f 1 389.5   18.2  400.3  18.2 2748.76 -93.5806     1626.55  -93.5806    262.379   86.4194      
1 1 1 12 15 25 o 0 141.2   9.5   137.8  9.5  1144.15 62.7221      791.58   62.7221     29.4312   62.7221      
1 1 1 12 17 25 o 0 99.6    8.7   100.3  8.7  608.827 -150.35      356.488  -150.35     32.6295   29.6504      
1 1 1 12 19 25 f 1 83.8    9     47.5   9    1153    -57.2135     126.68   -57.2135    590.563   122.786      
1 1 1 2  25 13 o 0 11.8    4     15.9   4    365.541 132.771      149.906  -47.2285    364.503   -47.2285     
1 1 1 4  25 13 o 0 272.9   11    286.6  11   2095.35 25.5593      1194.77  25.5593     13.1959   -154.441     
1 1 1 6  25 13 o 0 137.8   6.5   115.4  6.5  1880.83 -106.094     400.972  -106.094    665.264   73.9056      
1 1 1 8  25 13 o 0 87      5.6   70.1   5.6  1498.42 -51.2236     139.871  -51.2236    696.141   128.776      
1 1 1 12 25 13 f 1 94.8    7     89.3   7    1456.4  -68.0468     315.459  -68.0468    680.592   111.953      
1 1 1 13 14 25 f 1 30.4    6.9   20.7   6.9  1454.71 -2.73252     504.1    177.267     1483.96   177.267      
1 1 1 3  25 14 f 1 597.8   20.2  597    20.2 2525    -87.4885     2209.51  -87.4885    747.685   -87.4885     
1 1 1 7  25 14 f 1 293.6   11.6  276.4  11.6 402.528 120.624      997.374  120.624     772.136   120.624      
1 1 1 9  25 14 o 0 157.1   8.5   150.9  8.5  1636.36 -92.5235     645.666  -92.5235    250.17    87.4765      
1 1 1 13 25 14 f 1 216.9   11.1  197.9  11.1 1486.97 -19.8836     1211.17  -19.8836    215.612   -19.8836     
1 1 1 14 17 25 o 0 41.9    9.3   32.1   9.3  959.27  58.1747      168.852  -121.825    770.786   -121.825     
1 1 1 14 21 25 f 1 51.4    11.5  30.5   11.5 1035.06 78.6162      158.38   -101.384    760.076   -101.384     
1 1 1 2  25 15 o 0 98.5    6.1   98.9   6.1  1062.44 -115.652     385.434  -115.652    224.797   64.348       
1 1 1 8  25 15 o 0 322.6   12.6  299.3  12.6 1711.92 -176.315     1418.74  -176.315    484.971   -176.315     
1 1 1 12 25 15 o 0 100.1   8.4   118    8.4  1376.02 -153.701     496.232  -153.701    416.803   26.2995      
1 1 1 14 25 15 o 0 80.6    8.5   90.9   8.5  1820.36 -99.3895     111.221  -99.3895    1058.26   80.6105      
1 1 1 1  25 16 f 1 176.5   8.7   181.9  8.7  2802.94 118.596      310.898  118.596     1302.44   -61.4036     
1 1 1 3  25 16 o 0 134.7   7.3   143.1  7.3  2295.6  -108.039     303.401  -108.039    986.918   71.9606      
1 1 1 7  25 16 o 0 25.1    4.8   39.9   4.8  1035.43 -142.408     240.825  37.5917     949.081   37.5917      
1 1 1 9  25 16 o 0 240.8   11.8  248.2  11.8 1673.4  162.612      1388.3   162.612     262.899   162.612      
1 1 1 15 25 16 o 0 263.9   14.5  248.1  14.5 1317.35 -162.645     1476.37  -162.645    651.383   -162.645     
1 1 1 16 19 25 o 0 190.7   12.8  142.5  12.8 2065.5  19.9852      637.847  19.9852     586.426   -160.015     
1 1 1 2  25 17 o 0 285.2   11.2  264.2  11.2 2304.31 -30.9735     1043.45  -30.9735    245.526   149.026      
1 1 1 4  25 17 o 0 144.9   7.7   143.4  7.7  767.079 -167.801     804.369  -167.801    273.321   -167.801     
1 1 1 6  25 17 o 0 80.7    6.6   60.1   6.6  1618.22 -174.664     41.9914  -174.664    1059.28   5.33627      
1 1 1 8  25 17 o 0 2.4     5.6   20.6   5.6  773.143 150.781      365.818  -29.2187    883.074   -29.2187     
1 1 1 12 25 17 o 0 -4.7    6.6   7.8    6.6  1329.24 132.144      759.703  -47.8557    1606.7    -47.8557     
1 1 1 14 25 17 o 0 -3.6    7.2   -6.4   7.2  549.612 -28.7437     317.698  151.256     660.627   151.256      
1 1 1 16 25 17 o 0 97      10.8  85.4   10.8 1246.17 167.048      317.512  167.048     441.508   -12.9515     
1 1 1 3  25 18 o 0 162.9   8.4   151.4  8.4  802.452 27.5732      912.114  27.5732     359.933   27.5732      
1 1 1 5  25 18 o 0 136.6   8     148.6  8    1987.05 -126.646     554.188  -126.646    789.947   53.3541      
1 1 1 7  25 18 o 0 136.9   8.1   138.2  8.1  606.88  7.69727      642.579  7.69727     239.011   7.69727      
1 1 1 11 25 18 o 0 21.5    6.9   30.4   6.9  1149.9  164.389      357.621  -15.6107    1086.26   -15.6107     
1 1 1 15 25 18 o 0 35      9.7   34     9.7  682.261 23.8071      126.844  -156.193    540.88    -156.193     
1 1 1 2  25 19 o 0 36.3    6.4   34.3   6.4  1098.31 46.7303      242.006  -133.27     992.138   -133.27      
1 1 1 4  25 19 o 0 39.2    6.3   23.2   6.3  1264.78 -153.293     328.456  26.7073     1177.88   26.7073      
1 1 1 6  25 19 o 0 89.5    8.2   94     8.2  1006.03 56.8608      380.199  56.8608     284.099   -123.139     
1 1 1 10 25 19 o 0 188.4   9.9   187.8  9.9  1601.41 65.3105      995.179  65.3105     12.9279   -114.689     
1 1 1 14 25 19 o 0 124.6   10.9  110.1  10.9 2067.71 -148.275     277.459  -148.275    971.156   31.7248      
1 1 1 1  25 20 o 0 55.8    8.1   63.3   8.1  1539.98 -162.251     70.9805  17.7494     1113.12   17.7494      
1 1 1 3  25 20 o 0 169.2   8.8   159.4  8.8  1869.19 -86.8965     765.227  -86.8965    464.185   93.1035      
1 1 1 5  25 20 o 0 149.5   9.9   165.9  9.9  2136.61 24.9945      582.198  24.9945     800.003   -155.005     
1 1 1 9  25 20 f 1 122.4   8.6   129.1  8.6  1928.67 115.235      410.38   115.235     801.38    -64.7654     
1 1 1 11 25 20 o 0 129.6   9.4   117.8  9.4  740.699 116.584      551.028  116.584     97.0297   116.584      
1 1 1 15 25 20 o 0 24.3    11.1  6      11.1 732.379 123.378      298.308  -56.6222    723.17    -56.6222     
1 1 1 2  25 21 f 1 140     9.3   179.4  9.3  1182.94 170.047      934.796  170.047     160.333   170.047      
1 1 1 10 25 21 f 1 126     9.6   128.1  9.6  988.241 -16.3527     622.163  -16.3527    17.9591   -16.3527     
1 1 1 12 25 21 o 0 223.8   12.5  202.9  12.5 916.561 15.1348      1161.77  15.1348     615.743   15.1348      
1 1 1 1  25 22 o 0 346.2   14.8  309.6  14.8 2593.79 112.278      1345.52  112.278     322.62    -67.7221     
1 1 1 3  25 22 o 0 109.8   9.5   125.2  9.5  1645.62 -37.8642     464.832  -37.8642    577.785   142.136      
1 1 1 5  25 22 o 0 279.4   13.8  282.1  13.8 1734.14 38.7766      1475.24  38.7766     393.831   38.7766      
1 1 1 9  25 22 o 0 13.9    7.4   6.1    7.4  904.528 51.4042      428.309  -128.596    973.116   -128.596     
1 1 1 2  25 23 o 0 268.9   14.3  275.7  14.3 1614.98 -94.2227     1479.29  -94.2227    469.403   -94.2227     
1 1 1 4  25 23 o 0 196.1   12.1  186.8  12.1 1051.41 -101.567     1085.59  -101.567    437.831   -101.567     
1 1 1 6  25 23 f 1 172.6   12.2  134.1  12.2 1733.85 -17.0886     689.337  -17.0886    367.836   162.911      
1 1 1 8  25 23 o 0 10.7    10.3  -13.5  10.3 762.235 53.1874      393.438  -126.813    847.686   -126.813     
1 1 1 3  25 24 o 0 193.7   13.1  202.1  13.1 2706.04 160.619      521.511  160.619     1122.53   -19.3811     
1 1 1 9  25 24 o 0 19.4    11.1  31.1   11.1 1075.44 -130.883     344.163  49.1174     959.85    49.1174      
1 1 1 2  25 25 o 0 50.7    11.9  15     11.9 2953.46 -4.03294     967.142  175.967     2715.16   175.967      
1 1 1 12 25 25 o 0 40.7    11.3  -21.5  11.3 505.65  75.9016      184.532  -104.098    459.184   -104.098     
1 1 1 1  26 1  o 0 678.4   21    652.5  21   3769.66 85.3029      1778.79  85.3029     541.127   -94.6971     
1 1 1 1  5  26 o 0 17.3    2.7   18.4   2.7  1052.94 -108.943     450.945  71.0566     1094.94   71.0566      
1 1 1 1  7  26 o 0 668.4   22.3  644    22.3 2930.23 78.4446      2190.27  78.4446     405.85    78.4446      
1 1 1 1  9  26 o 0 626.4   20.9  616.6  20.9 2813.78 30.1682      2120.28  30.1682     421.502   30.1682      
1 1 1 1  11 26 f 1 404.3   13.4  392.9  13.4 2636.32 -57.2576     1460.01  -57.2576    82.8097   122.742      
1 1 1 1  13 26 o 0 25.5    3.2   27.8   3.2  387.958 29.3791      95.1704  -150.621    317.067   -150.621     
1 1 1 1  15 26 o 0 222.1   9.3   213.8  9.3  892.418 130.115      1115.85  130.115     616.322   130.115      
1 1 1 1  17 26 o 0 287.9   11.7  304    11.7 1755.64 -144.52      1683.62  -144.52     477.489   -144.52      
1 1 1 1  21 26 f 1 213.4   13.2  254.6  13.2 1939.47 74.8698      1158.04  74.8698     83.184    -105.13      
1 1 1 1  23 26 o 0 39.3    11.7  61.2   11.7 1779.39 -76.0458     244.46   103.954     1334.27   103.954      
1 1 1 2  26 2  o 0 280.7   9.3   272.3  9.3  2639.76 39.0845      870.199  39.0845     745.23    -140.916     
1 1 1 2  4  26 o 0 465.3   16.1  479.7  16.1 3097.62 123.028      1461.58  123.028     420.093   -56.972      
1 1 1 2  8  26 o 0 671.9   22    643    22   3613.02 -44.6115     1800.36  -44.6115    374.217   135.388      
1 1 1 2  10 26 o 0 548.1   18.2  517.2  18.2 2803.43 -155.824     1800.79  -155.824    131.706   -155.824     
1 1 1 2  12 26 o 0 288.8   9.7   260.3  9.7  2606.76 -135.639     924.033  -135.639    568.768   44.3613      
1 1 1 2  14 26 o 0 220     9.3   228.2  9.3  1733.56 177.319      1034.61  177.319     60.7988   177.319      
1 1 1 2  16 26 o 0 23.1    4.6   28.1   4.6  1512.16 77.7115      547.642  -102.288    1592.68   -102.288     
1 1 1 2  18 26 o 0 122     7.5   123.8  7.5  907.186 -123.528     653.923  -123.528    44.0632   -123.528     
1 1 1 2  20 26 o 0 64.2    7.2   55.7   7.2  842.794 4.24206      74.6462  4.24206     467.506   -175.758     
1 1 1 1  26 3  o 0 149.9   5.5   136.4  5.5  850.727 -109.204     568.602  -109.204    42.7586   -109.204     
1 1 1 3  5  26 o 0 229     8.5   243.7  8.5  1879.23 166.863      996.36   166.863     136.371   -13.1371     
1 1 1 3  7  26 o 0 260.1   9.5   260.5  9.5  1863.49 159.71       1121.33  159.71      3.64336   159.71       
1 1 1 3  9  26 o 0 61.9    3.8   66.2   3.8  2221.89 -112.752     369.255  67.2479     1689.98   67.2479      
1 1 1 3  11 26 o 0 36.9    3.2   24.7   3.2  2242.87 -71.8939     666.428  108.106     1951.35   108.106      
1 1 1 3  13 26 o 0 63.3    3.8   60.7   3.8  134.543 45.6494      25.7375  45.6494     50.0296   -134.351     
1 1 1 3  15 26 o 0 122.2   6.9   130.5  6.9  2270.26 80.8715      224.72   80.8715     1026.85   -99.1285     
1 1 1 3  17 26 o 0 145.6   7.5   130.9  7.5  381.661 -68.2818     472.264  -68.2818    213.905   -68.2818     
1 1 1 3  19 26 o 0 101.7   7.2   100.7  7.2  1110.59 -115.437     446.434  -115.437    274.606   64.5632      
1 1 1 2  26 4  o 0 294.2   9.9   292.7  9.9  2352.75 -3.15207     1097.47  -3.15207    344.993   176.848      
1 1 1 4  26 4  o 0 483.3   15.5  462.4  15.5 2471.65 -119.504     1776.29  -119.504    284.644   -119.504     
1 1 1 4  6  26 o 0 496.4   16.9  490.7  16.9 3103.71 30.8147      1511.21  30.8147     343.574   -149.185     
1 1 1 4  8  26 o 0 422.8   14.3  410.2  14.3 2056.2  -61.764      1721.47  -61.764     501.64    -61.764      
1 1 1 4  10 26 o 0 20.5    3.2   18.5   3.2  639.362 168.363      214.952  -11.6374    581.169   -11.6374     
1 1 1 4  12 26 o 0 88.6    4.6   77     4.6  1833.66 -113.273     68.8956  -113.273    965.493   66.7266      
1 1 1 4  14 26 o 0 315.6   13.1  324.9  13.1 1888.34 -1.04381     1411.13  -1.04381    366.241   -1.04381     
1 1 1 4  16 26 o 0 447     16.5  411.3  16.5 1517.68 134.324      2434.54  134.324     1401.22   134.324      
1 1 1 4  18 26 f 1 30.4    6.6   27.8   6.6  802.285 112.455      216.852  -67.5452    751.353   -67.5452     
1 1 1 4  20 26 o 0 108.7   10.2  129.9  10.2 1539.13 143.548      517.153  143.548     458.904   -36.4524     
1 1 1 1  26 5  o 0 145.7   5.8   142.7  5.8  1180.89 -72.4951     609.024  -72.4951    121.104   107.505      
1 1 1 3  26 5  o 0 378.6   12.8  385.4  12.8 1248.98 -123.885     1867.48  -123.885    1108.58   -123.885     
1 1 1 5  26 5  o 0 93.7    4.2   88.2   4.2  975.639 147.262      208.494  147.262     375.41    -32.7378     
1 1 1 5  7  26 o 0 282.8   10.2  276.3  10.2 2430.7  -100.515     956.979  -100.515    481.933   79.4849      
1 1 1 5  9  26 o 0 555.5   17.8  544.2  17.8 4098    -105.148     1144.51  -105.148    1258.05   74.8522      
1 1 1 5  11 26 f 1 361     12.4  366    12.4 3878.01 137.689      634.884  137.689     1567.65   -42.311      
1 1 1 5  13 26 o 0 123.6   7     132.9  7    637.307 -9.26457     499.377  -9.26457    145.686   -9.26457     
1 1 1 5  15 26 o 0 430.6   17.1  426.5  17.1 3063.31 -41.1223     1273.66  -41.1223    390.35    138.878      
1 1 1 5  17 26 o 0 113     8.3   114.6  8.3  998.23  -158.188     580.922  -158.188    84.8876   21.8118      
1 1 1 5  19 26 o 0 19.3    8.2   12.9   8.2  316.783 85.8261      136.168  -94.1739    338.833   -94.1739     
1 1 1 5  25 26 o 0 7.1     11.9  4.9    11.9 1060.53 -161.027     485.966  18.9729     1086.35   18.9729      
1 1 1 2  26 6  o 0 504.9   15.7  500.9  15.7 1523.88 -54.7434     2310.53  -54.7434    1378.28   -54.7434     
1 1 1 4  26 6  o 0 259.6   9     249.4  9    1151.43 142.734      1250.16  142.734     557.385   142.734      
1 1 1 6  8  26 o 0 92.3    4.4   86.5   4.4  2348.1  112.316      180.674  -67.6842    1556.3    -67.6842     
1 1 1 6  10 26 o 0 26.4    3.6   27.5   3.6  1286.56 121.492      352.047  -58.5082    1079.22   -58.5082     
1 1 1 6  12 26 o 0 210     8.3   207.3  8.3  2209.62 33.575       750.279  33.575      478.956   -146.425     
1 1 1 6  14 26 o 0 452     17.5  453.3  17.5 2630.27 -171         1574.38  -171        139.731   -171         
1 1 1 6  18 26 o 0 308.2   13.9  300.1  13.9 900.759 -136.588     1776.11  -136.588    1195.38   -136.588     
1 1 1 6  20 26 o 0 244.9   13.6  236    13.6 1312.87 94.9925      1384.72  94.9925     564.536   94.9925      
1 1 1 6  22 26 o 0 206.9   14.1  215.5  14.1 1827.99 60.0238      1010.15  60.0238     92.0745   -119.976     
1 1 1 3  26 7  o 0 57.2    3.9   45.5   3.9  1499.73 -65.7253     237.629  114.275     1144.7    114.275      
1 1 1 5  26 7  o 0 34.1    3.5   25.2   3.5  1201.4  15.2413      369.176  -164.759    1084.27   -164.759     
1 1 1 7  9  26 o 0 252     9.7   262.7  9.7  1161.87 1.83287      1355.49  1.83287     698.423   1.83287      
1 1 1 7  13 26 o 0 194     9     185.3  9    1568.88 -49.3278     877.276  -49.3278    18.5216   -49.3278     
1 1 1 7  15 26 o 0 125.8   8.4   142.2  8.4  1580.27 71.7111      658.619  71.7111     407.074   -108.289     
1 1 1 7  17 26 o 0 242     11.5  210.4  11.5 373.522 -152.155     856.177  -152.155    610.72    -152.155     
1 1 1 7  21 26 o 0 67.9    10.6  44.8   10.6 1997.84 126.384      257.64   -53.6164    1474.8    -53.6164     
1 1 1 2  26 8  o 0 44.9    3.6   38.7   3.6  427.182 5.31547      72.2091  -174.685    331.89    -174.685     
1 1 1 4  26 8  o 0 156.7   6.8   131    6.8  1307.78 17.5185      581.821  17.5185     199.534   -162.482     
1 1 1 8  26 8  o 0 78.2    4.8   75.6   4.8  2087.17 -151.743     85.9519  28.2571     1267.56   28.2571      
1 1 1 8  10 26 o 0 65.8    4.8   75.8   4.8  1571.63 91.879       44.8424  91.879      832.73    -88.121      
1 1 1 8  12 26 o 0 71.6    5.3   67.7   5.3  960.841 88.6613      143.564  88.6613     384       -91.3387     
1 1 1 8  14 26 o 0 60.7    6.4   57.6   6.4  899.714 26.9926      74.5727  26.9926     534.932   -153.007     
1 1 1 8  16 26 o 0 -0.5    6.9   -3.8   6.9  550.444 -79.6205     332.814  100.38      696.731   100.38       
1 1 1 8  18 26 o 0 207.4   12.8  180    12.8 1111.73 75.6625      1139.37  75.6625     433.516   75.6625      
1 1 1 8  20 26 o 0 145.7   12.1  129.2  12.1 1771.63 15.0748      561.281  15.0748     528.118   -164.925     
1 1 1 1  26 9  o 0 192.1   7.3   185.8  7.3  1839.13 -80.7227     750.036  -80.7227    373.209   99.2773      
1 1 1 3  26 9  o 0 9.5     3     5.8    3    613.235 41.1264      317.339  -138.874    685.025   -138.874     
1 1 1 5  26 9  o 0 476.5   15.7  457.8  15.7 2014.03 123.165      1921.48  123.165     733.882   123.165      
1 1 1 7  26 9  o 0 293.9   10.8  288.4  10.8 2366.08 137.332      1104.71  137.332     236.885   -42.6683     
1 1 1 9  26 9  f 1 213.7   9.4   220.6  9.4  1783.12 109.17       970.371  109.17      31.4455   -70.8304     
1 1 1 9  11 26 o 0 27.7    4.6   22.9   4.6  731.169 -39.3207     189.587  140.679     592.148   140.679      
1 1 1 9  13 26 o 0 150.7   9.4   149.7  9.4  225.383 -52.7329     265.062  -52.7329    143.342   -52.7329     
1 1 1 9  19 26 o 0 120.9   12    118.4  12   1235.51 -9.74506     567.029  -9.74506    199.073   170.255      
1 1 1 2  26 10 o 0 205.7   8.1   199.6  8.1  1857.37 118.697      813.115  118.697     304.043   -61.3033     
1 1 1 4  26 10 o 0 130.7   5.9   123.2  5.9  1839.28 -120.941     422.162  -120.941    639.105   59.059       
1 1 1 10 26 10 o 0 290.4   11.1  272.9  11.1 1138.27 118.191      1436.86  118.191     810.296   118.191      
1 1 1 10 12 26 o 0 374.9   16.8  364.3  16.8 2217.21 131.474      1444.49  131.474     242.725   131.474      
1 1 1 10 14 26 o 0 180.5   10.7  171    10.7 1302.23 94.1045      1048.43  94.1045     178.574   94.1045      
1 1 1 10 16 26 f 1 330.1   16.5  329.6  16.5 1908.25 -51.7586     1694.65  -51.7586    460.264   -51.7586     
1 1 1 3  26 11 o 0 426.1   15.5  406.8  15.5 3328.73 151.769      1170.2   151.769     753.709   -28.2307     
1 1 1 5  26 11 f 1 85.5    5.2   70.6   5.2  1736.02 142.007      59.7191  142.007     932.16    -37.9929     
1 1 1 7  26 11 f 1 25      4     21.9   4    1388.07 -20.0183     430.404  159.982     1210.81   159.982      
1 1 1 9  26 11 o 0 449.7   18.1  481.7  18.1 3088.7  74.0733      1412.35  74.0733     287.454   -105.927     
1 1 1 11 13 26 o 0 133.1   8.8   144.8  8.8  1589.18 46.8016      690.617  46.8016     375.528   -133.198     
1 1 1 11 15 26 o 0 114     8.7   117.9  8.7  1671.95 52.8457      451.999  52.8457     642.803   -127.154     
1 1 1 4  26 12 o 0 274     12.4  257.2  12.4 2023.25 42.8085      1141.06  42.8085     8.80315   -137.191     
1 1 1 6  26 12 o 0 543.5   19.7  537.5  19.7 3092.25 72.7687      1687.84  72.7687     40.2864   -107.231     
1 1 1 8  26 12 o 0 147.8   7.8   152.5  7.8  863.948 126.711      702.767  126.711     227.703   126.711      
1 1 1 12 26 12 o 0 80.1    7.8   103.4  7.8  918.56  -81.5343     394.261  -81.5343    220.699   98.4657      
1 1 1 12 14 26 o 0 3.7     6.7   21.6   6.7  261.423 48.6756      117.636  -131.324    289.663   -131.324     
1 1 1 12 18 26 o 0 55      8.9   28.6   8.9  427.501 78.257       19.1618  -101.743    281.599   -101.743     
1 1 1 1  26 13 o 0 511.4   18.5  547.3  18.5 3741.71 63.0897      1365.31  63.0897     799.816   -116.91      
1 1 1 7  26 13 o 0 167.5   7.7   145.3  7.7  1924.56 -24.341      564.382  -24.341     492.394   155.659      
1 1 1 9  26 13 o 0 164.9   8.2   157.7  8.2  1089.3  5.14278      781.562  5.14278     193.259   5.14278      
1 1 1 11 26 13 o 0 33.3    6.2   45.8   6.2  801.2   120.827      102.778  -59.1731    638.421   -59.1731     
1 1 1 13 26 13 o 0 1.8     6.7   10.9   6.7  1775.47 97.3353      987.816  -82.6647    2152.51   -82.6647     
1 1 1 13 17 26 o 0 13.6    9.7   3.7    9.7  1485.83 -78.5818     728.543  101.418     1646.6    101.418      
1 1 1 2  26 14 o 0 146.6   7.4   137.3  7.4  719.977 -90.8704     628.849  -90.8704    220.321   -90.8704     
1 1 1 4  26 14 o 0 167.2   7.9   170.5  7.9  1410.23 -90.0601     812.576  -90.0601    26.4733   -90.0601     
1 1 1 8  26 14 o 0 423.7   16.2  407.1  16.2 2363.4  -64.3352     1945.27  -64.3352    341.382   -64.3352     
1 1 1 12 26 14 o 0 218.6   11.6  207.2  11.6 1868.29 105.935      1076.1   105.935     147.329   -74.0647     
1 1 1 14 16 26 o 0 246.7   13.9  199.6  13.9 2072.47 1.913        1014.91  1.913       272.907   -178.087     
1 1 1 1  26 15 o 0 347.3   14    385.9  14   2607.61 98.5746      1315.95  98.5746     160.077   -81.4254     
1 1 1 7  26 15 o 0 321.5   12.4  287.3  12.4 1530.97 159.057      1799.86  159.057     764.035   159.057      
1 1 1 13 26 15 o 0 303     14.9  284.9  14.9 2388.06 -3.51195     1257.93  -3.51195    252.155   176.488      
1 1 1 15 17 26 o 0 87.8    11.8  84.7   11.8 1902.37 -100.191     74.1813  -100.191    1077.62   79.809       
1 1 1 15 19 26 o 0 105.9   12.5  76.7   12.5 775.766 -160.764     256.185  -160.764    193.064   19.2355      
1 1 1 2  26 16 o 0 12.6    5.6   4.7    5.6  438.075 -117.197     247.129  62.8033     552.777   62.8033      
1 1 1 6  26 16 o 0 76.7    6.1   84.3   6.1  1561.05 105.996      162.636  105.996     889.473   -74.0042     
1 1 1 1  26 17 o 0 346.7   13.7  347.5  13.7 1762.43 118.139      1972.07  118.139     748.693   118.139      
1 1 1 3  26 17 o 0 422.5   16.1  430.7  16.1 1820.01 -4.80367     2294.04  -4.80367    1052.19   -4.80367     
1 1 1 5  26 17 o 0 173.5   8.9   169.2  8.9  1487.76 137.834      972.259  137.834     25.6357   -42.1663     
1 1 1 7  26 17 o 0 147.8   8     149    8    1109.35 -109.555     855.57   -109.555    124.212   -109.555     
1 1 1 9  26 17 o 0 322.2   14.9  302.8  14.9 1710.63 -151.654     1690.12  -151.654    595.747   -151.654     
1 1 1 17 26 17 o 0 -0.9    12    11     12   1080.22 -82.3237     510.494  97.6763     1135.57   97.6763      
1 1 1 2  26 18 o 0 101.9   8.2   105.9  8.2  641.135 29.9702      433.095  29.9702     1.63484   -150.03      
1 1 1 4  26 18 f 1 226.1   10.5  206.9  10.5 563.53  -8.46493     1098.76  -8.46493    720.906   -8.46493     
1 1 1 6  26 18 o 0 27.2    7     10.4   7    964.377 -153.408     362.633  26.5918     987.021   26.5918      
1 1 1 14 26 18 o 0 247.7   14.1  208.2  14.1 1041.61 178.314      1278.42  178.314     654.98    178.314      
1 1 1 1  26 19 o 0 79.2    7.6   59.7   7.6  768.583 -143.084     171.589  -143.084    339.121   36.9162      
1 1 1 3  26 19 o 0 43.7    7.6   42.5   7.6  743.749 151.791      71.8743  -28.2086    558.122   -28.2086     
1 1 1 7  26 19 o 0 240     13.2  250.9  13.2 2003.84 -109.034     1184.29  -109.034    82.0819   70.9655      
1 1 1 9  26 19 o 0 131.2   9.4   137.8  9.4  1632.76 22.2018      593.049  22.2018     420.305   -157.798     
1 1 1 13 26 19 o 0 89      10.7  79.3   10.7 1168.48 -100.381     258.005  -100.381    438.069   79.6187      
1 1 1 15 26 19 o 0 92      12.6  96.7   12.6 366.202 -142.336     155.364  -142.336    55.4009   37.6643      
1 1 1 2  26 20 o 0 43      7.6   48     7.6  1219.45 -52.1394     147.36   127.861     937.491   127.861      
1 1 1 4  26 20 o 0 129.7   9.6   140.5  9.6  1113.65 95.9593      720.802  95.9593     10.7194   95.9593      
1 1 1 6  26 20 o 0 198     11.5  183.2  11.5 1741.66 21.9474      957.248  21.9474     134.813   -158.053     
1 1 1 8  26 20 o 0 -1.5    7.5   12.7   7.5  878.511 -151.731     455.468  28.2691     996.691   28.2691      
1 1 1 12 26 20 o 0 34.3    9.3   59.5   9.3  2086.51 -122.643     387.36   57.3565     1622.91   57.3565      
1 1 1 1  26 21 f 1 88.7    9.6   85.7   9.6  2772.43 96.4877      350.247  -83.5123    2137.25   -83.5123     
1 1 1 3  26 21 o 0 321.2   14.8  334    14.8 3037.54 -120.194     1071.21  -120.194    846.438   59.8056      
1 1 1 5  26 21 f 1 119.1   10.6  146.5  10.6 1302.02 -51.7011     671.417  -51.7011    142.046   128.299      
1 1 1 7  26 21 o 0 145.2   12.2  128.9  12.2 2007.33 -11.0236     458.977  -11.0236    767.035   168.976      
1 1 1 9  26 21 f 1 206     11.8  216.8  11.8 1212.85 28.3036      1176.38  28.3036     444.905   28.3036      
1 1 1 11 26 21 o 0 104.4   10.2  104.7  10.2 1336.26 -60.6013     402.929  -60.6013    382.659   119.399      
1 1 1 2  26 22 o 0 200.9   12.3  193.4  12.3 1853.35 -73.8318     948.191  -73.8318    208.177   106.168      
1 1 1 4  26 22 o 0 9.2     9.7   18.3   9.7  1402.32 174.505      625.752  -5.49495    1487.58   -5.49495     
1 1 1 6  26 22 o 0 44.8    9.2   34.8   9.2  1355.83 -128.433     239.619  51.567      1059.44   51.567       
1 1 1 5  26 23 o 0 146.4   12.7  190.8  12.7 603.853 -117.752     753.787  -117.752    392.877   -117.752     
1 1 1 2  26 24 o 0 122.7   12.8  127.3  12.8 1074.29 155.867      526.285  155.867     109.719   -24.1328     
1 1 1 6  26 24 o 0 58.8    11.9  77.2   11.9 1750.6  120.251      80.0592  -59.749     1086.19   -59.749      
1 1 1 1  6  27 o 0 548.5   19.2  546.8  19.2 3543.16 135.736      1455.92  135.736     648.32    -44.2642     
1 1 1 1  8  27 o 0 579.8   19.2  548.5  19.2 2824.28 5.97079      1960.49  5.97079     333.019   5.97079      
1 1 1 1  10 27 o 0 19.1    3.3   15.3   3.3  1262.77 49.8619      470.192  -130.138    1190.16   -130.138     
1 1 1 1  12 27 o 0 59      4     42.7   4    896.321 -172.035     0.091336 7.96469     503.555   7.96469      
1 1 1 1  14 27 o 0 384.8   13.3  380.6  13.3 1570.98 -66.5163     1775.88  -66.5163    910.255   -66.5163     
1 1 1 1  16 27 o 0 146.5   8     152.1  8    1391.05 53.3928      843.067  53.3928     99.8967   -126.607     
1 1 1 1  18 27 f 1 181.7   9.3   175.3  9.3  985.763 -129.753     1052.25  -129.753    406.594   -129.753     
1 1 1 1  20 27 o 0 78.4    7.8   93.7   7.8  428.36  101.866      203.257  101.866     66.9831   -78.1342     
1 1 1 1  22 27 f 1 170.4   13.4  160    13.4 2874.42 -162.695     217.139  -162.695    1541.99   17.3051      
1 1 1 2  5  27 o 0 59.7    3.7   48.5   3.7  2085.53 75.2248      412.574  -104.775    1644.51   -104.775     
1 1 1 2  7  27 o 0 96.4    4.8   93.4   4.8  1490.26 -44.4194     169.326  -44.4193    707.046   135.581      
1 1 1 2  11 27 o 0 115.7   5.5   102.5  5.5  529.152 -99.6695     348.422  -99.6695    51.0101   -99.6695     
1 1 1 2  13 27 o 0 183.6   7.5   183.9  7.5  1285.87 117.557      918.148  117.557     207.589   117.557      
1 1 1 2  15 27 o 0 97.5    6.3   89.9   6.3  2023.52 111.4        104.748  111.4       1274.07   -68.5997     
1 1 1 2  17 27 f 1 39.1    5.4   30.4   5.4  1241.49 -19.3965     286.004  160.603     1115.44   160.603      
1 1 1 2  19 27 f 1 5.6     6.1   14.2   6.1  84.173  -69.9436     42.4198  110.056     96.3547   110.056      
1 1 1 3  6  27 o 0 328.6   11.7  316.1  11.7 1984.3  -34.4228     1339.48  -34.4228    177.187   -34.4228     
1 1 1 3  10 27 o 0 186.6   7.7   195.9  7.7  2584.34 176.761      488.826  176.761     963.392   -3.23892     
1 1 1 3  12 27 f 1 53.7    4     48.1   4    903.316 68.4455      8.62257  -111.555    511.52    -111.555     
1 1 1 3  14 27 o 0 460.7   16.7  439.4  16.7 2434.38 49.6267      2078.15  49.6267     412.816   49.6267      
1 1 1 3  18 27 f 1 10      5.6   21.6   5.6  1649.46 -123.354     723.949  56.6464     1789.77   56.6464      
1 1 1 3  20 27 o 0 276     13    275.3  13   1663.51 -82.4591     1473.66  -82.4591    437.768   -82.4591     
1 1 1 1  27 4  o 0 271.6   9.4   269    9.4  2571.62 133.109      860.311  133.109     690.249   -46.8906     
1 1 1 3  27 4  f 1 170.9   6.5   163.6  6.5  1799.38 136.115      605.166  136.115     467.776   -43.8853     
1 1 1 4  5  27 o 0 488.2   16.3  503.6  16.3 2826.17 -170.083     1625.04  -170.083    23.4429   9.91674      
1 1 1 4  7  27 f 1 431.3   14.8  422.2  14.8 2738.59 -176.366     1478.8   -176.366    81.6695   3.63395      
1 1 1 4  9  27 o 0 261     9.8   256.8  9.8  1573.28 -132.557     1264.81  -132.557    381.471   -132.557     
1 1 1 4  11 27 f 1 210.4   7.9   176    7.9  2599.26 49.6839      484.667  49.6839     963.873   -130.316     
1 1 1 4  13 27 o 0 17.3    3.7   17.2   3.7  2067.44 156.459      779.429  -23.5413    1905.7    -23.5413     
1 1 1 4  15 27 o 0 53.8    6.6   61.5   6.6  1293.18 -120.958     14.6597  59.0417     883.391   59.0417      
1 1 1 4  17 27 o 0 92.4    7.6   98.5   7.6  462.513 63.337       272.583  63.337      26.7054   -116.663     
1 1 1 4  19 27 o 0 196.2   11.6  196    11.6 810.829 -147.209     1077.16  -147.209    567.578   -147.209     
1 1 1 5  6  27 o 0 110.9   5     108.7  5    1165.33 82.3605      458.442  82.3605     199.982   -97.6395     
1 1 1 5  8  27 o 0 256.3   10    276    10   430.273 87.7441      974.918  87.7441     733.639   87.7441      
1 1 1 5  10 27 o 0 142.5   6.2   146    6.2  2041.56 -103.872     442.494  -103.872    689.328   76.1285      
1 1 1 5  12 27 o 0 459.6   15.3  452.1  15.3 2828.43 57.9691      1493.45  57.9691     50.7557   -122.031     
1 1 1 5  14 27 f 1 317.6   13    290.3  13   1250.34 -20.4753     1869.67  -20.4753    1021.56   -20.4753     
1 1 1 5  18 27 o 0 103.4   9.1   91.1   9.1  959     160.886      404.119  160.886     203.389   -19.1136     
1 1 1 5  22 27 o 0 116.2   13.3  107.4  13.3 1039    11.5268      492.231  11.5268     123.671   -168.473     
1 1 1 1  27 6  o 0 7.4     3     5.8    3    1615.2  -161.69      867.556  18.3098     1839.74   18.3098      
1 1 1 5  27 6  o 0 181.9   7.2   186.8  7.2  2003.89 136.159      719.305  136.159     419.889   -43.8415     
1 1 1 6  7  27 o 0 114     6.4   118.6  6.4  1161.38 165.257      502.745  165.257     147.509   -14.7427     
1 1 1 6  9  27 o 0 40.5    4.1   38.4   4.1  1116.66 -91.665      156.758  88.335      775.813   88.335       
1 1 1 6  11 27 o 0 406.7   14.3  405.8  14.3 2832.08 16.3032      1313.54  16.3032     235.108   -163.697     
1 1 1 6  15 27 o 0 -3.7    5.7   1.2    5.7  473.893 175.01       290.665  -4.98971    604.536   -4.98971     
1 1 1 6  21 27 f 1 61.9    11.9  45.4   11.9 505.519 -5.73554     31.7961  -5.73554    272.788   174.264      
1 1 1 2  27 7  o 0 180.6   7.7   180.6  7.7  1804.19 127.797      692.014  127.797     381.501   -52.203      
1 1 1 4  27 7  f 1 45.9    3.9   54.9   3.9  657.356 -16.4262     11.2906  -16.4262    366.355   163.574      
1 1 1 6  27 7  o 0 214.7   8.5   213.5  8.5  1862.24 -4.12691     934.202  -4.12691    113.143   175.873      
1 1 1 7  8  27 o 0 269.5   10.5  288.9  10.5 2142.76 -15.1528     1126.13  -15.1528    61.3776   164.847      
1 1 1 7  10 27 o 0 39.5    4.2   28.6   4.2  1470.29 -120.612     307.242  59.3876     1112.14   59.3876      
1 1 1 7  12 27 o 0 501.1   18.1  535.8  18.1 2138.74 -8.72617     1999.13  -8.72617    846.948   -8.72617     
1 1 1 7  18 27 o 0 34.6    8     7.9    8    425.485 54.2984      125.263  -125.702    390.835   -125.702     
1 1 1 7  20 27 o 0 190     13.4  177.2  13.4 1877.18 67.9647      825.157  67.9647     310.199   -112.035     
1 1 1 1  27 8  o 0 223     8.2   211.6  8.2  1971.14 13.2845      943.424  13.2845     208.092   -166.716     
1 1 1 3  27 8  o 0 163.5   7     169.4  7    1465.03 -7.34973     808.277  -7.34973    32.4298   172.65       
1 1 1 5  27 8  o 0 479.4   16.5  453.9  16.5 1910.32 -6.68162     2010.9   -6.68162    932.611   -6.68162     
1 1 1 7  27 8  o 0 224.9   8.7   215.9  8.7  2747.14 -84.3415     561.77   -84.3415    964.897   95.6585      
1 1 1 8  11 27 o 0 114.3   6.7   118.9  6.7  1376.65 80.7392      455.709  80.7392     287.515   -99.2608     
1 1 1 8  13 27 f 1 51.8    6.7   48.5   6.7  1338.98 -68.9787     123.355  111.021     1022.25   111.021      
1 1 1 2  27 9  o 0 305.5   11.4  309.5  11.4 1922.59 -71.8281     1397.97  -71.8281    290.221   -71.8281     
1 1 1 4  27 9  o 0 158.8   6.5   147.8  6.5  1566.47 101.511      686.303  101.511     200.73    -78.4889     
1 1 1 6  27 9  o 0 254.4   9.7   243.9  9.7  2822.47 -170.047     671.019  -170.047    901.42    9.95286      
1 1 1 9  10 27 o 0 313.6   11.9  296.5  11.9 1977.72 -61.1398     1280.25  -61.1398    210.691   -61.1398     
1 1 1 9  12 27 o 0 147.8   8.2   163.3  8.2  674.664 175.344      813.929  175.344     362.171   175.344      
1 1 1 9  14 27 o 0 2.9     6.7   16.3   6.7  1287.19 24.2865      665.025  -155.714    1509.19   -155.714     
1 1 1 1  27 10 o 0 71      4.6   65.6   4.6  877.934 131.519      143.797  131.519     363.75    -48.4809     
1 1 1 3  27 10 o 0 297.2   10.7  284.9  10.7 3440.03 70.5277      567.547  70.5277     1385.65   -109.472     
1 1 1 5  27 10 o 0 142.6   6.5   146    6.5  1791.21 112.524      543.054  112.524     456.843   -67.4758     
1 1 1 7  27 10 o 0 8       4.2   16.1   4.2  729.173 -96.0351     290.569  83.9649     691.041   83.9649      
1 1 1 10 13 27 o 0 110.7   7.3   113.6  7.3  2763.24 -22.2237     122.677  157.776     1941.84   157.776      
1 1 1 10 15 27 o 0 45.9    7.9   44     7.9  1147.09 77.9148      133.489  -102.085    862.329   -102.085     
1 1 1 2  27 11 o 0 83.2    5.2   78.2   5.2  1410.62 -125.074     179.092  -125.074    623.439   54.9257      
1 1 1 4  27 11 f 1 121.9   6.8   137    6.8  2151.54 -40.0539     297.283  -40.0539    912.249   139.946      
1 1 1 6  27 11 o 0 234     9.7   201.7  9.7  2033.21 -7.38836     868.812  -7.38836    248.846   172.612      
1 1 1 8  27 11 o 0 196.7   8.7   176.9  8.7  1284.76 32.7745      917.756  32.7745     223.069   32.7745      
1 1 1 11 16 27 o 0 246.9   14.1  260.2  14.1 2312.07 -137.813     1062.49  -137.813    375.786   42.1873      
1 1 1 11 18 27 o 0 19.7    10.3  29.7   10.3 1256.91 38.1837      409.423  -141.816    1168.7    -141.816     
1 1 1 11 20 27 o 0 1.3     10.3  -10.2  10.3 564.447 -114.622     292.224  65.3784     618.774   65.3784      
1 1 1 11 22 27 o 0 -35.7   12    27.3   12   2101.83 -171.736     1013.94  8.2639      2185.98   8.2639       
1 1 1 3  27 12 f 1 170.5   8.2   160.5  8.2  1918.74 174.547      626.173  174.547     453.241   -5.45343     
1 1 1 7  27 12 o 0 308.1   12.6  283.7  12.6 2092.65 -36.3927     1193.58  -36.3927    62.1628   -36.3927     
1 1 1 9  27 12 o 0 175.9   8.8   156.8  8.8  2028.95 10.4239      709.091  10.4239     649.311   -169.576     
1 1 1 11 27 12 o 0 51.7    7.6   56.2   7.6  834.066 -149.373     27.2454  -149.373    521.287   30.627       
1 1 1 12 13 27 o 0 265.6   13.7  249.4  13.7 2024.47 157.467      1259.51  157.467     37.5209   -22.5325     
1 1 1 2  27 13 o 0 24.2    5.1   14.3   5.1  250.561 -56.1035     78.9757  123.896     219.11    123.896      
1 1 1 4  27 13 o 0 286.8   12    288.5  12   2314.82 77.1157      1077.68  77.1157     194.442   -102.884     
1 1 1 6  27 13 o 0 252.9   10.4  227.3  10.4 1588.84 48.53        1415.68  48.53       334.629   48.53        
1 1 1 8  27 13 f 1 480.7   17.7  434.7  17.7 849.384 -104.062     2585.24  -104.062    2013.89   -104.062     
1 1 1 10 27 13 o 0 176.6   9.2   155.7  9.2  2087.31 108.129      666.109  108.129     705.605   -71.8713     
1 1 1 12 27 13 o 0 36.4    7.9   56.6   7.9  1874.19 127.345      340.716  -52.6548    1534.35   -52.6548     
1 1 1 1  27 14 o 0 38.3    5.2   46.8   5.2  381.64  107.989      19.0615  -72.0114    232.211   -72.0114     
1 1 1 3  27 14 o 0 195.1   9.6   230.7  9.6  2274.56 83.853       931.296  83.853      640.785   -96.147      
1 1 1 7  27 14 o 0 145.8   8.1   150.3  8.1  792.684 -4.59258     814.219  -4.59258    284.931   -4.59258     
1 1 1 13 27 14 o 0 304     15.2  293.3  15.2 1448.47 -174.734     1665.49  -174.734    762.83    -174.734     
1 1 1 14 15 27 o 0 8.4     9.4   -2.3   9.4  1044.54 -53.8113     543.188  126.189     1184.48   126.189      
1 1 1 14 19 27 o 0 14.9    11.8  -3.2   11.8 1300.57 14.8805      603.791  -165.119    1346.3    -165.119     
1 1 1 2  27 15 o 0 43.7    5.6   32.3   5.6  1013.19 157.989      176.189  -22.0108    874.653   -22.0108     
1 1 1 4  27 15 o 0 36.8    6     17.3   6    265.36  75.6366      63.8941  -104.363    243.691   -104.363     
1 1 1 6  27 15 o 0 112.1   7.3   103.5  7.3  1435.35 66.0759      467.665  66.0759     488.238   -113.924     
1 1 1 12 27 15 o 0 251.3   14.2  273    14.2 2067.14 -95.1322     1229.65  -95.1322    56.5397   84.8678      
1 1 1 1  27 16 o 0 18.4    6.3   20.3   6.3  425.727 -108.996     173.038  71.0044     465.353   71.0044      
1 1 1 3  27 16 o 0 38.9    6.5   33.8   6.5  887.356 134.942      164.507  -45.0578    763.51    -45.0578     
1 1 1 5  27 16 o 0 63.8    7.4   67.7   7.4  897.478 137.403      137.749  137.403     457.793   -42.5972     
1 1 1 7  27 16 o 0 20.4    6.6   28.1   6.6  637.911 36.0646      203.021  -143.935    613.938   -143.935     
1 1 1 9  27 16 o 0 21.5    6.2   24.4   6.2  1593.74 162.346      586.324  -17.6535    1594.57   -17.6535     
1 1 1 2  27 17 f 1 75.5    7.6   92.6   7.6  1671.45 -10.3687     160.014  -10.3687    968.89    169.631      
1 1 1 4  27 17 o 0 16.2    7.2   29     7.2  815.649 -78.4661     275.829  101.534     807.917   101.534      
1 1 1 6  27 17 o 0 299.1   13.4  261.9  13.4 2049.96 -16.9869     1379.47  -16.9869    64.9578   -16.9869     
1 1 1 8  27 17 o 0 140.9   9     117.3  9    630.154 141.256      558.846  141.256     161.887   141.256      
1 1 1 3  27 18 f 1 179.6   9.8   164.7  9.8  447.337 -138.944     678.142  -138.944    386.468   -138.944     
1 1 1 5  27 18 o 0 139.2   9     140.8  9    974.503 -7.77172     750.69   -7.77172    129.368   -7.77172     
1 1 1 7  27 18 o 0 343.7   14.2  346.7  14.2 1907.05 179.732      1731.67  179.732     536.775   179.732      
1 1 1 13 27 18 o 0 173.9   13.3  147.1  13.3 894.56  155.421      822.748  155.421     295.006   155.421      
1 1 1 15 27 18 o 0 36.4    11.4  5.9    11.4 540.787 49.7103      167.331  -130.29     475.4     -130.29      
1 1 1 2  27 19 f 1 212.9   11.1  206.3  11.1 1179.74 -65.8255     1253.05  -65.8255    489.756   -65.8255     
1 1 1 4  27 19 o 0 176.6   10.4  167.9  10.4 2072.16 -7.74094     700.341  -7.74094    611.486   172.259      
1 1 1 6  27 19 o 0 45.2    9.8   44     9.8  419.358 -84.6807     21.4639  95.3193     282.495   95.3193      
1 1 1 10 27 19 o 0 -0.1    8.6   17.2   8.6  1353.71 10.3558      645.784  -169.644    1457.72   -169.644     
1 1 1 12 27 19 o 0 106.7   11.9  136    11.9 2253.46 -118.717     225.849  -118.717    1097.53   61.2831      
1 1 1 1  27 20 o 0 299.5   15    342.5  15   2408.49 -17.7096     1399.37  -17.7096    135.424   162.29       
1 1 1 3  27 20 o 0 327.5   15    319.8  15   2524.92 -128.872     1325.1   -128.872    259.571   51.1278      
1 1 1 5  27 20 o 0 60.8    8.7   45.2   8.7  432.353 90.9323      28.0493  90.9323     238.936   -89.0677     
1 1 1 7  27 20 o 0 65.7    10    36.8   10   888.915 103.033      13.476   103.033     526.051   -76.9671     
1 1 1 2  27 21 o 0 137.6   10.9  164.8  10.9 1313.65 95.3525      808.156  95.3525     7.73118   -84.6475     
1 1 1 4  27 21 f 1 1.8     9.2   14     9.2  1263.54 139.921      623.259  -40.0785    1400.49   -40.0785     
1 1 1 10 27 21 o 0 73.5    10    48.6   10   1391.21 -125.262     39.0223  54.7383     837.318   54.7383      
1 1 1 1  27 22 f 1 183.7   13.7  194.9  13.7 3017.18 -23.181      297.135  -23.181     1563.97   156.819      
1 1 1 3  27 22 o 0 68      10.8  78.2   10.8 2399.55 -139.924     271.15   40.0764     1722.39   40.0764      
1 1 1 7  27 22 o 0 31.6    12.1  52.1   12.1 958.021 -53.1106     134.343  126.889     689.594   126.889      
1 1 1 2  27 23 o 0 14.1    11.6  19     11.6 1643.34 135.128      693.94   -44.8717    1664.82   -44.8717     
1 1 1 4  27 23 o 0 86.9    12.7  98.7   12.7 272.021 -91.1196     116.386  -91.1196    42.0423   88.8804      
1 1 1 1  28 1  o 0 668.2   21.1  647.9  21.1 3371.98 18.1572      1956.34  18.1572     33.0616   18.1572      
1 1 1 1  7  28 o 0 573.9   19.5  538    19.5 3212.19 96.8202      1689.09  96.8202     116.01    -83.1798     
1 1 1 1  9  28 o 0 227.7   9.1   233.3  9.1  2016.92 -93.6137     948.773  -93.6137    175.233   86.3863      
1 1 1 1  17 28 o 0 352.3   14.3  330.4  14.3 2234.71 -42.2015     1598.83  -42.2015    162.799   -42.2015     
1 1 1 1  19 28 o 0 124.3   8.8   103.8  8.8  1199.57 66.2657      536.188  66.2657     212.212   -113.734     
1 1 1 2  28 2  o 0 528.2   17.3  529.3  17.3 2578.15 -92.1711     1932.98  -92.1711    470.238   -92.1711     
1 1 1 2  8  28 o 0 127.3   6.1   133.2  6.1  421.677 141.116      384.435  141.116     149.903   141.116      
1 1 1 2  10 28 o 0 406.9   14.2  382.3  14.2 2674.99 123.061      1354.59  123.061     117.59    -56.9393     
1 1 1 2  12 28 o 0 5.8     3.7   13.3   3.7  938.675 91.5675      500.673  -88.4325    1141.81   -88.4325     
1 1 1 2  16 28 o 0 189.7   9.1   178.3  9.1  2343.09 109.038      661.412  109.038     854.493   -70.9622     
1 1 1 2  18 28 o 0 65.9    7.3   70.9   7.3  2096.26 -126.85      189.069  53.1498     1508.88   53.1498      
1 1 1 3  5  28 f 1 594.5   19.3  572.9  19.3 3933.48 160.015      1379.42  160.015     825.127   -19.9849     
1 1 1 3  7  28 o 0 52.1    4.1   47.7   4.1  442.983 150.469      12.6025  150.469     233.125   -29.531      
1 1 1 3  9  28 o 0 272     10.4  273.2  10.4 2129.43 61.8517      1091.67  61.8517     79.3288   -118.148     
1 1 1 3  11 28 f 1 143.2   6.5   136    6.5  1710.17 42.9386      522.719  42.9386     411.063   -137.061     
1 1 1 3  15 28 o 0 76.3    6.8   74.3   6.8  1712.86 -104.683     45.9993  -104.683    1081.94   75.3166      
1 1 1 3  17 28 o 0 24.6    6.4   26.8   6.4  1208.22 -59.8756     389.85   120.124     1156.35   120.124      
1 1 1 3  19 28 o 0 168.4   10.5  144.9  10.5 1104.95 145.219      857.743  145.219     176.859   145.219      
1 1 1 2  28 4  o 0 37.5    3.7   24.2   3.7  710.365 153.648      137.475  -26.352     541.368   -26.352      
1 1 1 4  28 4  o 0 188.3   7.4   179.6  7.4  1778.04 62.7837      794.155  62.7837     200.812   -117.216     
1 1 1 4  6  28 o 0 120.6   5.8   122.7  5.8  2141.02 56.0106      247.632  56.0106     936.282   -123.989     
1 1 1 4  8  28 f 1 169     7.7   182.6  7.7  2656.02 12.2625      350.524  12.2625     1116.18   -167.738     
1 1 1 4  12 28 o 0 3.5     4.1   6.2    4.1  802.491 -1.77503     480.677  178.225     1021.51   178.225      
1 1 1 4  16 28 o 0 147.1   9.1   132.3  9.1  1744.18 49.2589      612.122  49.2589     501.355   -130.741     
1 1 1 4  18 28 o 0 148.3   11    145.6  11   955.966 81.3049      778.705  81.3049     184.673   81.3049      
1 1 1 4  22 28 o 0 63.6    10.7  76.3   10.7 994.541 -138.187     90.9174  -138.187    481.721   41.8127      
1 1 1 3  28 5  f 1 82.5    4.9   92.1   4.9  1952.58 129.248      57.8864  129.248     1048.87   -50.7519     
1 1 1 5  28 5  o 0 356.2   12.6  359.4  12.6 1652.05 4.41569      1661.04  4.41569     744.45    4.41569      
1 1 1 5  7  28 o 0 166.1   7.4   169.9  7.4  2762.39 83.9612      260.26   83.9612     1253.67   -96.0388     
1 1 1 5  9  28 o 0 43.7    4.2   40.5   4.2  614.073 -128.104     43.0343  51.8959     376.465   51.8959      
1 1 1 5  11 28 f 1 408.8   13.8  398.3  13.8 2628.87 6.35496      1720.3   6.35496     63.9815   -173.645     
1 1 1 5  13 28 o 0 352.4   12.8  369.4  12.8 1611.58 -136.333     2018.11  -136.333    948.885   -136.333     
1 1 1 5  15 28 o 0 62.6    7.2   30.6   7.2  785.538 -70.9338     6.16327  109.066     510.241   109.066      
1 1 1 5  17 28 o 0 143.2   10.3  156    10.3 2151.95 -23.339      497.141  -23.339     849.611   156.661      
1 1 1 2  28 6  o 0 188.3   7.4   206.9  7.4  1287.06 -28.9876     1025.82  -28.9876    295.46    -28.9876     
1 1 1 4  28 6  o 0 221.2   8.6   219    8.6  724.844 -152.719     1055.86  -152.719    651.288   -152.719     
1 1 1 6  28 6  o 0 51.3    4.1   47.2   4.1  1557.2  21.9502      168.788  -158.05     1024.39   -158.05      
1 1 1 6  8  28 o 0 304.3   12.6  325.6  12.6 2266.01 -3.1089      1204.68  -3.1089     24.7447   176.891      
1 1 1 6  10 28 o 0 24.1    4.5   20.1   4.5  654.343 -32.8466     186.923  147.153     537.844   147.153      
1 1 1 6  12 28 o 0 357.5   13.4  353.1  13.4 2456.12 -57.0072     1573.28  -57.0072    60.274    122.993      
1 1 1 6  14 28 o 0 205.1   10.5  187.2  10.5 3245.28 168.135      218.015  168.135     1899.1    -11.8652     
1 1 1 6  16 28 o 0 295.7   14.1  284    14.1 1837.27 -125.35      1494.97  -125.35     338.222   -125.35      
1 1 1 6  18 28 o 0 31.8    8.9   42.1   8.9  785.069 110.22       124.641  -69.7798    605.679   -69.7798     
1 1 1 1  28 7  o 0 314.6   11.1  313    11.1 1715.72 -109.252     1495.61  -109.252    515.902   -109.252     
1 1 1 3  28 7  o 0 95.1    5.5   82     5.5  1470.87 74.5307      232.429  74.5307     593.074   -105.469     
1 1 1 7  28 7  o 0 149.4   7.2   158    7.2  2032.46 -62.7324     496.746  -62.7324    607.798   117.268      
1 1 1 7  11 28 o 0 53.6    5.7   61     5.7  335.455 64.1661      49.1819  64.1661     174.33    -115.834     
1 1 1 7  15 28 o 0 264.9   12.5  259    12.5 1370.27 -77.5759     1514.13  -77.5759    647.029   -77.5759     
1 1 1 7  17 28 o 0 216     11.9  216.1  11.9 2030.1  79.8418      975.444  79.8418     276.937   -100.158     
1 1 1 7  19 28 o 0 5.3     9.8   -5.2   9.8  337.441 -83.5226     174.276  96.4774     376.43    96.4774      
1 1 1 2  28 8  o 0 160.6   7     157.3  7    1275.56 120.489      785.981  120.489     66.5482   120.489      
1 1 1 4  28 8  f 1 65.2    4.8   45.7   4.8  541.341 20.1462      51.1702  20.1462     250.699   -159.854     
1 1 1 6  28 8  o 0 196.2   8.1   181.1  8.1  1165.68 -58.6532     949.025  -58.6532    313.122   -58.6532     
1 1 1 8  28 8  o 0 275.4   10.9  257.1  10.9 1778.91 46.3605      1175.45  46.3605     220.556   46.3605      
1 1 1 8  10 28 o 0 21.7    5     24.9   5    611.01  63.4147      207.025  -116.585    614.636   -116.585     
1 1 1 8  12 28 o 0 143.8   8.2   154.3  8.2  1996.19 -39.5648     582.172  -39.5648    728.046   140.435      
1 1 1 8  16 28 o 0 -15.1   6.9   25.7   6.9  348.27  -3.3788      168.337  176.621     384.444   176.621      
1 1 1 1  28 9  o 0 400.1   13.8  405.9  13.8 1987.94 -89.6195     1745.05  -89.6195    619.104   -89.6195     
1 1 1 3  28 9  o 0 82.8    5.7   85.6   5.7  2133.88 -109.451     39.5701  70.5492     1227.18   70.5492      
1 1 1 5  28 9  o 0 44.8    4.6   43.5   4.6  756.939 31.7984      46.1128  -148.202    460.354   -148.202     
1 1 1 9  13 28 f 1 81.8    8.2   119.8  8.2  1977.34 -146.008     206.255  -146.008    1061.85   33.992       
1 1 1 9  15 28 o 0 199.4   12.1  173.8  12.1 2290.4  37.7354      682.683  37.7354     745.628   -142.265     
1 1 1 9  17 28 o 0 204.9   13.5  184    13.5 1964.17 -164.942     861.526  -164.942    331.735   15.0576      
1 1 1 4  28 10 o 0 222.4   8.7   188.6  8.7  1448.05 61.0805      1005.42  61.0805     210.969   61.0805      
1 1 1 6  28 10 o 0 78      5.6   72.5   5.6  591.511 10.2695      163.365  10.2695     155.748   -169.731     
1 1 1 8  28 10 o 0 187.7   8.5   193.6  8.5  1194.27 41.0394      1171.83  41.0394     373.872   41.0394      
1 1 1 10 14 28 f 1 335.3   15.5  360.4  15.5 1317.06 -48.9889     1950.2   -48.9889    1120.76   -48.9889     
1 1 1 10 16 28 o 0 15.2    9.5   37.4   9.5  842.787 -105.935     216.552  74.0646     731.435   74.0646      
1 1 1 5  28 11 f 1 8.7     4.7   15.2   4.7  582.736 54.3897      292.918  -125.61     691.675   -125.61      
1 1 1 7  28 11 o 0 499     17    483.3  17   3141.24 -37.7827     1791.45  -37.7827    310.004   142.217      
1 1 1 11 28 11 o 0 352.3   15    330.6  15   2097.29 -139.591     1648.71  -139.591    294.998   -139.591     
1 1 1 11 13 28 o 0 158.9   10.5  137    10.5 1273.78 -68.4754     797.406  -68.4754    3.02244   111.525      
1 1 1 11 17 28 o 0 78.6    11.5  77.5   11.5 1198.68 -118.352     196.258  -118.352    519.858   61.648       
1 1 1 2  28 12 o 0 234.4   11.1  244.1  11.1 1392.16 136.662      1500.73  136.662     536.328   136.662      
1 1 1 6  28 12 o 0 143.1   8.5   161.9  8.5  1008.1  38.6243      901.096  38.6243     226.389   38.6243      
1 1 1 8  28 12 o 0 406.9   16.5  410.1  16.5 2266.77 -158.098     1905.41  -158.098    414.378   -158.098     
1 1 1 10 28 12 o 0 48.8    6.5   40.6   6.5  451.557 -124.581     21.2639  55.4192     309.389   55.4192      
1 1 1 12 28 12 o 0 86.8    9.7   97.8   9.7  1533.57 -42.52       269.949  -42.52      689.486   137.48       
1 1 1 12 14 28 f 1 154.8   12.6  209.5  12.6 535.736 -82.3771     801.409  -82.3771    469.382   -82.3771     
1 1 1 5  28 13 o 0 38.1    6.3   32.4   6.3  474.867 130.064      80.4433  -49.9357    398.126   -49.9357     
1 1 1 7  28 13 o 0 237.7   11.1  242.8  11.1 1315.59 -156.733     1448.59  -156.733    583.599   -156.733     
1 1 1 11 28 13 o 0 258.1   13.9  267.3  13.9 2320.45 -40.7218     1114.42  -40.7218    337.779   139.278      
1 1 1 13 28 13 o 0 172.3   12.2  187.1  12.2 1113.82 -114.258     1005.99  -114.258    323.538   -114.258     
1 1 1 2  28 14 o 0 67.3    7.4   73.5   7.4  1335.76 -12.8222     120.56   -12.8222    787.198   167.178      
1 1 1 4  28 14 o 0 351.1   14.3  353.1  14.3 2089.34 89.2765      1762.72  89.2765     366.959   89.2765      
1 1 1 6  28 14 o 0 124.4   8.1   134.5  8.1  1915.15 -102.795     466.369  -102.795    791.1     77.2046      
1 1 1 8  28 14 o 0 222.9   10.8  218.4  10.8 2004.33 -71.9594     1048.03  -71.9594    229.052   108.041      
1 1 1 10 28 14 f 1 89.7    8.6   96.4   8.6  2401.35 28.8048      92.0394  -151.195    1602.18   -151.195     
1 1 1 14 16 28 o 0 54.2    11.2  42.5   11.2 127.88  -176.652     1.94521  -176.652    73.3818   3.34826      
1 1 1 1  28 15 o 0 177.4   9.2   169.6  9.2  1849.84 -30.4592     853.355  -30.4592    400.122   149.541      
1 1 1 3  28 15 o 0 410     15.9  426.7  15.9 2457.96 89.1037      1870.04  89.1037     232.265   89.1037      
1 1 1 5  28 15 o 0 98.6    8.6   91.6   8.6  1350.94 150.017      353.586  150.017     520.484   -29.9826     
1 1 1 7  28 15 o 0 102.1   8.1   101.3  8.1  414.991 66.59        276.987  66.59       13.1542   66.59        
1 1 1 13 28 15 f 1 60.3    9.6   51.7   9.6  1536.62 151.906      108.394  -28.0941    1033.61   -28.0941     
1 1 1 2  28 16 o 0 76.6    8.1   94.1   8.1  257.662 -86.7863     133.389  -86.7863    35.529    93.2137      
1 1 1 4  28 16 o 0 -4.5    7     -1.7   7    1049.68 142.032      623.102  -37.9676    1299.83   -37.9676     
1 1 1 1  28 17 o 0 48      8.2   42.2   8.2  1729.47 151.502      328.432  -28.4981    1455.96   -28.4981     
1 1 1 3  28 17 o 0 51.5    7.8   51.4   7.8  364.224 -8.04432     15.3248  -8.04432    218.33    171.956      
1 1 1 5  28 17 o 0 117.8   9.4   130.8  9.4  1311.8  37.8882      607.367  37.8882     220.136   -142.112     
1 1 1 9  28 17 o 0 45.9    8.2   18.3   8.2  825.473 -72.0306     137.311  107.969     639.484   107.969      
1 1 1 13 28 17 o 0 129.3   12.3  134.4  12.3 2256.62 -22.3058     290.276  -22.3058    1025.08   157.694      
1 1 1 4  28 18 o 0 334     14.8  347.7  14.8 2221.86 -12.705      1563.35  -12.705     169.959   -12.705      
1 1 1 6  28 18 o 0 228.1   13.3  231.2  13.3 2232.67 125.328      958.18   125.328     418.318   -54.6723     
1 1 1 12 28 18 o 0 0.6     11.3  7.6    11.3 1061.75 51.875       508.258  -128.125    1118.99   -128.125     
1 1 1 14 28 18 o 0 113     12.7  73.1   12.7 1981.19 -1.53394     92.2827  -1.53394    1020.14   178.466      
1 1 1 3  28 19 o 0 163.8   11.4  160.4  11.4 699.851 52.5407      795.804  52.5407     360.153   52.5407      
1 1 1 5  28 19 o 0 105.5   10.5  121.4  10.5 2210.01 -85.9158     185.687  -85.9158    1167.74   94.0842      
1 1 1 2  28 20 o 0 93.3    10    82.6   10   1940.53 46.9118      79.6246  46.9118     1117.29   -133.088     
1 1 1 4  28 20 o 0 20.1    9.9   45.5   9.9  737.88  -127.672     122.362  52.3281     570.527   52.3281      
1 1 1 8  28 20 o 0 82.4    11    98.6   11   737.887 54.9166      238.402  54.9166     190.092   -125.083     
1 1 1 10 28 20 o 0 171.7   13    180.9  13   1690.53 -88.2111     766.194  -88.2111    196.284   91.7889      
1 1 1 1  28 21 o 0 73      11.6  74.7   11.6 1419.46 -62.8868     113.435  -62.8868    752.346   117.113      
1 1 1 3  28 21 f 1 122.5   13.3  116.9  13.3 2252    -146.918     202.212  -146.918    1159.62   33.0821      
1 1 1 2  28 22 o 0 63.4    12    81.5   12   1874.53 25.5124      80.0191  -154.488    1182.59   -154.488     
1 1 1 6  28 22 o 0 22.3    11.7  45.7   11.7 845.041 152.386      166.788  -27.6136    648.832   -27.6136     
1 1 1 1  4  29 o 0 549.1   17.9  537.9  17.9 2183.01 -29.0102     2094.37  -29.0102    898.491   -29.0102     
1 1 1 1  6  29 o 0 435.9   15.7  438.1  15.7 3516.74 144.575      1086.55  144.575     836.312   -35.425      
1 1 1 1  8  29 o 0 349.1   13.1  361.3  13.1 2734.1  -19.7682     1156.34  -19.7682    329.523   160.232      
1 1 1 1  10 29 o 0 142.3   6.9   129.4  6.9  1511.93 174.362      700.012  174.362     324.243   -5.63774     
1 1 1 1  12 29 o 0 60.4    4.9   41.6   4.9  572.791 73.1133      29.3217  73.1133     353.107   -106.887     
1 1 1 1  14 29 o 0 410.2   14.8  406.4  14.8 2018.65 117.524      2031.36  117.524     724.85    117.524      
1 1 1 1  16 29 o 0 170.4   10    171.6  10   1900.49 119.427      768.074  119.427     433.968   -60.5728     
1 1 1 1  18 29 o 0 282.2   13.2  268.1  13.2 1732.65 -81.619      1428.74  -81.619     362.29    -81.619      
1 1 1 1  20 29 o 0 53.4    8.9   66.6   8.9  1149.32 -6.75696     36.5512  -6.75696    648.999   173.243      
1 1 1 1  29 2  o 0 153.6   6.6   152    6.6  1347.89 -23.1987     723.905  -23.1987    26.0894   156.801      
1 1 1 2  3  29 o 0 37.5    4     41.3   4    734.145 175.099      78.6396  -4.90085    478.418   -4.90085     
1 1 1 2  5  29 o 0 408.6   14.6  408    14.6 2277.03 -176.313     1573.11  -176.313    333.391   -176.313     
1 1 1 2  7  29 o 0 240.3   9.5   233.7  9.5  1839.96 -105.716     1024.37  -105.716    26.8507   -105.716     
1 1 1 2  9  29 f 1 16.4    4.1   20.9   4.1  1167.68 131.195      392.547  -48.8045    1023.89   -48.8045     
1 1 1 2  15 29 o 0 137.6   8.3   112.1  8.3  1083.97 119.874      645.392  119.874     44.3644   -60.1258     
1 1 1 2  19 29 o 0 44.5    8.7   47.4   8.7  1405.82 153.771      184.954  -26.2292    1032.49   -26.2292     
1 1 1 2  21 29 o 0 45      8.8   33.4   8.8  1185.43 -73.8371     224.483  106.163     908.849   106.163      
1 1 1 2  29 3  o 0 34.1    4.2   39.1   4.2  1864.2  89.2162      423.868  -90.7839    1454.64   -90.7839     
1 1 1 3  4  29 o 0 194.5   8.2   175.2  8.2  1791.21 -119.685     770.628  -119.685    199.889   60.3145      
1 1 1 3  6  29 o 0 295.8   10.7  254.9  10.7 2831.32 147.41       772.327  147.41      757.839   -32.59       
1 1 1 3  8  29 o 0 7.3     4     7.8    4    748.545 11.5105      339.429  -168.49     741.341   -168.49      
1 1 1 3  10 29 o 0 129.8   6.5   114.8  6.5  1078.85 60.0316      660.257  60.0316     61.6425   -119.968     
1 1 1 3  12 29 o 0 90.8    5.9   79.2   5.9  1061.83 -165.397     317.161  -165.397    383.037   14.6032      
1 1 1 3  14 29 f 1 57.9    5.3   59.5   5.3  439.858 -46.5975     57.5183  -46.5975    225.276   133.402      
1 1 1 3  18 29 o 0 204.3   12.4  235.3  12.4 377.111 14.3665      755.2    14.3665     525.785   14.3665      
1 1 1 1  29 4  o 0 249.3   9.7   245    9.7  2204.24 65.9406      952.363  65.9406     277.272   -114.059     
1 1 1 3  29 4  o 0 54.4    4.8   56.1   4.8  1048.39 112.754      9.81186  112.754     565.576   -67.2464     
1 1 1 4  5  29 o 0 534.9   17.5  520    17.5 2792.08 -167.016     1729.9   -167.016    226.511   -167.016     
1 1 1 4  7  29 o 0 470.2   16.2  443.3  16.2 2662.78 -35.6439     1547.31  -35.6439    120.515   -35.6439     
1 1 1 4  9  29 o 0 68.5    5.6   57     5.6  1941.66 -88.0428     190.696  91.9572     1489.57   91.9572      
1 1 1 4  11 29 o 0 60.4    5.3   58.5   5.3  535.102 127.323      79.2468  127.323     274.17    -52.6766     
1 1 1 4  17 29 o 0 120.2   10.2  117    10.2 2064.39 2.60063      290.658  2.60063     974.772   -177.399     
1 1 1 4  19 29 o 0 124.3   10.8  114.6  10.8 356.822 -174.574     302.59   -174.574    90.0804   -174.574     
1 1 1 5  8  29 o 0 95.9    6     102    6    1480.33 -76.6198     373.221  -76.6198    616.077   103.38       
1 1 1 5  10 29 o 0 283.9   10.9  265.2  10.9 1544.6  30.1182      1588.8   30.1182     567.898   30.1182      
1 1 1 5  12 29 o 0 152     7.5   141.2  7.5  999.721 -5.0668      829.934  -5.0668     178.987   -5.0668      
1 1 1 5  14 29 o 0 224.1   10.8  225.1  10.8 2417.51 70.2691      858.34   70.2691     667.427   -109.731     
1 1 1 1  29 6  o 0 154.3   7     161.3  7    2320.04 -103.415     410.367  -103.415    881.797   76.5854      
1 1 1 3  29 6  o 0 92.4    5.6   87.8   5.6  2110    73.1692      20.2582  73.1692     1135.38   -106.831     
1 1 1 6  7  29 o 0 47.8    4.9   49.6   4.9  1580.95 -160.209     176.341  19.7915     1013.91   19.7915      
1 1 1 6  9  29 o 0 185.7   8.3   181.8  8.3  1195.62 -94.3963     1111.26  -94.3963    321.001   -94.3963     
1 1 1 6  11 29 o 0 102.1   7     120.1  7    1560.43 34.6852      453.086  34.6852     564.662   -145.315     
1 1 1 6  13 29 o 0 249.8   10.5  216.9  10.5 1742.09 -39.3173     1235.82  -39.3173    132.589   -39.3173     
1 1 1 6  15 29 o 0 127.6   9.4   133.8  9.4  92.8667 -68.6023     101.2    -68.6023    43.6163   -68.6023     
1 1 1 6  19 29 o 0 11.8    10.7  6.8    10.7 501.666 -129.12      225.183  50.8801     519.918   50.8801      
1 1 1 2  29 7  o 0 234.9   9.3   209.8  9.3  1541.4  -142.709     1070.77  -142.709    221.598   -142.709     
1 1 1 4  29 7  o 0 34.3    4.8   24.2   4.8  1049.61 -96.1597     233.571  83.8403     802.236   83.8403      
1 1 1 6  29 7  o 0 215.4   9.1   204.3  9.1  1799.18 30.7338      886.764  30.7338     72.1585   -149.266     
1 1 1 7  8  29 o 0 219.8   9.1   218.7  9.1  2205.6  164.182      959.208  164.182     497.771   -15.8183     
1 1 1 7  10 29 o 0 161.2   8     159.7  8    1947.67 -39.2339     685.08   -39.2339    586.459   140.766      
1 1 1 7  14 29 o 0 54.8    8.5   53     8.5  1822.54 56.9005      240.673  -123.099    1375.56   -123.099     
1 1 1 7  16 29 o 0 140.3   10.5  124.1  10.5 1739.88 21.7485      528.575  21.7485     529.902   -158.251     
1 1 1 7  18 29 o 0 1.8     11    26.3   11   596.136 -165.442     238.226  14.558      591.173   14.558       
1 1 1 1  29 8  o 0 365.5   13.3  384.1  13.3 2883.67 121.716      1184.07  121.716     412.601   -58.2836     
1 1 1 3  29 8  o 0 314.8   12.6  284.4  12.6 3101.38 -59.6924     751.281  -59.6924    936.923   120.308      
1 1 1 7  29 8  o 0 76.9    5.8   85.4   5.8  508.604 107.447      221.209  107.447     116.034   -72.5532     
1 1 1 8  9  29 o 0 -4.2    5.3   -1.4   5.3  955.379 86.8094      586.833  -93.1906    1210.75   -93.1906     
1 1 1 8  11 29 o 0 224.8   10.4  238.2  10.4 2728.44 -31.6905     726.672  -31.6905    1030.22   148.309      
1 1 1 8  13 29 o 0 97      8.1   106.9  8.1  1851.23 171.994      247.152  171.994     909.463   -8.00628     
1 1 1 8  15 29 o 0 148.9   10.9  108.6  10.9 567.854 161.844      514.335  161.844     167.161   161.844      
1 1 1 2  29 9  f 1 500.5   16.7  482.3  16.7 2094.63 22.8143      1950.14  22.8143     799.052   22.8143      
1 1 1 4  29 9  o 0 366.7   13.7  337.7  13.7 2388.92 -136.14      1625.62  -136.14     9.12014   -136.14      
1 1 1 6  29 9  o 0 448.1   16.1  446.2  16.1 1705.05 -62.5624     2380     -62.5624    1245.53   -62.5624     
1 1 1 8  29 9  o 0 64.2    5.6   64.3   5.6  1061.18 109.603      104.887  109.603     589.191   -70.3971     
1 1 1 9  10 29 o 0 43.7    6.4   44.7   6.4  710.168 109.87       48.0147  -70.1301    505.812   -70.1301     
1 1 1 9  14 29 o 0 147.5   9.9   147.7  9.9  1023.23 122.382      782.207  122.382     154.086   122.382      
1 1 1 9  16 29 o 0 171.2   13.6  173.8  13.6 584.878 74.963       750.328  74.963      399.8     74.963       
1 1 1 1  29 10 o 0 54.8    5.3   55.9   5.3  1474.63 -109.321     102.504  70.6788     1120.36   70.6788      
1 1 1 3  29 10 o 0 75.9    6.5   81.8   6.5  750.151 165.108      259.885  165.108     249.124   -14.8918     
1 1 1 5  29 10 o 0 157.6   7.5   142.6  7.5  1435.92 62.5457      825.899  62.5457     132.005   -117.454     
1 1 1 7  29 10 o 0 99.8    6.8   98.3   6.8  2306.18 -54.2169     9.84773  -54.2169    1502.47   125.783      
1 1 1 9  29 10 o 0 120.3   7.7   114.4  7.7  1202.33 118.118      581.934  118.118     192.624   -61.8819     
1 1 1 10 13 29 o 0 102.3   9     102    9    715.007 -162.379     391.654  -162.379    48.6738   17.6207      
1 1 1 10 15 29 o 0 2.4     9.5   24.1   9.5  1529.08 -7.01881     661.809  172.981     1582.49   172.981      
1 1 1 2  29 11 o 0 40      5.3   28.7   5.3  1618.08 117.117      437.999  -62.8832    1537.9    -62.8832     
1 1 1 6  29 11 o 0 45.7    5.7   41.3   5.7  422.85  130.238      22.0448  -49.7621    299.806   -49.7621     
1 1 1 8  29 11 o 0 102.8   6.9   76.7   6.9  773.631 -57.1295     350.483  -57.1295    148.826   122.87       
1 1 1 11 12 29 o 0 62.8    8.4   64     8.4  1136.53 178.993      69.2726  178.993     632.328   -1.00697     
1 1 1 1  29 12 o 0 105.3   6.8   105.7  6.8  2213.36 101.709      120.779  101.709     1384.67   -78.2909     
1 1 1 3  29 12 o 0 189.2   10.2  214.1  10.2 265.696 -140.524     567.786  -140.524    390.108   -140.524     
1 1 1 5  29 12 o 0 109.7   7.6   107.2  7.6  1795.06 -3.71841     338.653  -3.71841    841.373   176.282      
1 1 1 7  29 12 o 0 37.5    6.7   58.7   6.7  487.325 -91.4221     6.12571  -91.4221    304.83    88.5779      
1 1 1 9  29 12 o 0 50.4    7.4   62.5   7.4  1013.04 140.537      23.9691  140.537     610.73    -39.4632     
1 1 1 12 13 29 o 0 64.1    10.8  106.4  10.8 1598.16 -21.0393     211.469  -21.0393    757.226   158.961      
1 1 1 12 17 29 o 0 -20.7   12.3  -14.2  12.3 283.054 -61.1649     147.782  118.835     309.194   118.835      
1 1 1 2  29 13 o 0 328.2   14.4  363.8  14.4 2825.04 108.627      1324.93  108.627     563.38    -71.3729     
1 1 1 6  29 13 o 0 357.9   14.7  307.5  14.7 2913.87 -67.0502     1184.07  -67.0502    674.997   112.95       
1 1 1 8  29 13 o 0 8.6     6.8   21.6   6.8  1273.35 166.58       541.238  -13.4195    1339.15   -13.4195     
1 1 1 12 29 13 o 0 76.7    10.7  99.8   10.7 827.05  45.3958      307.792  45.3958     190.071   -134.604     
1 1 1 13 16 29 o 0 57.4    12.5  79     12.5 438.701 -153.937     69.0571  -153.937    182.253   26.0632      
1 1 1 3  29 14 f 1 18.5    7.8   12.5   7.8  1771.75 -78.3479     831.142  101.652     1986.08   101.652      
1 1 1 5  29 14 o 0 201.2   12    182.5  12   2942.07 -100.738     378.937  -100.738    1495.84   79.2624      
1 1 1 13 29 14 o 0 164.6   12.4  143.9  12.4 1019.43 -8.92145     797.984  -8.92145    197.77    -8.92145     
1 1 1 4  29 15 o 0 2.1     7.8   36.5   7.8  910.976 164.458      292.97   -15.5418    872.072   -15.5418     
1 1 1 6  29 15 o 0 306     13.6  276.2  13.6 1342.22 24.3339      1660.67  24.3339     822.088   24.3339      
1 1 1 8  29 15 o 0 318.5   14    284    14   3221.38 8.20101      815.43   8.20101     1160.81   -171.799     
1 1 1 10 29 15 o 0 213.1   11.9  211.2  11.9 2625.18 -177.15      642.196  -177.15     937.039   2.85022      
1 1 1 1  29 16 o 0 259.4   12.5  249.1  12.5 1398.42 -29.1688     1489.26  -29.1688    589.354   -29.1688     
1 1 1 3  29 16 o 0 244.8   12.3  222.3  12.3 2611.94 124.762      812.756  124.762     841.375   -55.2376     
1 1 1 5  29 16 o 0 151.6   11.4  131.6  11.4 1679.2  150.312      635.679  150.312     409.999   -29.6884     
1 1 1 7  29 16 o 0 162.1   10.4  143.9  10.4 1348.4  -8.78905     798.965  -8.78905    25.9368   171.211      
1 1 1 9  29 16 o 0 219.1   12.8  222.5  12.8 1653.6  -104.439     1126.93  -104.439    134.346   -104.439     
1 1 1 11 29 16 o 0 88.2    11.2  68.9   11.2 571.339 102.307      189.032  102.307     146.895   -77.6929     
1 1 1 4  29 17 o 0 77.7    9.5   74.1   9.5  1671.51 106.477      60.9547  106.477     975.097   -73.5226     
1 1 1 6  29 17 o 0 25.1    10.3  56     10.3 2042.57 -125.338     432.546  54.6618     1677.05   54.6618      
1 1 1 8  29 17 o 0 72.3    9.8   45.6   9.8  1203.33 -119.002     33.2474  -119.002    686.58    60.9978      
1 1 1 12 29 17 o 0 120     12.6  106.6  12.6 1206.5  122.104      419.121  122.104     265.991   -57.8961     
1 1 1 3  29 18 o 0 94.5    9.7   114.8  9.7  812.069 -134.926     438.281  -134.926    61.9495   45.0743      
1 1 1 5  29 18 o 0 121.7   10.6  118.3  10.6 1029.56 -67.8111     568.108  -67.8111    55.7679   112.189      
1 1 1 2  29 19 o 0 181.3   12.9  179.6  12.9 290.328 -67.565      471.59   -67.565     294.166   -67.565      
1 1 1 4  29 19 o 0 115.2   11.1  114.5  11.1 114.844 -142.44      97.9131  -142.44     28.8084   -142.44      
1 1 1 5  29 20 o 0 115.5   12.7  133.1  12.7 1182.38 -9.62886     514.731  -9.62886    172.455   170.371      
1 1 1 7  29 20 o 0 43.1    12.8  50.4   12.8 2063.79 108.152      431.777  -71.8481    1610.52   -71.8481     
1 1 1 4  29 21 o 0 63.2    12.7  75.5   12.7 93.2924 -116.927     16.991   -116.927    36.7187   63.0729      
1 1 1 1  7  30 o 0 290.4   11.6  296.6  11.6 3099.36 64.5149      884.791  64.5149     1179.25   -115.485     
1 1 1 1  9  30 o 0 395.8   14.3  380    14.3 877.891 86.3403      2240.33  86.3403     1660.39   86.3403      
1 1 1 1  11 30 o 0 427.4   15    430.7  15   1710.85 -33.3845     2253.66  -33.3845    1137.23   -33.3845     
1 1 1 1  13 30 o 0 195.3   8.9   194.5  8.9  897.646 -129.005     1112.71  -129.005    543.562   -129.005     
1 1 1 1  15 30 o 0 152.7   8.2   154    8.2  1222.27 60.4918      830.812  60.4918     71.724    60.4918      
1 1 1 1  17 30 o 0 161     10.6  160.1  10.6 314.428 156.222      428.765  156.222     238.293   156.222      
1 1 1 1  19 30 o 0 63.2    9.5   46.6   9.5  927.601 171.374      23.3843  -8.6257     563.682   -8.6257      
1 1 1 2  30 2  o 0 518.6   17.7  534.6  17.7 3316.66 20.9961      1467.93  20.9961     311.683   -159.004     
1 1 1 2  4  30 o 0 68.7    5.7   73.2   5.7  1312.11 -76.3037     103.864  -76.3037    589.409   103.696      
1 1 1 2  6  30 o 0 396.3   14.7  395.5  14.7 1734.29 92.2601      2133.04  92.2601     981.353   92.2601      
1 1 1 2  8  30 o 0 174.7   8.2   172.6  8.2  1307.12 98.6121      1020.66  98.6121     157.964   98.6121      
1 1 1 2  12 30 f 1 -4.5    5.1   22.5   5.1  1156.47 10.2253      552.342  -169.775    1292.09   -169.775     
1 1 1 2  14 30 o 0 291     11.7  287.4  11.7 2031.17 10.5984      1393.67  10.5984     125.431   10.5984      
1 1 1 2  22 30 o 0 27.9    11    57.5   11   46.5606 -159.627     2.84843  20.3729     28.4908   20.3729      
1 1 1 3  5  30 o 0 13.7    4.8   28.2   4.8  1895.07 132.301      747.87   -47.699     2001.8    -47.699      
1 1 1 3  7  30 o 0 8.7     4.6   15.9   4.6  242.026 11.7962      114.976  -168.204    274.417   -168.204     
1 1 1 3  11 30 o 0 101.3   6.4   93.3   6.4  1117.36 -21.7964     404.5    -21.7964    307.61    158.204      
1 1 1 3  13 30 o 0 274.9   11.4  261.9  11.4 1623.94 51.3324      1460.44  51.3324     442.41    51.3324      
1 1 1 3  15 30 o 0 22.1    6.3   -6.2   6.3  1363.26 -21.1599     647.15   158.84      1484.37   158.84       
1 1 1 3  17 30 o 0 28      9.7   32.2   9.7  931.376 -38.2184     231.297  141.782     789.364   141.782      
1 1 1 3  19 30 o 0 176.9   12.6  155.4  12.6 2304.92 -1.65866     481.646  -1.65866    846.788   178.341      
1 1 1 3  21 30 o 0 29.4    10.6  18.8   10.6 973.096 -133.953     310.592  46.0474     853.349   46.0474      
1 1 1 2  30 4  o 0 69.2    5.5   67     5.5  669.904 -37.298      126.705  -37.298     233.608   142.702      
1 1 1 4  6  30 o 0 83.9    5.8   91.4   5.8  1108.5  -53.0471     335.7    -53.0471    392.644   126.953      
1 1 1 4  8  30 o 0 173.9   8.1   170    8.1  651.756 105.235      883.694  105.235     458.302   105.235      
1 1 1 4  12 30 o 0 152.5   8.4   158.4  8.4  1004.11 -108.14      857.331  -108.14     226.083   -108.14      
1 1 1 4  14 30 f 1 127.7   7.6   119.4  7.6  2776.94 0.651235     26.8823  -179.349    1750.16   -179.349     
1 1 1 5  7  30 o 0 125.6   6.7   117.5  6.7  1274.8  -166.162     614.07   -166.162    216.606   13.8384      
1 1 1 5  9  30 f 1 37.6    5.4   46.8   5.4  705.399 -84.7134     61.8079  95.2866     519.94    95.2866      
1 1 1 5  11 30 o 0 374.8   14.3  384.3  14.3 1902.28 2.44022      1902.48  2.44022     704.432   2.44022      
1 1 1 6  30 6  o 0 10.5    4.9   9.1    4.9  453.215 -128.2       236.617  51.7995     533.193   51.7995      
1 1 1 6  8  30 o 0 149     8.2   169.4  8.2  1377.17 -156.634     882.717  -156.634    6.04221   23.3662      
1 1 1 6  10 30 o 0 392.8   14.9  419.9  14.9 3043.23 -102.133     1430.55  -102.133    487.824   77.8667      
1 1 1 6  12 30 o 0 194.4   9.7   165.9  9.7  1792.95 55.9488      865.055  55.9488     248.295   -124.051     
1 1 1 6  14 30 o 0 247     12.1  218.5  12.1 1257.98 -99.6302     1319.45  -99.6302    552.95    -99.6302     
1 1 1 1  30 7  o 0 27      5.1   43.4   5.1  582.304 -21.8793     93.4282  158.121     489.549   158.121      
1 1 1 3  30 7  o 0 207     9.3   209.5  9.3  1748.67 68.2637      1124     68.2637     45.9923   -111.736     
1 1 1 7  9  30 o 0 63.5    6.4   63.5   6.4  2227.15 20.1472      305.336  -159.853    1709.47   -159.853     
1 1 1 7  11 30 o 0 85.4    7.2   120.4  7.2  818.073 -46.9476     442.823  -46.9476    66.049    133.052      
1 1 1 7  13 30 o 0 250     11.9  285.5  11.9 2133.28 120.359      1211.13  120.359     93.1194   -59.6412     
1 1 1 7  15 30 o 0 172.8   12.1  180.4  12.1 1890.08 -103.619     766.946  -103.619    364.44    76.3806      
1 1 1 7  17 30 o 0 -31.9   9.3   36.7   9.3  971.471 -116.972     428.008  63.0284     995.156   63.0284      
1 1 1 4  30 8  o 0 418.8   15.7  396.3  15.7 2309.13 99.3461      1889.64  99.3461     362.892   99.3461      
1 1 1 6  30 8  o 0 61.7    6.5   71.4   6.5  273.993 99.5232      75.4851  99.5232     102.637   -80.4768     
1 1 1 8  30 8  o 0 305.2   12.2  298.3  12.2 2258.52 82.7367      1361.97  82.7367     63.2292   -97.2633     
1 1 1 8  10 30 o 0 89.8    7.2   74.4   7.2  1032.85 -132.798     267.595  -132.798    375.472   47.2024      
1 1 1 1  30 9  o 0 44.9    5.7   38.8   5.7  1408.34 -19.5379     252.573  160.462     1203.02   160.462      
1 1 1 7  30 9  o 0 274.6   11.9  264.8  11.9 1865.73 135.468      1384.97  135.468     202.966   135.468      
1 1 1 9  30 9  o 0 41.2    6.9   47.4   6.9  152.683 92.0065      6.05446  -87.9935    101.038   -87.9935     
1 1 1 9  11 30 o 0 125.9   8.4   108.5  8.4  1051.37 -109.432     558.562  -109.432    86.8648   70.568       
1 1 1 9  13 30 o 0 41.1    8.7   20.8   8.7  1032.53 -162.922     222.007  17.0782     844.545   17.0782      
1 1 1 2  30 10 o 0 355.7   12.4  291.4  12.4 2105.66 -105.107     1617.51  -105.107    216.118   -105.107     
1 1 1 4  30 10 o 0 69.3    7     79.6   7    853.697 -140.172     220.303  -140.172    338.383   39.828       
1 1 1 6  30 10 o 0 216     9.6   186.3  9.6  1241.45 70.1758      1183.5   70.1758     394.667   70.1758      
1 1 1 8  30 10 o 0 87.5    7     66.4   7    2185.1  174.283      126.775  -5.71734    1490.57   -5.71734     
1 1 1 10 14 30 o 0 12.1    9.8   39     9.8  984.212 163.435      249.637  -16.5645    832.398   -16.5645     
1 1 1 3  30 11 o 0 175.3   9     162.8  9    1422.8  -137.369     946.145  -137.369    24.7542   -137.369     
1 1 1 5  30 11 o 0 3.1     6.4   9      6.4  1940.13 -77.5076     1062.69  102.492     2297.87   102.492      
1 1 1 7  30 11 o 0 176.5   9.2   179.2  9.2  1540.33 -91.8727     940.639  -91.8727    22.8482   88.1273      
1 1 1 9  30 11 o 0 371.3   15    362.2  15   3503.28 51.6942      962.57   51.6942     1188.23   -128.306     
1 1 1 11 30 11 o 0 58.4    8.8   78     8.8  678.663 -136.552     140.167  -136.552    268.131   43.4476      
1 1 1 11 13 30 o 0 252.6   13.5  266.2  13.5 2496.54 -118.918     955.428  -118.918    526.887   61.0815      
1 1 1 11 15 30 o 0 150.8   12.6  153.6  12.6 1097.94 106.191      699.938  106.191     69.0995   106.191      
1 1 1 2  30 12 f 1 156.5   9.1   135.1  9.1  2063.41 -105.637     526.363  -105.637    818.193   74.3626      
1 1 1 4  30 12 o 0 381.6   15.1  332.4  15.1 1578.44 163.287      1957.9   163.287     952.136   163.287      
1 1 1 6  30 12 o 0 234.1   10.8  236.6  10.8 1739.67 176.611      1229.6   176.611     140.202   176.611      
1 1 1 10 30 12 o 0 39.6    8     51.6   8    914.233 175.401      65.8713  -4.59921    617.102   -4.59921     
1 1 1 1  30 13 o 0 284.4   12.2  261.5  12.2 1530.32 -113.955     1567.56  -113.955    576.782   -113.955     
1 1 1 3  30 13 o 0 90.6    8.9   74.3   8.9  1980.57 106.915      14.0431  106.915     1247.48   -73.0849     
1 1 1 5  30 13 o 0 162.3   9.9   126.2  9.9  2114.69 30.37        486.962  30.37       837.253   -149.63      
1 1 1 9  30 13 o 0 279     13.7  272.1  13.7 2519.72 -164.902     1042.15  -164.902    478.563   15.0981      
1 1 1 4  30 14 f 1 227.3   12.7  214.7  12.7 3188.56 -42.3849     400.874  -42.3849    1604.56   137.615      
1 1 1 6  30 14 o 0 264.6   13    249.3  13   2406.45 -134.363     1021.69  -134.363    457.385   45.6371      
1 1 1 10 30 14 o 0 265.1   13.1  234.8  13.1 2046.18 151.147      1117.32  151.147     92.842    -28.8528     
1 1 1 1  30 15 o 0 71.4    9     59.6   9    1440.2  126.988      28.1077  126.988     884.586   -53.0123     
1 1 1 3  30 15 o 0 42.8    8.6   67.1   8.6  1491.5  -39.5596     86.7992  140.44      1017.15   140.44       
1 1 1 7  30 15 o 0 87.7    9.6   92.4   9.6  595.28  61.1583      268.419  61.1583     90.2145   -118.842     
1 1 1 2  30 16 o 0 9.7     9.2   -0.2   9.2  1439.16 87.635       748.961  -92.365     1642.9    -92.365      
1 1 1 4  30 16 o 0 105     10.8  104.2  10.8 1007.14 -164.597     448.905  -164.597    166.692   15.4027      
1 1 1 6  30 16 o 0 62.3    11.3  52.7   11.3 821.292 144.21       48.6431  144.21      444.764   -35.7905     
1 1 1 8  30 16 o 0 228.2   13.6  234.9  13.6 2324.33 134.723      884.312  134.723     486.345   -45.2766     
1 1 1 1  30 17 o 0 168.2   12    182.9  12   1753.77 28.1602      840.159  28.1602     242.749   -151.84      
1 1 1 3  30 17 o 0 68.4    10.8  60.3   10.8 1079.02 89.11        86.9093  89.11       569.326   -90.89       
1 1 1 7  30 17 o 0 243     13.5  220.2  13.5 2406.94 29.3452      844.222  29.3452     570.23    -150.655     
1 1 1 9  30 17 o 0 176.1   12.5  161.9  12.5 2469.58 127.624      419.964  127.624     988.968   -52.3763     
1 1 1 2  30 18 o 0 200.2   13.7  191.5  13.7 1290.96 -34.8089     1079.44  -34.8089    299.588   -34.8089     
1 1 1 8  30 18 o 0 83      11.3  85.2   11.3 2058.35 -119.283     41.4274  60.7169     1211.01   60.7169      
1 1 1 10 30 18 o 0 13.5    12.5  11.7   12.5 915.949 42.7863      376.136  -137.214    886.043   -137.214     
1 1 1 3  30 19 o 0 114     12.8  91.7   12.8 1360.34 148.826      334.299  148.826     460.661   -31.1742     
1 1 1 5  30 19 f 1 26.4    12.6  -4.1   12.6 874.486 -54.4634     372.907  125.537     878.685   125.537      
1 1 1 1  2  31 o 0 305.7   11.5  300    11.5 3008.68 -156.615     959.284  -156.615    984.423   23.3852      
1 1 1 1  4  31 o 0 60.8    5.4   48.4   5.4  838.471 151.136      38.1198  151.136     504.857   -28.8643     
1 1 1 1  6  31 f 1 306.6   12.1  296.9  12.1 1737.27 -176.887     1617.36  -176.887    487.908   -176.887     
1 1 1 1  8  31 o 0 84.2    6.3   65.7   6.3  785.742 108.283      223.238  108.283     281.774   -71.7169     
1 1 1 1  10 31 o 0 415.7   15.1  385.3  15.1 2061.14 -22.1918     1920.21  -22.1918    624.696   -22.1918     
1 1 1 1  12 31 o 0 87.4    7.2   93.4   7.2  492.058 107.117      244.982  107.117     59.9349   -72.883      
1 1 1 1  31 2  o 0 383.7   13.5  382.7  13.5 2588.52 -98.1965     1622.66  -98.1965    89.1185   81.8035      
1 1 1 2  3  31 f 1 311     11.8  318.6  11.8 932.364 142.086      1843.43  142.086     1239.25   142.086      
1 1 1 2  5  31 f 1 203.4   9.3   200.8  9.3  1646.87 -100.599     1080.67  -100.599    13.4404   -100.599     
1 1 1 2  7  31 o 0 123.8   7.3   117.5  7.3  1462.25 60.4558      553.056  60.4558     385.455   -119.544     
1 1 1 2  11 31 o 0 411.7   15.2  385.3  15.2 3413.35 -165.008     1167.69  -165.008    952.972   14.992       
1 1 1 2  13 31 o 0 103.7   7.5   117.4  7.5  881.994 110.575      489.48   110.575     49.6379   -69.425      
1 1 1 2  15 31 o 0 124.4   8.1   106.2  8.1  1850.89 103.465      350.91   103.465     757.582   -76.5354     
1 1 1 2  17 31 o 0 -4.1    9.3   -11.5  9.3  1705    -106.684     909.366  73.3156     1895.67   73.3156      
1 1 1 2  31 3  f 1 261.8   10.4  271.2  10.4 1590.13 27.0123      1514.08  27.0123     462.837   27.0123      
1 1 1 3  4  31 o 0 67.7    5.7   63.1   5.7  1768.19 -131.888     83.8914  48.1119     1218.68   48.1119      
1 1 1 3  8  31 o 0 202     9.1   196.6  9.1  1342.68 102.485      1137.65  102.485     293.701   102.485      
1 1 1 3  12 31 o 0 6.2     5.8   2.9    5.8  396.328 149.629      212.961  -30.3709    456.03    -30.3709     
1 1 1 3  14 31 o 0 295.9   12.1  272.5  12.1 2145.51 -62.6968     1268.47  -62.6968    23.4375   117.303      
1 1 1 1  31 4  o 0 16.8    5.3   25.4   5.3  846.306 -163.195     309.458  16.805      870.654   16.805       
1 1 1 4  7  31 f 1 208.2   9.3   207.9  9.3  1734.69 -176.28      1067.73  -176.28     40.6953   3.71971      
1 1 1 4  9  31 o 0 135.2   7.8   135.6  7.8  738.086 -172.599     638.99   -172.599    179.663   -172.599     
1 1 1 4  17 31 o 0 15      9.3   35.5   9.3  1676.91 -153.355     528.091  26.6452     1487.68   26.6452      
1 1 1 4  31 5  o 0 33.3    5.5   26     5.5  1774.09 154.656      560.675  -25.3436    1708.8    -25.3436     
1 1 1 5  6  31 o 0 54.1    5.9   60.2   5.9  836.879 -51.6736     57.053   -51.6736    473.469   128.326      
1 1 1 5  8  31 o 0 93.6    7.1   86.3   7.1  1921.38 22.3488      107.234  22.3488     1087.73   -157.651     
1 1 1 5  10 31 o 0 5.2     6.2   15.7   6.2  607.314 -169.136     289.256  10.8638     662.939   10.8638      
1 1 1 5  12 31 o 0 169.7   9.3   170    9.3  1450.85 -130.836     883.316  -130.836    3.55815   -130.836     
1 1 1 5  14 31 o 0 159.3   9.7   165.2  9.7  2895.67 -31.7144     191.769  -31.7144    1531.8    148.286      
1 1 1 5  16 31 o 0 93.4    10.9  64.6   10.9 201.754 116.91       81.4527  116.91      35.9624   -63.0897     
1 1 1 5  18 31 o 0 6.3     12.3  4.1    12.3 1295.12 153.223      591.628  -26.7771    1318.23   -26.7771     
1 1 1 6  7  31 o 0 55.4    6.3   59.2   6.3  759.424 -60.9554     52.0663  -60.9554    419.553   119.045      
1 1 1 6  9  31 o 0 68.7    6.4   61.4   6.4  1614.37 117.101      31.5823  -62.8991    1025.09   -62.8991     
1 1 1 6  11 31 o 0 186.3   9.8   201.6  9.8  1853.94 148.996      905.335  148.996     220.953   -31.0044     
1 1 1 6  13 31 o 0 48.6    8.1   42.1   8.1  611.833 23.1141      30.49    -156.886    395.991   -156.886     
1 1 1 2  31 7  o 0 382.5   14.2  394.3  14.2 1128.22 -134.333     2252.33  -134.333    1512.99   -134.333     
1 1 1 6  31 7  o 0 209.4   10.4  222.8  10.4 1344.2  -52.131      1238.22  -52.131     396.713   -52.131      
1 1 1 7  12 31 o 0 155     9.8   144.4  9.8  2274.9  -26.2497     419.551  -26.2497    942.953   153.75       
1 1 1 1  31 8  o 0 75.8    6.9   68     6.9  1045.8  -168.726     187.282  -168.726    501.275   11.2745      
1 1 1 7  31 8  o 0 278.5   12.4  277.9  12.4 2061.37 114.672      1308.6   114.672     34.1874   114.672      
1 1 1 8  9  31 o 0 49.3    7.2   47.9   7.2  814.26  -154.489     28.6499  25.5112     523.807   25.5112      
1 1 1 8  13 31 o 0 147.6   10.6  134.3  10.6 459.494 17.7121      475.872  17.7121     204.975   17.7121      
1 1 1 8  15 31 o 0 66.1    10.2  43.2   10.2 772.509 -153.644     2.49648  26.3563     443.867   26.3563      
1 1 1 2  31 9  o 0 279.5   11.6  280.8  11.6 729.44  -8.6965      1546.72  -8.6965     1078.24   -8.6965      
1 1 1 4  31 9  o 0 365.8   14.3  349.2  14.3 1685.89 60.1981      1898.14  60.1981     833.209   60.1981      
1 1 1 8  31 9  o 0 20.6    7.1   31.4   7.1  2367.13 -10.7578     851.608  169.242     2294.73   169.242      
1 1 1 9  10 31 o 0 293.8   13.8  295.2  13.8 2689.82 48.8371      1044.03  48.8371     570.738   -131.163     
1 1 1 9  12 31 o 0 194.2   11.8  212    11.8 1526.84 1.18587      1048.76  1.18587     146.59    1.18587      
1 1 1 9  14 31 f 1 175.5   12.6  158.9  12.6 2559.36 -161.488     378.693  -161.488    1112.51   18.5117      
1 1 1 1  31 10 o 0 189.8   9.5   162.4  9.5  1165.32 170.853      1036.12  170.853     285.816   170.853      
1 1 1 3  31 10 o 0 104.2   7.9   108.6  7.9  1485.63 12.9247      416.035  12.9247     525.065   -167.075     
1 1 1 7  31 10 o 0 346.5   14.5  352.5  14.5 1484.84 133.538      1870.48  133.538     962.041   133.538      
1 1 1 9  31 10 o 0 109.9   8.9   134.5  8.9  1005.38 56.3237      585.831  56.3237     17.6528   -123.676     
1 1 1 10 11 31 o 0 274.2   13.4  270.7  13.4 1780.09 164.189      1341.02  164.189     287.862   164.189      
1 1 1 4  31 11 o 0 326.7   14.5  335.6  14.5 2277.38 -150.66      1481.63  -150.66     60.448    -150.66      
1 1 1 6  31 11 o 0 256     11.4  224.4  11.4 1607.2  49.259       1283.91  49.259      298.269   49.259       
1 1 1 8  31 11 o 0 72.9    8.7   72.3   8.7  712.995 175.104      167.903  175.104     261.324   -4.89626     
1 1 1 1  31 12 o 0 63.4    8     46.2   8    1122.23 -47.486      6.43656  132.514     718.605   132.514      
1 1 1 3  31 12 o 0 167.2   9.6   153.1  9.6  1585.12 -156.216     804.072  -156.216    185.824   23.7844      
1 1 1 5  31 12 o 0 341.4   14.2  337.3  14.2 2444.11 109.97       1412.48  109.97      88.167    -70.03       
1 1 1 7  31 12 o 0 254.4   12.1  254    12.1 1434.07 -138.537     1386.3   -138.537    521.511   -138.537     
1 1 1 9  31 12 o 0 265.1   12.9  251    12.9 2345.11 -88.0153     1018.88  -88.0153    368.133   91.9847      
1 1 1 11 31 12 f 1 281.8   13.8  243.6  13.8 1263.33 33.4969      1412.48  33.4969     676.871   33.4969      
1 1 1 2  31 13 o 0 182.1   10.8  170.9  10.8 2125.97 172.921      693.808  172.921     632.952   -7.07869     
1 1 1 4  31 13 o 0 213.6   14.3  199.7  14.3 920.203 -24.1921     1154.63  -24.1921    589.698   -24.1921     
1 1 1 8  31 13 o 0 79.5    10.4  78.6   10.4 2201.91 -101.23      119.553  78.7696     1423.3    78.7696      
1 1 1 12 31 13 o 0 93.5    12.8  65.7   12.8 813.889 64.8054      172.823  64.8054     284.121   -115.195     
1 1 1 3  31 14 o 0 143.7   11.1  122    11.1 1083.7  -112.08      679.34   -112.08     15.0325   -112.08      
1 1 1 7  31 14 o 0 34.8    9.5   41.2   9.5  1149.27 161.242      199.712  -18.7583    880.052   -18.7583     
1 1 1 2  31 15 o 0 192.8   12.3  161.8  12.3 1173.53 -174.301     991.464  -174.301    274.293   -174.301     
1 1 1 4  31 15 o 0 82.9    11.5  82.8   11.5 1571.64 -144.764     157.55   -144.764    787.63    35.236       
1 1 1 9  31 16 o 0 10.8    11.2  6      11.2 715.884 31.374       318.91   -148.626    721.023   -148.626     
1 1 1 8  31 17 o 0 70.3    11.9  57.8   11.9 1270.05 -126.625     0.821109 -126.625    710.627   53.3749      
1 1 1 1  31 18 o 0 48.2    12.9  89.3   12.9 1200.82 151.309      95.6236  151.309     607.294   -28.6915     
1 1 1 1  32 1  o 0 344.5   12.7  324.2  12.7 2312.77 -66.2654     1490.33  -66.2654    11.1835   -66.2654     
1 1 1 1  3  32 o 0 279.3   10.8  262.4  10.8 2178.48 108.641      1216.21  108.641     130.657   -71.3587     
1 1 1 1  5  32 o 0 245.3   10.4  251.7  10.4 2247.75 -8.62519     1061.61  -8.62519    328.701   171.375      
1 1 1 1  7  32 f 1 38.2    6.4   32.7   6.4  1043.45 -171.359     208.076  8.64139     854.765   8.64139      
1 1 1 1  11 32 f 1 181.6   9.3   160.9  9.3  1506.43 123.22       875.62   123.22      39.7498   -56.7795     
1 1 1 1  15 32 o 0 234.5   11.6  235.2  11.6 3032.28 119.333      533.008  119.333     1215.77   -60.667      
1 1 1 1  17 32 o 0 83      11.3  98.8   11.3 1294.86 13.7857      232.964  13.7857     495.745   -166.214     
1 1 1 2  32 2  o 0 95.8    6.6   87.2   6.6  1264    -36.4        328.577  -36.4       466.255   143.6        
1 1 1 2  4  32 o 0 7.7     5.8   -12.9  5.8  716.433 -157.199     412.478  22.8007     854.013   22.8007      
1 1 1 2  6  32 o 0 86.8    7.1   76.2   7.1  1895.74 -162.958     36.7335  -162.958    1129.43   17.0423      
1 1 1 2  10 32 o 0 56.1    7     70.6   7    1317.29 -176.726     38.8666  -176.726    758.702   3.27369      
1 1 1 2  12 32 o 0 364     14.2  313.1  14.2 2542.72 -36.9041     1327.33  -36.9041    190.675   143.096      
1 1 1 2  14 32 o 0 157.2   9.5   140    9.5  1379.54 54.3646      729.784  54.3646     78.966    -125.635     
1 1 1 2  16 32 f 1 215     12.7  188.7  12.7 896.2   -48.6264     962.051  -48.6264    450.558   -48.6264     
1 1 1 1  32 3  o 0 240.6   10.9  243.8  10.9 3112.93 -150.043     584.394  -150.043    1391.81   29.957       
1 1 1 3  32 3  o 0 73.4    6.2   76.5   6.2  838.049 26.641       202.463  26.641      321.379   -153.359     
1 1 1 3  5  32 o 0 3       5.9   9.3    5.9  1809.97 145.444      956.948  -34.5562    2067.2    -34.5562     
1 1 1 3  7  32 o 0 128.8   8.1   127.8  8.1  1456.94 129.621      587.402  129.621     302.611   -50.3793     
1 1 1 3  9  32 o 0 199.2   10    185.7  10   1577.77 68.166       993.937  68.1659     37.9014   68.1659      
1 1 1 3  11 32 o 0 336.9   13.9  311.4  13.9 2366.37 77.4618      1347.49  77.4618     69.0989   -102.538     
1 1 1 3  13 32 o 0 244     12.1  256.1  12.1 698.26  -102.857     1243.46  -102.857    832.159   -102.857     
1 1 1 3  15 32 o 0 101.2   9.5   105    9.5  1217.18 66.1487      341.383  66.1487     354.125   -113.851     
1 1 1 2  32 4  o 0 46.8    5.8   39.8   5.8  1817.3  -29.5157     374.189  150.484     1520.01   150.484      
1 1 1 4  6  32 o 0 172.2   8.9   179.4  8.9  1365.93 -91.7766     947.95   -91.7766    115.244   -91.7766     
1 1 1 4  8  32 o 0 137.8   9     157.8  9    1319.38 -42.0034     760.668  -42.0034    38.5502   137.997      
1 1 1 4  10 32 o 0 352.2   13.8  325.7  13.8 2589    -31.8112     1306.29  -31.8112    245.918   148.189      
1 1 1 4  12 32 o 0 49.9    8.1   64.7   8.1  1463.2  -171.348     62.1926  8.65158     927.01    8.65158      
1 1 1 4  14 32 o 0 100.3   8.7   85.2   8.7  639.012 127.655      290.462  127.655     80.3868   -52.3446     
1 1 1 1  32 5  o 0 115.7   7.9   117    7.9  1088.23 -55.9027     566.995  -55.9027    124.377   124.097      
1 1 1 3  32 5  o 0 44.9    6.3   52.1   6.3  378.339 125.227      2.23948  125.227     234.362   -54.7734     
1 1 1 5  32 5  o 0 183.3   9.2   189.2  9.2  2933.76 12.2292      334.75   12.2292     1469.9    -167.771     
1 1 1 5  7  32 o 0 210.3   10.1  213.7  10.1 1572.82 -136.346     1112.06  -136.346    160.545   -136.346     
1 1 1 5  11 32 o 0 68.1    7.8   65.1   7.8  870.168 156.954      122.273  156.954     393.173   -23.0459     
1 1 1 5  15 32 o 0 172     12.2  158.7  12.2 1655.38 -71.1344     702.601  -71.1344    233.007   108.866      
1 1 1 2  32 6  o 0 37.3    6.7   43.1   6.7  1439.56 110.205      274.848  -69.7951    1181.19   -69.7951     
1 1 1 6  8  32 o 0 110.6   7.9   96.1   7.9  700.672 169.174      388.794  169.174     31.2364   -10.8261     
1 1 1 6  10 32 o 0 161.6   9.3   163.7  9.3  1529.07 120.153      795.579  120.153     111.197   -59.8471     
1 1 1 6  12 32 f 1 113.5   8.8   108.2  8.8  1282.33 47.4157      460.616  47.4157     292.984   -132.584     
1 1 1 1  32 7  f 1 73      6.9   53.6   6.9  1902.45 171.608      155.628  -8.39182    1366.92   -8.39182     
1 1 1 5  32 7  o 0 54.7    7.2   50.9   7.2  954.087 -95.7779     7.98973  84.2221     592.614   84.2221      
1 1 1 7  32 7  o 0 156.5   9.9   152.6  9.9  1667.37 27.3411      707.955  27.3411     295.753   -152.659     
1 1 1 7  9  32 f 1 55.8    9.2   20.9   9.2  785.283 -168.52      57.5251  11.48       525.91    11.48        
1 1 1 7  11 32 o 0 200.8   11.6  224.3  11.6 1935.99 90.0668      948.845  90.0668     184.533   -89.9332     
1 1 1 7  15 32 o 0 100.8   12.1  82.7   12.1 304.212 81.4939      121.772  81.4939     48.0159   -98.5061     
1 1 1 2  32 8  o 0 77.1    8.2   115.5  8.2  1036.86 -162.232     415.508  -162.232    233.635   17.7684      
1 1 1 4  32 8  o 0 200     10.9  197.8  10.9 2264.04 -163.999     760.632  -163.999    633.758   16.001       
1 1 1 6  32 8  o 0 35.4    7.8   38.8   7.8  336.644 9.91046      46.0795  -170.09     249.85    -170.09      
1 1 1 8  32 8  o 0 31.1    7.9   46.5   7.9  317.774 -140.83      31.504   39.1705     220.316   39.1705      
1 1 1 8  12 32 o 0 136.6   11.1  163.8  11.1 1544.51 -179.287     692.52   -179.287    198.671   0.712606     
1 1 1 3  32 9  o 0 9.7     7.5   21.9   7.5  607.063 -48.0209     249.858  131.979     625.199   131.979      
1 1 1 9  32 9  o 0 117.9   9.8   132    9.8  967.88  -152.683     583.867  -152.683    17.1227   -152.683     
1 1 1 2  32 10 o 0 77.4    8.7   103.1  8.7  1157.25 -145.453     337.392  -145.453    379.997   34.5467      
1 1 1 4  32 10 o 0 171.7   10.1  178.7  10.1 779.506 64.8375      902.616  64.8375     427.255   64.8375      
1 1 1 6  32 10 o 0 175.5   10.1  162.8  10.1 1989.91 -65.6863     679.427  -65.6863    513.03    114.314      
1 1 1 8  32 10 f 1 72.3    8.8   63     8.8  1430.72 140.748      47.2028  140.748     798.931   -39.2525     
1 1 1 10 32 10 o 0 128.2   10.2  130.1  10.2 1420.51 38.2538      567.883  38.2538     250.489   -141.746     
1 1 1 1  32 11 f 1 109.1   8.9   102.3  8.9  627.386 111.924      393.06   111.924     1.47397   111.924      
1 1 1 3  32 11 o 0 -11.7   8.3   6.3    8.3  724.761 54.9327      399.152  -125.067    841.927   -125.067     
1 1 1 5  32 11 o 0 -4.6    8.2   -4.2   8.2  236.286 21.6753      129.159  -158.325    271.09    -158.325     
1 1 1 11 32 11 o 0 -10.5   9.8   -14.6  9.8  2407.45 21.6719      1257.07  -158.328    2605.55   -158.328     
1 1 1 2  32 12 o 0 108.4   9.7   82.4   9.7  1708.16 34.8633      246.365  34.8633     797.595   -145.137     
1 1 1 4  32 12 o 0 224.5   13.9  236.4  13.9 2813.2  -75.7123     648.273  -75.7123    1043.32   104.288      
1 1 1 6  32 12 f 1 19.2    9     -4.3   9    1014.78 -179.096     479.757  0.904269    1082.73   0.904269     
1 1 1 8  32 12 o 0 56.9    9.3   53.6   9.3  1225.89 3.3654       31.9836  -176.635    742.677   -176.635     
1 1 1 10 32 12 o 0 121.1   10.7  102.8  10.7 1022.69 23.625       409.658  23.625      165.135   -156.375     
1 1 1 1  32 13 o 0 226.7   11.8  172.2  11.8 2273.46 -179.609     769.672  -179.609    618.125   0.39068      
1 1 1 3  32 13 o 0 277.6   13.9  275.2  13.9 1451.79 76.0378      1493.73  76.0378     621.097   76.0378      
1 1 1 7  32 13 f 1 236.1   12.6  197.1  12.6 1981.04 -33.7672     944.289  -33.7672    211.943   146.233      
1 1 1 11 32 13 o 0 89.9    11.4  40.9   11.4 1608.69 1.61655      0.811671 -178.383    886.965   -178.383     
1 1 1 10 32 14 o 0 78.2    12.3  65.6   12.3 1602.28 99.2114      1.76145  -80.7886    885.781   -80.7886     
1 1 1 2  32 16 f 1 27.4    11.4  -0.7   11.4 1442.44 -163.69      612.03   16.3098     1453.82   16.3098      
1 1 1 1  2  33 o 0 38.2    7.2   37.6   7.2  997.745 -177.474     164.163  2.52625     759.086   2.52625      
1 1 1 1  4  33 o 0 172.7   9.3   187.2  9.3  3023.14 21.2025      240.142  21.2025     1567.07   -158.797     
1 1 1 1  6  33 o 0 11.8    6.9   -2.2   6.9  619.6   93.9749      316.729  -86.0251    686.566   -86.0251     
1 1 1 1  8  33 o 0 95.7    8.6   121.6  8.6  1525.11 -28.9458     407.034  -28.9458    498.218   151.054      
1 1 1 1  10 33 o 0 99.8    8.6   96.1   8.6  909.93  72.5217      375.984  72.5217     158.888   -107.478     
1 1 1 1  12 33 o 0 84.7    8.3   74.8   8.3  1362.88 -134.306     180.371  -134.306    609.709   45.6941      
1 1 1 1  33 2  o 0 326     12.9  322.3  12.9 3060.56 116.968      1013.42  116.968     865.732   -63.0321     
1 1 1 2  3  33 o 0 9.6     6.8   28.9   6.8  662.59  -65.497      215.219  114.503     609.725   114.503      
1 1 1 2  7  33 o 0 253.8   12.3  272.2  12.3 1964.49 1.27649      1222.22  1.27649     56.6637   1.27649      
1 1 1 2  9  33 o 0 259.6   13    273.6  13   2103.54 -152.46      1169.79  -152.46     68.564    27.5402      
1 1 1 2  33 3  o 0 260.6   11.9  271.1  11.9 1928.93 -74.8207     1287.86  -74.8207    110.085   -74.8207     
1 1 1 3  4  33 o 0 210.5   10.3  195.6  10.3 1888.21 46.3857      924.914  46.3857     195.878   -133.614     
1 1 1 3  8  33 o 0 176.4   10.5  195.1  10.5 1868.39 -42.6029     822.577  -42.6029    277.601   137.397      
1 1 1 3  12 33 o 0 11.9    8.9   32.8   8.9  1037.43 -58.8659     304.747  121.134     901.156   121.134      
1 1 1 1  33 4  o 0 6.9     6.6   -3.7   6.6  150.055 21.1399      82.6185  -158.86     175.021   -158.86      
1 1 1 4  7  33 o 0 96.8    7.8   66.9   7.8  1884.36 142.165      59.5209  142.165     1049.06   -37.8352     
1 1 1 4  9  33 o 0 191     11.2  195.8  11.2 1314.47 61.1172      1025.07  61.1172     258.061   61.1172      
1 1 1 2  33 5  o 0 120.5   7.8   119.4  7.8  431.4   133.029      366.122  133.029     102.518   133.029      
1 1 1 4  33 5  o 0 5       6.8   24.4   6.8  969.066 13.9732      380.7    -166.027    963.398   -166.027     
1 1 1 5  6  33 o 0 363.8   14.6  357.5  14.6 1112.72 -13.731      1909.76  -13.731     1256.4    -13.731      
1 1 1 5  8  33 o 0 117.7   9.3   128.5  9.3  2600.76 -171.469     66.368   -171.469    1450.85   8.5311       
1 1 1 5  10 33 o 0 277.9   13.9  290    13.9 2357.98 -177.734     1115.6   -177.734    245.797   2.26632      
1 1 1 5  14 33 o 0 177.9   11.8  164.1  11.8 2424.82 164.685      439.509  164.685     902.01    -15.315      
1 1 1 1  33 6  o 0 267.8   12.1  284.6  12.1 1661.1  177.148      1460.75  177.148     439.131   177.148      
1 1 1 3  33 6  o 0 20.2    7.3   37.7   7.3  971.001 -68.9615     231.193  111.039     819.13    111.039      
1 1 1 5  33 6  o 0 193.4   10.3  167.2  10.3 2048.6  96.58        724.356  96.58       495.492   -83.42       
1 1 1 2  33 7  o 0 17.6    7.4   38.1   7.4  1765.76 54.7248      516.527  -125.275    1591.82   -125.275     
1 1 1 6  33 7  o 0 165.6   10    161.5  10   718.696 70.0018      772.133  70.0018     348.95    70.0018      
1 1 1 7  8  33 o 0 -8.9    8.5   22.2   8.5  1279.71 -150.304     591.333  29.6958     1330.01   29.6958      
1 1 1 7  10 33 o 0 37.6    10.1  65.4   10.1 1313.02 118.404      60.8298  -61.5955    810.501   -61.5955     
1 1 1 1  33 8  o 0 151.8   9.9   147.4  9.9  1940.81 29.389       578.485  29.389      608.613   -150.611     
1 1 1 3  33 8  o 0 216.5   12.3  227.5  12.3 1622.44 131.345      1148.71  131.345     171.752   131.345      
1 1 1 5  33 8  o 0 107.7   9.7   99.2   9.7  1121.01 17.4209      425.17   17.4209     238.568   -162.579     
1 1 1 7  33 8  o 0 47      8.8   37.9   8.8  1393.15 107.099      211.359  -72.9015    1021.34   -72.9015     
1 1 1 8  9  33 o 0 68.9    10.2  89.5   10.2 1312.06 87.9204      188.887  87.9204     560.192   -92.0796     
1 1 1 2  33 9  o 0 76.1    9     63.9   9    1542.9  -81.5638     44.7397  -81.5638    887.707   98.4362      
1 1 1 4  33 9  o 0 142.6   10.3  117.7  10.3 1675.28 50.2763      527.97   50.2763     468.171   -129.724     
1 1 1 6  33 9  o 0 215.8   12.6  195    12.6 2069.69 80.8317      848.423  80.8317     360.811   -99.1683     
1 1 1 8  33 9  o 0 153.3   11.5  111.6  11.5 1690.68 26.0307      531.268  26.0307     437.821   -153.969     
1 1 1 9  10 33 o 0 220.8   13.2  191.1  13.2 1799.6  8.77838      895.068  8.77838     109.167   -171.222     
1 1 1 5  33 10 o 0 73      9.3   79.2   9.3  453.216 20.5971      143.952  20.5971     121.792   -159.403     
1 1 1 6  33 11 o 0 19.9    9.9   35.2   9.9  535.182 -92.5862     142.251  87.4138     448.136   87.4138      
1 1 1 8  33 11 o 0 155.5   11.7  149    11.7 1627.54 -178.171     618.527  -178.171    293.943   1.8287       
1 1 1 10 33 11 o 0 81.7    11.8  81.6   11.8 215.334 41.139       63.0072  41.139      55.1754   -138.861     
1 1 1 1  33 12 o 0 166.6   11.6  141.4  11.6 2642.5  111.289      271.691  111.289     1306.15   -68.7108     
1 1 1 6  33 13 o 0 105.4   11.4  62.1   11.4 1510.47 114.005      163.381  114.005     686.285   -65.995      
1 1 1 1  33 14 o 0 110.7   11.7  112    11.7 2006.14 172.604      211.893  172.604     951.91    -7.39571     
1 1 1 1  34 1  o 0 94.9    8.7   127.4  8.7  2089.93 -130.796     226.189  -130.796    1012.25   49.2042      
1 1 1 1  7  34 o 0 168     11.2  185.5  11.2 1923.99 -37.2957     726.262  -37.2957    379.78    142.704      
1 1 1 1  9  34 o 0 107.6   9.4   97.1   9.4  1989.38 117.196      176.289  117.196     958.76    -62.8045     
1 1 1 2  6  34 o 0 254.6   12.5  251    12.5 2039.73 -9.61154     1099.17  -9.61154    72.3538   170.388      
1 1 1 2  10 34 o 0 17      8.9   29.6   8.9  1482.26 -68.3909     489.051  111.609     1318.96   111.609      
1 1 1 3  5  34 o 0 173.2   10.5  182.4  10.5 2153.86 -137.718     633.267  -137.718    601.226   42.2825      
1 1 1 4  34 4  o 0 305.1   13.2  277.1  13.2 1641.12 24.0784      1464.66  24.0784     508.861   24.0784      
1 1 1 4  6  34 o 0 84.9    9     75.9   9    1109.66 -131.248     221.621  -131.248    410.992   48.752       
1 1 1 4  8  34 o 0 187.4   11.2  174.3  11.2 660.503 49.8491      808.827  49.8491     434.558   49.8491      
1 1 1 4  12 34 o 0 174.4   12.6  179    12.6 1203.97 -0.815598    821.268  -0.815598   161.932   -0.815598    
1 1 1 1  34 5  o 0 149     10.5  177.3  10.5 586.507 82.942       702.087  82.942      352.43    82.942       
1 1 1 5  7  34 o 0 118.2   10.1  124.3  10.1 782.302 98.037       504.186  98.037      61.2924   98.037       
1 1 1 5  13 34 o 0 99.5    11.5  118.6  11.5 2117.11 -66.6826     145.832  -66.6825    998.098   113.317      
1 1 1 4  34 6  o 0 237.5   12.4  241.2  12.4 2180.04 176.721      980.76   176.721     287.236   -3.27907     
1 1 1 6  34 6  o 0 173.8   11.3  172.5  11.3 1383.55 69.2982      867.603  69.2982     76.8694   69.2982      
1 1 1 6  8  34 o 0 43.2    9.6   49     9.6  402.617 -131.941     31.3922  48.0592     255.101   48.0592      
1 1 1 3  34 7  o 0 86.8    9.1   60.1   9.1  1313.85 16.3253      147.902  16.3253     620.919   -163.675     
1 1 1 5  34 7  o 0 214.7   12    227.9  12   2871.86 -60.4626     542.768  -60.4626    1109.69   119.537      
1 1 1 7  34 7  o 0 167.2   11.3  168.9  11.3 1116.43 -0.0630877   783.574  -0.0630877  159.295   -0.0630877   
1 1 1 4  34 8  o 0 123.3   11.3  96.1   11.3 1616.74 -13.2578     378.621  -13.2578    556.676   166.742      
1 1 1 10 34 10 o 0 62.1    12.1  82.9   12.1 2022.56 -109.603     117.918  70.3968     1199.45   70.3968      
1 1 1 5  34 11 o 0 82.2    12.2  36.5   12.2 1677.51 59.8353      75.6609  -120.165    1013.08   -120.165     
1 1 1 1  34 13 o 0 1.9     12.1  6.2    12.1 1039.3  -28.14       485.012  151.86      1074.85   151.86       
1 1 1 1  2  35 o 0 16      9.2   51.3   9.2  1542.71 18.7603      273.845  -161.24     1129.65   -161.24      
1 1 1 1  6  35 o 0 67.2    9.6   60.9   9.6  2154.01 -162.5       262.016  17.5        1446.55   17.5         
1 1 1 2  9  35 o 0 156.4   11.8  172.9  11.8 848.608 73.1224      695.291  73.1224     234.39    73.1224      
1 1 1 2  35 3  o 0 38.9    9     19.3   9    634.924 150.627      130.254  -29.3728    493.341   -29.3728     
1 1 1 3  4  35 o 0 231     12.4  205.2  12.4 2891.45 -23.6076     489.228  -23.6076    1094.56   156.392      
1 1 1 3  6  35 o 0 258.2   13    237.7  13   3009.41 92.9429      582.706  92.9429     1062.78   -87.0571     
1 1 1 3  35 4  o 0 125.7   10.9  122.3  10.9 1302.55 -46.7041     484.483  -46.7041    247.929   133.296      
1 1 1 4  5  35 o 0 189.3   11.7  191.1  11.7 2568.04 142.133      480.887  142.133     920.384   -37.8669     
1 1 1 4  7  35 o 0 17.2    10.4  11.6   10.4 1721.58 -3.37056     699.883  176.629     1635.54   176.629      
1 1 1 4  9  35 o 0 187.8   12.6  149.3  12.6 1375.04 -157.902     756.301  -157.902    14.8557   -157.902     
1 1 1 2  35 5  f 1 110.1   10.8  84.7   10.8 1294.47 -129.587     292.756  -129.587    444.91    50.4135      
1 1 1 4  35 5  o 0 226.5   12.4  196.5  12.4 2459.85 2.83649      663.819  2.83649     708.025   -177.164     
1 1 1 5  8  35 o 0 93.6    11.8  123.8  11.8 1738.89 51.403       275.024  51.403      662.802   -128.597     
1 1 1 5  10 35 o 0 44.3    11.3  39.2   11.3 314.109 54.8386      36.1259  -125.161    203.837   -125.161     
1 1 1 1  35 6  o 0 136.5   11.1  129.8  11.1 376.408 -4.75625     305.854  -4.75625    91.2115   -4.75625     
1 1 1 5  35 6  o 0 150.9   12.7  165.5  12.7 704.933 -44.115      611.805  -44.115     222.466   -44.115      
1 1 1 6  7  35 f 1 136.3   11.5  150.6  11.5 1805.64 -9.50222     486.092  -9.50222    492.243   170.498      
1 1 1 2  35 7  o 0 197.4   12.4  191    12.4 1528.5  3.42505      910.582  3.42505     47.1652   3.42505      
1 1 1 4  35 7  o 0 49.1    10.7  25.4   10.7 1161.71 -154.516     207.206  25.4839     853.037   25.4839      
1 1 1 6  35 7  f 1 17.7    10.6  12.9   10.6 1180.41 -172.322     468.913  7.67849     1117.22   7.67849      
1 1 1 7  8  35 o 0 71.6    11.4  67.6   11.4 1851.87 -12.5952     97.4594  167.405     1086.39   167.405      
1 1 1 1  35 8  o 0 51.8    11.1  66.7   11.1 666.102 -50.6494     26.6625  -50.6494    351.168   129.351      
1 1 1 1  36 1  o 0 136.1   11.2  122    11.2 1226.01 90.5667      516.087  90.5667     155.849   -89.4333     
1 1 1 1  5  36 o 0 54.1    11.8  101.3  11.8 2172.38 62.1863      86.9959  -117.814    1238.91   -117.814     
1 1 1 1  7  36 o 0 34.1    11.7  94.7   11.7 701.988 -104.556     127.441  -104.556    243.594   75.4435      
1 1 1 1  36 3  o 0 93      11.3  83.8   11.3 1691.78 -75.3017     118.703  -75.3017    813.436   104.698      
1 1 1 1  36 5  o 0 14.5    11.2  30     11.2 818.755 -119.048     266.808  60.9519     718.449   60.9519      
1 1 1 5  7  36 o 0 41.8    11.7  56.8   11.7 502.001 -21.812      20.0563  158.188     282.183   158.188      
1 1 1 4  36 6  o 0 22.7    12    14.6   12   1573.18 44.5872      576.839  -135.413    1424.01   -135.413     
1 1 1 6  36 6  o 0 20.8    11.2  56.5   11.2 1004.09 -87.209      121.525  92.791      652.639   92.791       
1 1 1 2  3  3  o 0 2458.8  159.3 ?      ?    4249.45 150.719      4664.3   150.719     2276.68   150.719      
1 1 1 0  2  4  < 0 -0.1    0.1   ?      ?    ?       ?            1013.18  1.49048e-14 ?         ?            
1 1 1 1  4  1  < 0 0       0.1   ?      ?    ?       ?            4434.95  -94.9259    ?         ?            
1 1 1 1  3  4  o 0 550.9   31.5  ?      ?    4830.9  92.2713      547.701  92.2713     2099.21   -87.7287     
1 1 1 1  4  3  < 0 -0.2    0.1   ?      ?    ?       ?            1523.17  -30.9618    ?         ?            
1 1 1 0  4  4  f 1 3506.4  276   ?      ?    3637.96 -180         4414.94  180         2307.41   180          
1 1 1 2  4  4  o 0 1170.7  46.8  ?      ?    5967.61 -87.7919     1485.01  -87.7919    1775.36   92.2081      
1 1 1 0  1  5  < 0 -0.2    0.2   ?      ?    ?       ?            502.728  -90         ?         ?            
1 1 1 0  3  5  o 0 290.8   15.3  ?      ?    768.251 -90          721.686  -90         278.556   -90          
1 1 1 1  2  5  o 0 2031.5  92.6  ?      ?    8832.22 172.996      1500.9   172.996     3329.73   -7.00364     
1 1 1 1  5  2  o 0 2361.3  118.1 ?      ?    5668.96 -132.51      3671.08  -132.51     578.223   -132.51      
1 1 1 2  3  5  f 1 4303.6  195.4 ?      ?    6291.52 -41.0598     5713.48  -41.0598    2269.73   -41.0598     
1 1 1 0  5  3  o 0 1453.3  81.8  ?      ?    1662.98 -90          2815.17  -90         1867.01   -90          
1 1 1 2  5  3  f 1 4422    246.4 ?      ?    8210.57 146.043      4820.3   146.043     304.435   146.043      
1 1 1 3  4  5  o 0 2856    120.7 ?      ?    3923.47 -115.779     5328.77  -115.779    3158.26   -115.779     
1 1 1 1  5  4  o 0 6516.9  510   ?      ?    9404.08 95.8629      6084.51  95.8629     945.342   95.8629      
1 1 1 3  5  4  o 0 3952.1  166.4 ?      ?    2266.4  24.1541      7483.29  24.1541     6224.28   24.1541      
1 1 1 0  5  5  o 0 119.3   6.1   ?      ?    4290.06 90           795.64   90          1654.87   -90          
1 1 1 0  2  6  o 0 51.7    3.1   ?      ?    2942.56 -3.39503e-15 414.676  0           1269.72   180          
1 1 1 0  4  6  f 1 1550.6  66    ?      ?    5941.27 -3.59235e-14 2931.6   0           485.371   180          
1 1 1 1  6  1  o 0 4333    278.2 ?      ?    8041.78 154.651      4786.51  154.651     422.039   154.651      
1 1 1 1  3  6  o 0 1313.8  42.8  ?      ?    2959.92 -151.342     3290.25  -151.342    1672.51   -151.342     
1 1 1 1  5  6  o 0 1495.9  48.9  ?      ?    2751.97 -131.724     3722.81  -131.724    2221.71   -131.724     
1 1 1 0  6  2  o 0 228.4   13.6  ?      ?    3901.73 3.62525e-14  1097.38  0           1093.45   -180         
1 1 1 2  6  2  o 0 1624.8  57.8  ?      ?    5154.65 54.4258      2773.03  54.4258     39.8345   -125.574     
1 1 1 0  6  4  f 1 1348.6  62.1  ?      ?    3368.3  180          2708.88  180         789.209   -180         
1 1 1 1  6  5  o 0 3518.6  108.8 ?      ?    4151.79 143.206      5969.59  143.206     3708.98   143.206      
1 1 1 3  6  5  o 0 1548.7  58    ?      ?    2000.66 88.8882      4085.58  88.8883     3003.69   88.8883      
1 1 1 5  6  5  o 0 1538.6  61.3  ?      ?    3424.44 -20.5126     3676.7   -20.5126    1706.84   -20.5126     
1 1 1 0  6  6  o 0 972     45.2  ?      ?    4949.78 -4.71456e-14 2294.45  0           503.805   180          
1 1 1 2  6  6  o 0 3436.9  115.6 ?      ?    5352.06 35.1471      5157     35.1471     2297.65   35.1471      
1 1 1 6  6  6  o 0 3270.5  211.2 ?      ?    7436.75 -96.9596     3969.57  -96.9596    353.257   83.0404      
1 1 1 0  1  7  o 0 17.2    1.2   ?      ?    2010.67 90           117.345  90          1018.55   -90          
1 1 1 0  3  7  o 0 17.2    1.4   ?      ?    6685.15 90           267.908  90          3533.74   -90          
1 1 1 0  5  7  f 1 1117    51.8  ?      ?    2973.57 90           2461.52  90          769.382   90           
1 1 1 0  7  1  o 0 56.8    3.1   ?      ?    2638.32 -90          405.492  -90         1052.05   90           
1 1 1 1  7  2  o 0 1699.9  51.2  ?      ?    3347.28 -116.681     3776.8   -116.681    1967.31   -116.681     
1 1 1 2  3  7  o 0 2763.3  93.3  ?      ?    4026.61 -151.393     4997.73  -151.393    2839      -151.393     
1 1 1 0  7  3  o 0 686.5   32.3  ?      ?    1604.21 -90          1846.58  -90         948.755   -90          
1 1 1 3  4  7  o 0 6109.4  256.2 ?      ?    9826.32 50.3314      5539.94  50.3314     262.82    50.3314      
1 1 1 3  6  7  o 0 1481.8  52.8  ?      ?    7178.06 -29.4672     1411.26  -29.4672    2396.17   150.533      
1 1 1 1  7  4  o 0 2590.1  80.4  ?      ?    6556.13 77.0118      3517.94  77.0118     35.1723   -102.988     
1 1 1 3  7  4  o 0 1864.8  66.1  ?      ?    3349.49 -34.1082     4047.22  -34.1082    2237.25   -34.1082     
1 1 1 0  7  5  f 1 1312.9  60.7  ?      ?    1406.54 -90          2613.67  -90         1819.05   -90          
1 1 1 2  7  5  o 0 4137.9  133.2 ?      ?    3994.54 -133.832     6620.02  -133.832    4488.26   -133.832     
1 1 1 5  7  6  o 0 2968.3  110.5 ?      ?    6663.89 -18.628      3463.95  -18.628     306.417   -18.628      
1 1 1 0  7  7  o 0 634     29.9  ?      ?    2231.53 -90          1815.48  -90         569.257   -90          
1 1 1 0  8  0  o 0 6888.8  766.8 ?      ?    10120.2 1.35137e-13  5741.44  0           237.799   -3.12762e-12 
1 1 1 0  2  8  o 0 112.5   6.3   ?      ?    563.634 -180         219.94   180         97.0863   2.01974e-12  
1 1 1 0  4  8  o 0 91.6    4.8   ?      ?    1472.3  2.99125e-13  418.081  0           411.189   -180         
1 1 1 0  6  8  o 0 15.1    1.1   ?      ?    226.348 -180         12.0832  180         114.404   1.14359e-12  
1 1 1 0  8  2  o 0 280.4   13.5  ?      ?    3040.62 -1.52924e-13 1185.72  0           491.088   180          
1 1 1 2  8  2  o 0 3115.1  100.4 ?      ?    4804.89 -114.443     5051.3   -114.443    2481.13   -114.443     
1 1 1 2  4  8  o 0 1552.3  50.4  ?      ?    4560.67 128.722      2874.76  128.722     449.264   128.722      
1 1 1 1  8  3  o 0 1748.8  54.7  ?      ?    6896.37 -70.4572     2045.89  -70.4572    1665.5    109.543      
1 1 1 0  8  4  o 0 4232.8  192.6 ?      ?    7453.57 -180         4701.18  180         557.821   180          
1 1 1 4  6  8  o 0 2181.8  86.7  ?      ?    5252.89 -85.1489     3030.26  -85.1489    635.784   -85.1489     
1 1 1 5  8  5  o 0 1169.6  46.8  ?      ?    4299.03 -56.7769     2031.93  -56.7769    3.23659   123.223      
1 1 1 0  8  6  o 0 218.8   10.7  ?      ?    2772.9  -180         1031.43  180         509.082   1.0315e-13   
1 1 1 2  8  6  f 1 1976.3  61.6  ?      ?    4208.4  82.7851      3713.74  82.785      1476.95   82.785       
1 1 1 6  8  6  f 1 2785.7  110.1 ?      ?    5976.89 115.448      3577.91  115.448     709.296   115.448      
1 1 1 5  8  7  o 0 1113.4  42    ?      ?    4576.84 50.7363      1751.25  50.7363     347.922   -129.264     
1 1 1 7  8  7  o 0 1295.8  46.2  ?      ?    5966.47 50.6716      1526.07  50.6716     1333.8    -129.328     
1 1 1 0  8  8  o 0 325.8   15.5  ?      ?    3768.27 5.66558e-15  1111.56  0           675.306   -180         
1 1 1 2  8  8  o 0 3099.2  96.2  ?      ?    5063.01 144.845      4132.95  144.845     1849.42   144.845      
1 1 1 0  1  9  f 1 896.4   41.9  ?      ?    1886.79 90           2143.89  90          1091.93   90           
1 1 1 0  3  9  o 0 2936.3  147.1 ?      ?    3228    90           3930.61  90          2129.55   90           
1 1 1 0  5  9  o 0 1046.5  44.9  ?      ?    1254.97 -90          2255.93  -90         1557.5    -90          
1 1 1 0  7  9  o 0 2553    117.1 ?      ?    4946.37 90           3117.76  90          771.454   90           
1 1 1 0  9  1  f 1 949.5   38.3  ?      ?    742.923 90           1760.59  90          1354.94   90           
1 1 1 1  2  9  o 0 3805.8  134.1 ?      ?    7361.33 125.969      4573.92  125.969     614.745   125.969      
1 1 1 1  4  9  o 0 3021.5  97.5  ?      ?    7217.47 75.8251      3719.12  75.8251     167.994   -104.175     
1 1 1 1  6  9  o 0 2332.6  75.5  ?      ?    5091.59 -77.697      3333.64  -77.697     982.641   -77.697      
1 1 1 1  8  9  o 0 1220    39.9  ?      ?    3650.76 -127.172     2319.97  -127.172    651.159   -127.172     
1 1 1 1  9  2  o 0 3181.5  95.1  ?      ?    6717.2  -21.9451     4143.37  -21.9451    560.494   -21.9451     
1 1 1 2  3  9  o 0 1580    51.5  ?      ?    5052.91 -73.6178     2661.88  -73.6178    10.243    106.382      
1 1 1 2  5  9  o 0 1955.1  63.5  ?      ?    4502.44 115.391      3047.47  115.391     1003.46   115.391      
1 1 1 0  9  3  o 0 2365    100.3 ?      ?    4535.85 -90          3471.62  -90         983.418   -90          
1 1 1 3  4  9  o 0 2660.2  86.1  ?      ?    4030.08 56.5195      4764.81  56.5195     2645.97   56.5195      
1 1 1 3  8  9  o 0 3608    121.8 ?      ?    6740.02 -109.649     3857.63  -109.649    865.473   -109.649     
1 1 1 1  9  4  o 0 3845.9  114.8 ?      ?    4672.73 157.794      5978.84  157.794     3480.07   157.794      
1 1 1 4  5  9  o 0 7990.5  334.6 ?      ?    10636.6 -41.9545     5617.04  -41.9545    795.015   -41.9545     
1 1 1 0  9  5  o 0 344.2   16.5  ?      ?    2657.28 90           1308.35  90          154.621   -90          
1 1 1 2  9  5  o 0 3090.8  92.4  ?      ?    5652.61 27.4377      3892.24  27.4377     1329.17   27.4377      
1 1 1 4  9  5  o 0 1856.9  69.8  ?      ?    4901.15 105.27       2757.63  105.27      521.038   105.27       
1 1 1 5  6  9  o 0 1088    43.8  ?      ?    3786.98 -126.267     2023.8   -126.267    299.25    -126.267     
1 1 1 1  9  6  o 0 3407.8  105.6 ?      ?    6782.53 -63.6616     3776.72  -63.6616    658.428   -63.6616     
1 1 1 5  9  6  o 0 1395.7  52.6  ?      ?    4057.65 31.7268      2445.54  31.7268     586.352   31.7268      
1 1 1 0  9  7  o 0 7.8     0.9   ?      ?    419.135 90           9.69931  90          188.182   -90          
1 1 1 7  8  9  o 0 1393    52.6  ?      ?    4471.13 -67.4646     2835.71  -67.4646    272.188   -67.4646     
1 1 1 5  9  8  o 0 4692.4  174.1 ?      ?    6673.5  133.41       6101.03  133.41      2375.64   133.41       
1 1 1 0  9  9  o 0 16.6    1.7   ?      ?    1385.95 90           66.0429  90          580.739   -90          
1 1 1 0  10 0  o 0 752.1   43.2  ?      ?    6886.88 -1.09208e-13 1906.29  0           1773.7    180          
1 1 1 0  2  10 o 0 44.8    2.9   ?      ?    307.939 180          47.9675  180         121.603   -2.56352e-13 
1 1 1 0  4  10 o 0 3362.2  167.7 ?      ?    7944.45 -3.84914e-14 3581.56  0           193.868   180          
1 1 1 0  6  10 o 0 1196.3  51.2  ?      ?    3067.98 -180         2127.69  180         677.96    180          
1 1 1 0  8  10 o 0 690.6   32.6  ?      ?    2680.14 3.97091e-14  1593.37  0           342.567   -1.44989e-13 
1 1 1 1  10 1  o 0 7150.3  250.6 ?      ?    10682.5 -78.3222     5883.18  -78.3222    245.617   -78.3222     
1 1 1 1  3  10 f 1 1411.2  48.1  ?      ?    4037.3  -64.8615     2480.68  -64.8615    612.297   -64.8615     
1 1 1 1  5  10 o 0 1827.3  59.4  ?      ?    3977.65 70.3003      3131.78  70.3003     1303.86   70.3003      
1 1 1 1  9  10 o 0 2097.7  68.3  ?      ?    5704.2  -30.3816     3371.55  -30.3816    159.083   -30.3816     
1 1 1 0  10 2  o 0 901.7   39    ?      ?    1362.69 2.85785e-13  2036.08  0           1299.6    -1.61954e-13 
1 1 1 2  6  10 o 0 1303.6  42.5  ?      ?    5916.91 60.955       1464.96  60.955      1193.29   -119.045     
1 1 1 2  8  10 o 0 1339.8  45.9  ?      ?    6147.17 127.31       1762.12  127.311     1656.98   -52.6895     
1 1 1 3  10 3  o 0 1709.9  55.7  ?      ?    4324.3  -104.407     2772.99  -104.407    817.76    -104.407     
1 1 1 3  7  10 o 0 2244.2  79.9  ?      ?    7939.92 -34.1163     1870.71  -34.1163    1645.58   145.884      
1 1 1 0  10 4  o 0 33.7    2.2   ?      ?    2411.87 -1.17924e-13 209.713  0           920.18    180          
1 1 1 4  10 4  o 0 1199.3  41.1  ?      ?    5429.67 112.515      1517.44  112.515     947.276   -67.4848     
1 1 1 4  6  10 o 0 977.7   37.5  ?      ?    4246.09 178.191      1592.12  178.191     296.996   -1.80902     
1 1 1 4  8  10 o 0 2926.3  109.4 ?      ?    4439.36 -140.09      5117.4   -140.09     2682.88   -140.09      
1 1 1 1  10 5  o 0 2734.2  85    ?      ?    5625.6  -151.332     3538.11  -151.332    969.758   -151.332     
1 1 1 3  10 5  o 0 1912.5  64.9  ?      ?    5530.32 -173.26      2514.76  -173.26     37.6911   -173.26      
1 1 1 5  10 5  o 0 9214.9  340.1 ?      ?    12497.9 -8.46384     5600.35  -8.46384    102.155   171.536      
1 1 1 5  7  10 o 0 2764.3  109.8 ?      ?    6923.95 -167.781     3642.67  -167.781    202.001   12.2192      
1 1 1 5  9  10 o 0 1720.4  64.7  ?      ?    5888.68 13.2896      2551.78  13.2896     657.315   -166.71      
1 1 1 0  10 6  o 0 5023.5  228.1 ?      ?    6299.99 1.77936e-14  4313.45  0           1362.65   -3.85318e-14 
1 1 1 2  10 6  o 0 1867.9  56.1  ?      ?    3860.08 83.0668      3159.98  83.0668     1428.87   83.0668      
1 1 1 1  10 7  o 0 3204.4  103.6 ?      ?    8410.18 -159.532     2802.44  -159.532    1021      20.4684      
1 1 1 3  10 7  o 0 1291.5  40.4  ?      ?    6560.46 -46.1775     1150.67  -46.1775    1756.46   133.822      
1 1 1 5  10 7  o 0 1228.3  46.4  ?      ?    5167.74 -73.9686     2062.29  -73.9686    818.973   106.031      
1 1 1 7  9  10 o 0 2214.3  82.8  ?      ?    6471.81 170.2        3087.34  170.2       499.594   -9.8004      
1 1 1 0  10 8  o 0 1469.4  68.1  ?      ?    5834.19 180          2319.5   180         393.024   -5.14189e-14 
1 1 1 4  10 8  o 0 1171.5  40.2  ?      ?    3445.38 -131.105     2786.46  -131.105    894.567   -131.105     
1 1 1 6  10 8  o 0 4456.6  156.9 ?      ?    9611.41 95.9598      4235.33  95.9598     1115.82   -84.0402     
1 1 1 8  10 8  o 0 2813.8  105.5 ?      ?    6371.46 83.0395      4140.78  83.0395     487.344   83.0395      
1 1 1 1  10 9  o 0 2221.9  72    ?      ?    4615.18 103.924      4144.17  103.924     1547.85   103.924      
1 1 1 3  10 9  o 0 2007.2  62.7  ?      ?    6066.37 173.911      2940.33  173.911     375.105   -6.08865     
1 1 1 5  10 9  o 0 1631.1  61.6  ?      ?    4498.64 -19.4861     3118.42  -19.4861    664.543   -19.4861     
1 1 1 9  10 9  o 0 2384.3  84.5  ?      ?    6227.85 44.6763      3899.46  44.6763     26.1724   44.6763      
1 1 1 0  10 10 o 0 2798.7  128.3 ?      ?    5186.03 3.46298e-15  3941.17  0           970.699   -1.05972e-14 
1 1 1 4  10 10 o 0 1407.5  48    ?      ?    2809.36 -147.667     3492.76  -147.667    1977.31   -147.667     
1 1 1 6  10 10 o 0 2152.7  80.9  ?      ?    6019.19 -100.417     3162.7   -100.417    99.1606   79.5827      
1 1 1 10 10 10 o 0 1363.6  89.7  ?      ?    5749.77 35.8409      1930.32  35.8409     1617.48   -144.159     
1 1 1 0  1  11 o 0 911.3   39.2  ?      ?    2963.47 -90          1833.99  -90         450.812   -90          
1 1 1 0  3  11 o 0 193.2   10.4  ?      ?    98.3002 90           56.4525  90          10.3004   90           
1 1 1 0  5  11 o 0 716     33.4  ?      ?    4469.24 -90          1633.35  -90         462.085   90           
1 1 1 0  7  11 o 0 1375.2  58.7  ?      ?    3153.84 -90          2804.63  -90         972.351   -90          
1 1 1 0  9  11 o 0 17      1.4   ?      ?    964.971 90           58.669   90          493.93    -90          
1 1 1 0  11 1  o 0 863.8   35.1  ?      ?    4686.84 -90          1753.14  -90         393.708   90           
1 1 1 1  10 11 o 0 1636.4  53.5  ?      ?    4689.17 -107.923     3079.86  -107.923    481.94    -107.923     
1 1 1 2  7  11 f 1 1164.1  38.1  ?      ?    2922.73 132.975      3039.58  132.975     1410      132.975      
1 1 1 2  9  11 o 0 4132.3  139.1 ?      ?    5392.57 90.8365      6073.62  90.8365     3117.37   90.8365      
1 1 1 0  11 3  o 0 26.1    1.5   ?      ?    1375.58 -90          101.225  -90         534.207   90           
1 1 1 3  8  11 o 0 1478.1  53.1  ?      ?    4648.13 111.199      2766.48  111.199     232.031   111.199      
1 1 1 3  10 11 o 0 1150.2  37.8  ?      ?    4156.18 34.8601      2340.31  34.8601     105.508   34.8601      
1 1 1 4  5  11 o 0 6042.9  202.4 ?      ?    9447.55 -74.8672     4689.96  -74.8672    514.587   -74.8672     
1 1 1 4  7  11 o 0 1438.6  54.3  ?      ?    3715.34 27.9661      3165.94  27.9661     1136.58   27.9661      
1 1 1 0  11 5  o 0 1942.2  89.4  ?      ?    3250.27 90           2656.81  90          1150.92   90           
1 1 1 5  8  11 o 0 1925.3  77    ?      ?    4803.17 -80.8804     3442.26  -80.8804    833.285   -80.8804     
1 1 1 1  11 6  o 0 1611    50.5  ?      ?    5571.42 149.255      2095.95  149.255     419.822   -30.7447     
1 1 1 5  11 6  o 0 1250.6  47.3  ?      ?    2453.5  14.2337      3440.21  14.2337     2077.67   14.2337      
1 1 1 6  7  11 f 1 1189.8  47.8  ?      ?    6607.2  171.332      1179.06  171.332     2488.47   -8.6677      
1 1 1 0  11 7  o 0 310.4   15.4  ?      ?    851.954 90           825.37   90          333.923   90           
1 1 1 2  11 7  f 1 4482.7  133.5 ?      ?    7712.91 22.2341      5252.63  22.2341     960.502   22.2341      
1 1 1 7  8  11 o 0 1680.1  67.5  ?      ?    5445.44 141.845      2747.33  141.845     257.294   -38.1547     
1 1 1 7  10 11 o 0 1085.1  41.2  ?      ?    4395.27 3.64672      2271.34  3.64672     303.583   -176.353     
1 1 1 0  11 9  o 0 741.3   34.9  ?      ?    5035.31 -90          2023.83  -90         851.137   90           
1 1 1 2  11 9  o 0 2784.4  86.5  ?      ?    6565.04 58.3743      3816.61  58.3743     221.044   58.3743      
1 1 1 6  11 9  o 0 1969    70.2  ?      ?    5717.78 -151.756     3034.89  -151.756    63.027    28.2444      
1 1 1 1  11 10 o 0 3705.1  119.5 ?      ?    7494.38 -62.7774     4520.62  -62.7774    372.18    -62.7774     
1 1 1 9  11 10 o 0 909.8   34.8  ?      ?    2226.79 -53.2453     2990.6   -53.2453    1659.97   -53.2453     
1 1 1 0  11 11 o 0 6057.6  275.2 ?      ?    8601.13 90           5677.68  90          847.415   90           
1 1 1 2  11 11 o 0 4084.1  131.6 ?      ?    9956.33 -137.76      3528.86  -137.76     1843.84   42.2402      
1 1 1 4  11 11 o 0 4209.4  141.4 ?      ?    8568.97 93.341       4702.71  93.341      238.345   -86.659      
1 1 1 6  11 11 f 1 1545.6  58.4  ?      ?    5741.7  -58.4751     2436.15  -58.4751    887.788   121.525      
1 1 1 8  11 11 f 1 970     35    ?      ?    1115.01 178.584      3294.77  178.584     2642.37   178.584      
1 1 1 10 11 11 o 0 1357.5  51.6  ?      ?    4237.2  49.471       2982.41  49.471      474.655   49.471       
1 1 1 0  12 0  o 0 563.3   32.5  ?      ?    3511.96 180          1343.67  180         238.032   -1.31119e-13 
1 1 1 0  2  12 f 1 3976.9  181.4 ?      ?    6325.76 2.37741e-16  3791.25  0           849.241   -8.23602e-16 
1 1 1 0  4  12 o 0 1092.1  55.5  ?      ?    5858.82 1.03485e-14  1993.58  0           722.351   -180         
1 1 1 0  6  12 o 0 313.2   15.2  ?      ?    332.996 -3.8214e-14  371.329  0           179.296   4.09288e-14  
1 1 1 0  8  12 o 0 2.3     0.7   ?      ?    1163.21 -4.31238e-14 8.8178   0           654.837   180          
1 1 1 0  10 12 o 0 917.3   42.9  ?      ?    3956.17 180          2213.19  180         7.48295   1.32761e-12  
1 1 1 1  12 1  o 0 1435    43.4  ?      ?    2993.06 37.3297      2859.47  37.3297     1526.09   37.3297      
1 1 1 1  3  12 f 1 1552.8  52.9  ?      ?    4546.33 -110.77      2434.35  -110.77     371.529   -110.77      
1 1 1 1  11 12 o 0 6131.4  197.2 ?      ?    10729.5 109.963      5631.91  109.963     723.956   -70.037      
1 1 1 0  12 2  f 1 486     21.3  ?      ?    1571.01 -2.14631e-13 1220.78  0           502.261   3.07041e-13  
1 1 1 2  4  12 o 0 3099.9  96    ?      ?    7338.88 69.3736      3089.6   69.3736     162.408   -110.626     
1 1 1 2  6  12 o 0 1727.5  54    ?      ?    6713.85 160.793      2156.49  160.793     1544.59   -19.2069     
1 1 1 2  10 12 o 0 1649.4  56.4  ?      ?    5443.71 23.6799      2634.85  23.6799     300.264   -156.32      
1 1 1 1  12 3  f 1 1957.3  57    ?      ?    6341.78 -163.994     2207.54  -163.994    645.047   16.0064      
1 1 1 3  12 3  f 1 2624.6  81.6  ?      ?    7385.05 -82.4369     2529.03  -82.4369    747.826   97.5631      
1 1 1 3  7  12 o 0 1760.9  59.9  ?      ?    5302.48 172.715      2915.55  172.715     37.4575   172.715      
1 1 1 3  9  12 o 0 2281.3  81.2  ?      ?    6396.71 41.3757      3126.93  41.3757     304.905   -138.624     
1 1 1 3  11 12 o 0 8277.2  265   ?      ?    11375.9 -71.7783     6987.52  -71.7783    442.888   -71.7783     
1 1 1 0  12 4  o 0 279     12.6  ?      ?    599.129 -1.00918e-13 449.824  0           175.884   1.5718e-13   
1 1 1 4  8  12 f 1 9464    331.6 ?      ?    12127.2 179.77       6934.26  179.77      389.853   179.77       
1 1 1 5  12 5  f 1 1475.6  52.8  ?      ?    3943.98 -157.742     3142.21  -157.742    954.212   -157.742     
1 1 1 5  7  12 f 1 6547.7  243   ?      ?    9432.62 30.6476      6146.9   30.6476     1022.81   30.6476      
1 1 1 5  9  12 o 0 2527.3  94.6  ?      ?    6358.75 -170.462     3465.02  -170.462    83.5067   -170.462     
1 1 1 0  12 6  o 0 1288.6  59.8  ?      ?    5502.57 2.55309e-15  2668.41  0           474.203   -180         
1 1 1 6  10 12 o 0 1666.5  66.7  ?      ?    3983.19 133.21       3623.68  133.21      1335.14   133.21       
1 1 1 1  12 7  o 0 1573    49.3  ?      ?    3998.22 91.4885      3336.88  91.4885     1110.92   91.4885      
1 1 1 3  12 7  o 0 1825.4  57    ?      ?    4629.35 -112.47      3369.55  -112.47     856.364   -112.47      
1 1 1 7  12 7  o 0 3685.5  145.8 ?      ?    7483.5  171.898      4483.36  171.898     353.673   171.898      
1 1 1 7  9  12 o 0 7312    287.8 ?      ?    9101.34 75.9405      7555.58  75.9405     2243.44   75.9405      
1 1 1 7  11 12 o 0 1426.9  57.5  ?      ?    4996.27 -72.5825     2604.26  -72.5825    241.977   107.418      
1 1 1 0  12 8  o 0 16.4    1.4   ?      ?    240.307 -2.93738e-13 14.1215  0           122.213   180          
1 1 1 2  12 8  o 0 1320.4  41.5  ?      ?    4677.76 12.3873      2453.96  12.3873     97.4677   -167.613     
1 1 1 6  12 8  o 0 1618.5  57.9  ?      ?    5705.5  17.6499      2450.93  17.6499     631.752   -162.35      
1 1 1 8  12 8  o 0 1447.1  58.2  ?      ?    4167.97 -16.1811     3245.93  -16.1811    746.942   -16.1811     
1 1 1 8  10 12 o 0 1388.6  52.8  ?      ?    5350.02 121.053      2382.09  121.053     723.058   -58.9466     
1 1 1 1  12 9  o 0 2012.4  65.7  ?      ?    5987.41 -130.323     3017.22  -130.323    285.038   49.6768      
1 1 1 3  12 9  o 0 1353    40.9  ?      ?    5357.66 15.7569      2131.45  15.7569     742.528   -164.243     
1 1 1 5  12 9  o 0 1521.8  51.8  ?      ?    4834.25 -109.339     2689.2   -109.339    113.681   -109.339     
1 1 1 7  12 9  o 0 1756.8  66.4  ?      ?    4582.99 42.5919      3535.35  42.5919     851.67    42.5919      
1 1 1 9  12 9  o 0 9630.7  355.9 ?      ?    10504.9 -123.566     8844.8   -123.566    2579.06   -123.566     
1 1 1 9  11 12 o 0 2428.1  90.9  ?      ?    5211.31 96.3136      4236.95  96.3136     1235.85   96.3136      
1 1 1 0  12 10 o 0 1934.4  89.2  ?      ?    4824.51 0            3205.35  0           503.386   0            
1 1 1 4  12 10 o 0 1295.7  44.4  ?      ?    5411.72 120.036      2140.88  120.036     976.907   -59.9636     
1 1 1 6  12 10 o 0 2363    84    ?      ?    5304.49 -176.179     4084.77  -176.179    1032.55   -176.179     
1 1 1 8  12 10 o 0 2969.1  111.1 ?      ?    7156.58 -8.0902      3977.93  -8.0902     184.623   171.91       
1 1 1 10 12 10 o 0 2183.2  77.9  ?      ?    6773.85 167.037      3072.81  167.037     934.557   -12.9631     
1 1 1 1  12 11 o 0 2360    76.5  ?      ?    5505.35 -18.2041     4085.53  -18.2041    826.487   -18.2041     
1 1 1 7  12 11 o 0 1641.2  58.7  ?      ?    6585.92 -87.1437     2144.86  -87.1437    1609.91   92.8563      
1 1 1 11 12 11 f 1 2220    78.8  ?      ?    4970.59 1.69264      4092.93  1.69264     1169.17   1.69264      
1 1 1 0  12 12 o 0 204.6   10.4  ?      ?    3906.17 1.36781e-14  1105.33  0           1233.03   -180         
1 1 1 6  12 12 o 0 1290.3  48.8  ?      ?    4321.32 74.5349      2652.26  74.5349     224.863   74.5349      
1 1 1 8  12 12 o 0 1478.9  53.1  ?      ?    3421.39 -104.367     3495.7   -104.367    1565.69   -104.367     
1 1 1 10 12 12 o 0 2415.3  91    ?      ?    6157.94 41.7097      3654.89  41.7097     145.872   41.7097      
1 1 1 12 12 12 o 0 868.5   58.9  ?      ?    3029.69 -121.397     1953.7   -121.397    55.2477   -121.397     
1 1 1 0  1  13 o 0 237.2   10.7  ?      ?    4231.08 -90          1134.95  -90         1267.58   90           
1 1 1 0  3  13 o 0 933.1   43.5  ?      ?    4150.16 -90          2270.34  -90         99.1482   90           
1 1 1 0  5  13 o 0 323.8   17.2  ?      ?    398.603 90           448.706  90          221.308   90           
1 1 1 0  7  13 o 0 587.9   27.8  ?      ?    1163.08 90           1572.79  90          913.937   90           
1 1 1 0  9  13 o 0 836.1   36.3  ?      ?    1880.83 90           2084.59  90          1032.79   90           
1 1 1 0  11 13 o 0 4829.9  220.7 ?      ?    7512.45 -90          5404.51  -90         910.515   -90          
1 1 1 0  13 1  o 0 6.7     0.7   ?      ?    224.004 90           5.28387  90          119.874   -90          
1 1 1 1  8  13 o 0 5994.6  184.8 ?      ?    8327.81 -40.7717     6407.79  -40.7717    1825.37   -40.7717     
1 1 1 1  10 13 o 0 1702.4  55.5  ?      ?    3528.39 -128.023     4039.88  -128.023    1954.17   -128.023     
1 1 1 1  12 13 o 0 2193.2  71.4  ?      ?    4691.31 -97.7958     4188.37  -97.7958    1466.37   -97.7958     
1 1 1 2  5  13 o 0 1579.2  49.5  ?      ?    5717.74 174.458      2404.61  174.458     721.572   -5.54234     
1 1 1 2  7  13 o 0 2438.6  76    ?      ?    4579.13 36.6921      4338.09  36.6921     1850.43   36.6921      
1 1 1 2  9  13 o 0 1351.4  44.3  ?      ?    5013.09 -147.304     2307.55  -147.304    386.333   32.6959      
1 1 1 2  11 13 o 0 4495.3  145.1 ?      ?    8820.48 99.5873      4885.39  99.5873     198.73    -80.4127     
1 1 1 0  13 3  o 0 190.9   8.9   ?      ?    3372.88 -90          991.202  -90         906.902   90           
1 1 1 3  4  13 o 0 2961    92.1  ?      ?    9297.56 130.196      2561.1   130.196     2478.88   -49.8042     
1 1 1 3  6  13 o 0 1941.4  60.6  ?      ?    5494.47 -47.8983     3092.14  -47.8983    130.157   -47.8983     
1 1 1 4  5  13 o 0 1638.2  53.5  ?      ?    5429.26 35.9199      2618.84  35.9199     304.092   -144.08      
1 1 1 4  7  13 o 0 1664.9  56.8  ?      ?    5912.06 -103.541     2393.89  -103.541    759.912   76.4586      
1 1 1 4  9  13 o 0 2034.8  72.6  ?      ?    5630.05 124.096      3372.44  124.096     142.029   124.096      
1 1 1 4  11 13 o 0 1097.1  36.2  ?      ?    3772.62 -91.2054     2538.2   -91.2054    408.508   -91.2054     
1 1 1 0  13 5  o 0 530     25.1  ?      ?    2100.65 90           1660.58  90          475.697   90           
1 1 1 3  13 6  o 0 2400.2  77.9  ?      ?    5443.19 -64.4239     3810.14  -64.4239    874.856   -64.4239     
1 1 1 6  9  13 o 0 1217.4  49.3  ?      ?    4989.1  17.7465      2190     17.7465     664.339   -162.253     
1 1 1 6  11 13 f 1 8594.7  318   ?      ?    11190.6 98.4479      7113.87  98.4479     802.883   98.4479      
1 1 1 0  13 7  o 0 830.8   39    ?      ?    3926.63 -90          2109.23  -90         98.0219   90           
1 1 1 4  13 7  o 0 2924.8  94.5  ?      ?    7457.44 -90.9226     3444.07  -90.9226    542.798   89.0774      
1 1 1 6  13 7  o 0 1732.9  65.3  ?      ?    3433.52 -66.8513     3767.61  -66.8513    1922.47   -66.8513     
1 1 1 7  10 13 o 0 2939.5  117.1 ?      ?    6244.96 -5.09911     4343.25  -5.09911    797.118   -5.09911     
1 1 1 7  12 13 o 0 1310.9  49.9  ?      ?    4345.23 0.313852     2646.23  0.313852    237.019   0.313852     
1 1 1 3  13 8  o 0 1398.7  42.4  ?      ?    4570.03 64.1489      2604.32  64.1489     164.064   64.1489      
1 1 1 8  9  13 o 0 2221.4  88.6  ?      ?    6413.63 125.683      3260.9   125.683     442.637   -54.3173     
1 1 1 8  11 13 o 0 2091.6  78.8  ?      ?    4698.75 -62.5974     3896.07  -62.5974    1250.88   -62.5974     
1 1 1 0  13 9  o 0 18.7    1.6   ?      ?    2654.73 90           158.572  90          1319.63   -90          
1 1 1 6  13 9  o 0 2620.9  88.8  ?      ?    6452.52 77.5325      3826.76  77.5325     124.606   77.5325      
1 1 1 8  13 9  o 0 1223.6  46.5  ?      ?    4152.35 -91.7864     2686.18  -91.7864    278.562   -91.7864     
1 1 1 9  12 13 o 0 1362.4  51.7  ?      ?    3395.88 -107.681     3521.47  -107.681    1464.92   -107.681     
1 1 1 3  13 10 o 0 4085.1  126.4 ?      ?    9055.73 -88.9024     4265.93  -88.9024    931.188   91.0976      
1 1 1 5  13 10 o 0 3402.8  110   ?      ?    7249.44 155.263      4401.3   155.263     285.436   155.263      
1 1 1 7  13 10 o 0 7124    250.3 ?      ?    10736.5 28.9495      6300.24  28.9495     189.603   28.9495      
1 1 1 9  13 10 o 0 1943.6  73    ?      ?    6799.95 -158.132     2578.47  -158.132    1333.9    21.8679      
1 1 1 0  13 11 o 0 2178.6  100.1 ?      ?    3521.34 -90          3627.51  -90         1524.48   -90          
1 1 1 1  13 12 o 0 1791.7  58.5  ?      ?    6443.36 -81.963      2536.83  -81.963     1200.01   98.037       
1 1 1 5  13 12 o 0 930     32.3  ?      ?    5361.61 -177.618     1296.83  -177.618    1685.48   2.38189      
1 1 1 7  13 12 o 0 1608.4  57.6  ?      ?    5579.61 -91.4113     2564.97  -91.4113    530.349   88.5887      
1 1 1 9  13 12 o 0 1054.1  38.3  ?      ?    3636.13 -45.6489     2694.09  -45.6489    490.567   -45.6489     
1 1 1 11 13 12 o 0 827.3   30.2  ?      ?    4176.31 -48.6761     1826.89  -48.6761    725.046   131.324      
1 1 1 0  13 13 o 0 1351.3  63    ?      ?    4695.27 90           2797.79  90          52.3563   90           
1 1 1 2  13 13 o 0 1900.7  61.9  ?      ?    5763.25 -58.1197     3028.06  -58.1197    228.723   121.88       
1 1 1 4  13 13 f 1 2577.3  83.5  ?      ?    4746.31 89.232       4516.58  89.232      1875.67   89.232       
1 1 1 10 13 13 o 0 1086.6  41.6  ?      ?    3626.19 -89.0371     2739.44  -89.0371    571.473   -89.0371     
1 1 1 0  14 0  f 1 5839.9  325.4 ?      ?    8401.47 2.03883e-14  5435.23  0           799.849   -1.18157e-13 
1 1 1 0  2  14 o 0 58.4    3.4   ?      ?    603.653 -180         123.371  180         215.462   6.91534e-13  
1 1 1 0  4  14 o 0 2031.5  93.3  ?      ?    4121.08 2.76271e-14  3299.58  0           980.889   -6.53067e-14 
1 1 1 0  6  14 f 1 840.7   39.2  ?      ?    4949.91 -180         2116.17  180         674.461   2.09272e-13  
1 1 1 0  8  14 o 0 469.4   22.6  ?      ?    3866.79 180          1705.4   180         633.572   -3.92359e-14 
1 1 1 0  10 14 o 0 290.7   14.4  ?      ?    3926.59 2.09453e-14  1319.1   0           1020.84   -180         
1 1 1 0  12 14 f 1 13.5    2     ?      ?    2679.49 3.71424e-14  123.459  0           1450.68   -180         
1 1 1 1  5  14 o 0 2419.6  78.5  ?      ?    2936.44 123.831      5168.47  123.831     3555.31   123.831      
1 1 1 1  7  14 f 1 1419.1  46.5  ?      ?    6330.59 102.21       1766.82  102.21      1709.45   -77.7898     
1 1 1 1  9  14 o 0 1076.6  34    ?      ?    4363.77 -101.994     2278.93  -101.994    287.919   78.0061      
1 1 1 1  11 14 f 1 7251.2  232.6 ?      ?    11104   -45.3227     6281.36  -45.3227    183.234   134.677      
1 1 1 1  13 14 o 0 1827.5  60    ?      ?    4857.56 128.066      3401.92  128.066     647.026   128.066      
1 1 1 0  14 2  o 0 5036    211.9 ?      ?    9306.41 -180         5105.09  180         45.3262   5.30792e-12  
1 1 1 2  6  14 f 1 1842.3  57.6  ?      ?    6412.64 62.0658      2436.67  62.0658     1037.75   -117.934     
1 1 1 2  8  14 o 0 1109.6  36.5  ?      ?    3022.73 -89.2949     3027.22  -89.295     1268.26   -89.295      
1 1 1 2  12 14 o 0 1511.4  49.6  ?      ?    5900.25 -31.0004     2257.28  -31.0004    1073.4    149          
1 1 1 1  14 3  o 0 1240.1  37.6  ?      ?    4152.02 141.631      2561.69  141.631     296.482   141.631      
1 1 1 3  14 3  o 0 1793.5  56    ?      ?    5128.4  -50.2219     3028.13  -50.2219    274.205   -50.2219     
1 1 1 3  5  14 o 0 1180.4  37.3  ?      ?    4170.47 -38.0253     2379.77  -38.0253    151.917   -38.0253     
1 1 1 3  9  14 f 1 1469.2  50.3  ?      ?    4058.36 171.014      3183.45  171.014     851.456   171.014      
1 1 1 0  14 4  o 0 493.9   20.5  ?      ?    2442.92 3.28783e-14  1592.87  0           234.824   -1.90144e-13 
1 1 1 2  14 4  o 0 3901.6  116.3 ?      ?    7927.56 -85.8193     4401.08  -85.8193    125.532   -85.8193     
1 1 1 4  8  14 o 0 3134.3  106.1 ?      ?    8156.32 112.719      3567.38  112.719     1085.46   -67.281      
1 1 1 4  12 14 o 0 3636.7  117.5 ?      ?    8134.04 -135.966     4087.1   -135.966    407.673   44.0337      
1 1 1 3  14 5  o 0 2955.8  95.5  ?      ?    6268.57 -164.757     4099.64  -164.757    749.28    -164.757     
1 1 1 5  14 5  o 0 1147.4  39.4  ?      ?    4669.41 -21.2839     2064.79  -21.2839    429.765   158.716      
1 1 1 5  9  14 o 0 2214.8  83.3  ?      ?    6464.95 -18.3971     3149.31  -18.3971    498.687   161.603      
1 1 1 5  11 14 o 0 1005.5  38.4  ?      ?    3516.46 -146.251     2415.7   -146.251    465.286   -146.251     
1 1 1 0  14 6  f 1 1407.8  65.5  ?      ?    6400.74 2.64283e-15  2713.02  0           863.016   -180         
1 1 1 2  14 6  f 1 1424.2  44.8  ?      ?    5958.58 97.9198      1941.87  97.9198     1277.6    -82.0802     
1 1 1 6  14 6  o 0 3428.5  121.6 ?      ?    7882.25 119.996      4172.7   119.996     404.421   -60.0042     
1 1 1 6  8  14 o 0 2668.3  95.1  ?      ?    7790.48 -105.084     3118.42  -105.084    1309.72   74.9162      
1 1 1 7  14 7  f 1 6831.2  253.3 ?      ?    9623.59 89.1953      6747.81  89.1953     1144.58   89.1953      
1 1 1 7  9  14 o 0 1148.1  46.4  ?      ?    4122.55 -37.0047     2469.7   -37.0047    141.808   -37.0047     
1 1 1 7  11 14 o 0 1763.6  70.9  ?      ?    3525.02 125.802      3882.47  125.802     1933.69   125.802      
1 1 1 0  14 8  o 0 2946.8  135.2 ?      ?    6593.82 -180         4246.27  180         281.151   180          
1 1 1 8  14 8  o 0 1783.7  71.7  ?      ?    6337.68 -168.848     2563.29  -168.848    1089.55   11.1522      
1 1 1 8  12 14 o 0 977.2   37.4  ?      ?    3564.76 96.4355      2492.26  96.4355     373.992   96.4355      
1 1 1 5  14 9  o 0 2865.3  89    ?      ?    5493.3  6.18538      4637.35  6.18538     1531.36   6.18538      
1 1 1 7  14 9  o 0 3318.9  117.6 ?      ?    8205.07 7.98645      3754.94  7.98645     895.161   -172.014     
1 1 1 9  11 14 f 1 966.1   37.1  ?      ?    4067.03 -67.3546     2217.21  -67.3546    251.603   112.645      
1 1 1 9  13 14 f 1 889     34.1  ?      ?    3249.86 158.986      2391.84  158.986     474.737   158.986      
1 1 1 0  14 10 o 0 3898.4  178.3 ?      ?    7104.97 180          4823.78  180         602.886   -180         
1 1 1 2  14 10 o 0 1111.7  35.2  ?      ?    4357.91 13.8872      2305.5   13.8872     194.955   -166.113     
1 1 1 1  14 11 f 1 1881    61.4  ?      ?    6330.33 108.619      2728.77  108.619     951.729   -71.3812     
1 1 1 3  14 11 o 0 3736.4  115.8 ?      ?    7842.55 -102.653     4444.95  -102.653    31.92     -102.653     
1 1 1 7  14 11 o 0 1446.7  52    ?      ?    4831.31 -157.653     2655.37  -157.653    19.9219   22.3468      
1 1 1 0  14 12 f 1 1121.7  53.1  ?      ?    8006.62 -4.47191e-15 2544.07  0           2154.58   180          
1 1 1 8  14 12 o 0 1757.8  63.1  ?      ?    4455.35 132.406      3662.77  132.406     1012.54   132.406      
1 1 1 10 14 12 o 0 1100.9  42.1  ?      ?    4066.57 -34.3848     2532.7   -34.3848    103.399   -34.3848     
1 1 1 5  14 13 o 0 847.5   29.4  ?      ?    3441.54 113.536      2034.73  113.536     164.613   113.536      
1 1 1 7  14 13 o 0 1203.1  43.3  ?      ?    5484.23 -71.6772     1938.85  -71.6772    1279.89   108.323      
1 1 1 9  14 13 f 1 2181.9  77.9  ?      ?    5444.77 102.296      3776.34  102.296     563.006   102.296      
1 1 1 0  14 14 o 0 136.3   7.3   ?      ?    747.363 -2.01332e-13 347.554  0           78.4933   180          
1 1 1 2  14 14 o 0 2302.2  75    ?      ?    4871.54 118.121      4409.73  118.121     1484.69   118.121      
1 1 1 10 14 14 o 0 920.2   35.3  ?      ?    3860.3  60.5501      2129.68  60.5501     100.925   -119.45      
1 1 1 14 14 14 o 0 1594.2  105   ?      ?    3886.8  -145.375     3331.38  -145.375    1155.62   -145.375     
1 1 1 0  1  15 o 0 196.6   9.1   ?      ?    786.637 -90          493.604  -90         60.5063   -90          
1 1 1 0  3  15 o 0 737.8   34.5  ?      ?    3601.87 -90          1956.76  -90         36.5187   90           
1 1 1 0  5  15 o 0 1074.7  49.9  ?      ?    3835.15 90           2360.55  90          239.185   90           
1 1 1 0  7  15 f 1 5962    271.1 ?      ?    8905.89 -90          6007.43  -90         644.548   -90          
1 1 1 0  9  15 o 0 262.1   12    ?      ?    1866.14 90           1122.9   90          18.5076   90           
1 1 1 0  11 15 o 0 124.9   6.9   ?      ?    2453.33 90           737.023  90          690.546   -90          
1 1 1 0  13 15 o 0 2179.1  100.8 ?      ?    5335.87 90           3759.05  90          456.166   90           
1 1 1 0  15 1  o 0 34.8    2     ?      ?    1444.05 90           163.841  90          620.894   -90          
1 1 1 1  12 15 o 0 2715.4  88.2  ?      ?    9016.29 -40.283      2490.37  -40.283     2610.8    139.717      
1 1 1 1  15 2  o 0 2478    71.9  ?      ?    5330.57 104.537      3966.57  104.537     1102.08   104.537      
1 1 1 2  7  15 o 0 1725.3  54.2  ?      ?    4475.32 -159.624     3487.07  -159.624    904.608   -159.624     
1 1 1 2  11 15 o 0 1847.5  60.4  ?      ?    6557.59 -115.889     2493.37  -115.889    1195.26   64.1108      
1 1 1 0  15 3  o 0 1239.1  53.1  ?      ?    3258.21 90           2506.2   90          724.366   90           
1 1 1 2  15 3  o 0 3688.5  110.1 ?      ?    8966.15 69.7617      3564.47  69.7617     1209.56   -110.238     
1 1 1 3  4  15 o 0 2091.8  62.9  ?      ?    4270.76 -98.8361     3869.14  -98.8361    1613.52   -98.8361     
1 1 1 3  10 15 o 0 3081    104.2 ?      ?    7211.35 -105.54      3950.34  -105.54     89.186    74.4605      
1 1 1 3  12 15 o 0 1472.1  48.1  ?      ?    5943.92 128.511      2105.56  128.511     1167.62   -51.4893     
1 1 1 4  5  15 o 0 1971.3  64.1  ?      ?    5380.87 -171.77      3384.77  -171.77     315.017   -171.77      
1 1 1 4  9  15 o 0 1621.6  55.4  ?      ?    3731.93 126.139      3575.91  126.139     1488.7    126.139      
1 1 1 4  11 15 o 0 3325.8  117.9 ?      ?    7997.6  94.7877      3766.89  94.7877     636.933   -85.2123     
1 1 1 0  15 5  o 0 848.5   36.7  ?      ?    6326.44 -90          2077.92  -90         1387.92   90           
1 1 1 2  15 5  o 0 2509.2  75.3  ?      ?    5411.18 -96.7656     3925.55  -96.7656    1049.59   -96.7656     
1 1 1 4  15 5  o 0 1495    48.9  ?      ?    5707.71 96.9782      2362.84  96.9782     903.66    -83.0218     
1 1 1 5  6  15 o 0 1654.7  56.5  ?      ?    4525.7  163.934      3270.81  163.934     705.981   163.934      
1 1 1 5  10 15 o 0 1299.1  49.4  ?      ?    3920.72 15.6487      2826.6   15.6487     662.288   15.6487      
1 1 1 3  15 6  o 0 1507.8  49.3  ?      ?    5027.24 39.7128      2759.21  39.7128     118.827   -140.287     
1 1 1 6  7  15 o 0 3428.1  121.8 ?      ?    5538.23 54.8676      5329.4   54.8676     2208.74   54.8676      
1 1 1 6  9  15 o 0 1532.4  58    ?      ?    5106.11 -69.348      2678.31  -69.348     156.314   110.652      
1 1 1 6  13 15 o 0 1208.5  46.2  ?      ?    4921.02 45.5028      2236.81  45.5028     617.289   -134.497     
1 1 1 0  15 7  f 1 2696.5  123.9 ?      ?    6838.85 -90          4017.46  -90         72.3789   90           
1 1 1 2  15 7  o 0 2269.9  68.3  ?      ?    7010.95 10.5913      2998.07  10.5913     1038.3    -169.409     
1 1 1 7  12 15 o 0 770.1   29.9  ?      ?    1646.85 -78.5712     2754.68  -78.5712    1791.11   -78.5712     
1 1 1 3  15 8  o 0 1264.5  38.5  ?      ?    2945.96 -73.3115     3321.22  -73.3115    1649.91   -73.3115     
1 1 1 5  15 8  o 0 1442.6  49.3  ?      ?    5258.57 -18.3359     2460.24  -18.3359    494       161.664      
1 1 1 7  15 8  o 0 3318.4  124   ?      ?    7423.59 -0.00464108  4156.81  -0.00464108 21.9231   179.995      
1 1 1 8  13 15 o 0 1031.2  42    ?      ?    3988.76 156.386      2326.73  156.386     24.623    156.386      
1 1 1 0  15 9  o 0 252.6   12.8  ?      ?    1307.28 -90          934.907  -90         164.503   -90          
1 1 1 4  15 9  o 0 2438.2  76    ?      ?    6389.44 126.48       3504.89  126.48      72.1098   -53.5203     
1 1 1 6  15 9  o 0 1899.3  67.7  ?      ?    3964.76 -48.9327     3921.08  -48.9327    1713.73   -48.9327     
1 1 1 8  15 9  o 0 3516.6  124.6 ?      ?    8276.34 -78.0304     3906.01  -78.0304    718.907   101.97       
1 1 1 9  10 15 o 0 1001.4  40.8  ?      ?    4718.29 -51.8754     1941.91  -51.8754    889.696   128.125      
1 1 1 1  15 10 o 0 3099.9  100.2 ?      ?    7092.55 -149.85      4147.15  -149.85     69.9531   -149.85      
1 1 1 9  15 10 o 0 839.4   32.3  ?      ?    4021.45 -177.535     1918.08  -177.535    502.783   2.46459      
1 1 1 0  15 11 o 0 101.4   6.1   ?      ?    234.139 -90          86.9984  -90         48.9715   90           
1 1 1 4  15 11 o 0 2542.1  79.2  ?      ?    6094.33 120.528      3754.26  120.528     396.628   120.528      
1 1 1 6  15 11 o 0 1364.8  44.9  ?      ?    5232.2  -74.9107     2256.38  -74.9107    600.13    105.089      
1 1 1 8  15 11 o 0 1091    41.6  ?      ?    2459.53 130.214      3309.21  130.214     1850.8    130.214      
1 1 1 3  15 12 o 0 1064.1  33.7  ?      ?    3401.03 -113.919     2585.94  -113.919    712.973   -113.919     
1 1 1 5  15 12 o 0 1571.3  51.3  ?      ?    4481.19 14.9961      3266.76  14.9961     624.96    14.9961      
1 1 1 7  15 12 o 0 2485.5  84.5  ?      ?    6380.67 -153.955     3740.15  -153.955    2.47978   -153.955     
1 1 1 0  15 13 o 0 380.3   19.1  ?      ?    2910.94 90           1558.3   90          242.563   -90          
1 1 1 8  15 13 o 0 988.2   35.8  ?      ?    3740.93 -138.205     2357.43  -138.205    196.814   -138.205     
1 1 1 10 15 13 f 1 1181.7  42.9  ?      ?    4000.81 -158.859     2649.37  -158.859    326.712   -158.859     
1 1 1 12 15 13 o 0 6108.4  226.7 ?      ?    9277.78 6.63402      6435.25  6.63402     1245.77   6.63402      
1 1 1 13 14 15 o 0 1294.2  47    ?      ?    4231.08 115.137      2848.84  115.137     526.622   115.137      
1 1 1 3  15 14 f 1 2011.8  63    ?      ?    6543.6  73.4414      2868.63  73.4414     988.188   -106.559     
1 1 1 5  15 14 o 0 1052    36.3  ?      ?    3703.29 -15.1732     2522.29  -15.1732    388.004   -15.1732     
1 1 1 9  15 14 o 0 2211.8  78.9  ?      ?    5617.62 126.73       3762.27  126.73      669.74    126.73       
1 1 1 13 15 14 o 0 1105.6  42.5  ?      ?    4377.7  -60.9073     2371.28  -60.9073    31.3936   119.093      
1 1 1 0  15 15 o 0 2448.3  112.7 ?      ?    5992.94 -90          3880.15  -90         266.181   -90          
1 1 1 2  15 15 o 0 1077.6  35.9  ?      ?    4617.57 20.3702      2131.38  20.3702     573.003   -159.63      
1 1 1 4  15 15 o 0 2005.5  65.3  ?      ?    4563.52 80.5917      3898.45  80.5917     1281.57   80.5917      
1 1 1 6  15 15 o 0 1406.9  48.3  ?      ?    3800.97 176.047      3171.86  176.047     1021.9    176.047      
1 1 1 10 15 15 o 0 1097.1  39.7  ?      ?    4147.55 81.6713      2438.13  81.6713     194.23    81.6713      
1 1 1 12 15 15 f 1 1592.7  60.7  ?      ?    3908.23 -81.4709     3518.07  -81.4709    1398.18   -81.4709     
1 1 1 0  16 0  o 0 997.8   57.1  ?      ?    2193.98 -2.55269e-13 2226.88  0           953.593   3.40848e-13  
1 1 1 0  2  16 o 0 879.3   37.9  ?      ?    3768.57 5.6731e-14   2283.67  0           54.7083   -2.31137e-12 
1 1 1 0  4  16 o 0 1046.4  49.1  ?      ?    4213.87 -2.36207e-14 2496.55  0           1.65136   180          
1 1 1 0  6  16 o 0 54.5    3.2   ?      ?    491.133 -180         99.2505  180         191.012   1.96021e-13  
1 1 1 0  8  16 o 0 1732.4  80    ?      ?    3680.76 180          3174.18  180         1017.45   180          
1 1 1 0  10 16 o 0 498.2   22.3  ?      ?    4754.03 -180         1679.56  180         1067.72   2.73397e-14  
1 1 1 0  12 16 o 0 238.4   12.1  ?      ?    1391.53 -2.83281e-14 967.258  0           109.378   2.22184e-13  
1 1 1 0  14 16 o 0 699.9   33.8  ?      ?    4676.59 -6.14437e-16 2073.84  0           742.513   180          
1 1 1 1  11 16 o 0 2810.9  87.4  ?      ?    7744.34 167.309      3313.19  167.309     1046.07   -12.6906     
1 1 1 1  13 16 o 0 2473.5  80.9  ?      ?    6460.38 -59.6129     3765.52  -59.6129    109.706   120.387      
1 1 1 0  16 2  o 0 310.8   13.9  ?      ?    43.2047 -2.57901e-12 49.8196  0           24.5444   2.65581e-12  
1 1 1 2  16 2  o 0 2152.6  67.2  ?      ?    6485.95 -49.8782     3080.49  -49.8782    625.486   130.122      
1 1 1 2  4  16 o 0 2970.2  92.2  ?      ?    6525.44 63.1686      4274.47  63.1686     535.608   63.1686      
1 1 1 2  6  16 f 1 1095.3  36.1  ?      ?    3737.59 -92.3788     2569.58  -92.3788    424.082   -92.3788     
1 1 1 2  8  16 o 0 1071.6  34    ?      ?    5182.77 104.569      1746.99  104.569     1187.38   -75.4309     
1 1 1 2  14 16 o 0 1733    57    ?      ?    3766.83 -163.159     3925.97  -163.159    1722.71   -163.159     
1 1 1 3  9  16 o 0 1364.8  44.7  ?      ?    5723.4  9.09968      2038.75  9.09968     1144.91   -170.9       
1 1 1 3  13 16 o 0 1020.7  35.4  ?      ?    2605.62 124.729      3031.87  124.729     1508.59   124.729      
1 1 1 0  16 4  o 0 239.7   11.1  ?      ?    2166.96 4.91613e-14  1097.27  0           175.314   -180         
1 1 1 2  16 4  o 0 6447.8  191.4 ?      ?    9976.04 107.414      6158.7   107.414     457.637   107.414      
1 1 1 4  16 4  o 0 1318.6  40.1  ?      ?    3820.64 162.855      2987.9   162.855     827.748   162.855      
1 1 1 1  16 5  o 0 1382.8  43.6  ?      ?    3297.37 46.3616      3453.57  46.3616     1548.35   46.3616      
1 1 1 3  16 5  o 0 1394.7  44    ?      ?    5084.52 129.552      2479.25  129.552     399.042   -50.4481     
1 1 1 5  16 5  o 0 2108.8  68.7  ?      ?    6815.96 -95.3212     2785.66  -95.3212    1051.56   84.6788      
1 1 1 5  9  16 o 0 971.8   33.8  ?      ?    2680.91 122.768      2700.06  122.768     1230.43   122.768      
1 1 1 5  13 16 o 0 1852.9  66.3  ?      ?    5679.03 -96.1648     3039.79  -96.1648    224.392   83.8352      
1 1 1 5  15 16 o 0 1708.4  55.9  ?      ?    6060.2  39.4789      2653.04  39.4789     640.202   -140.521     
1 1 1 0  16 6  o 0 773.8   31.7  ?      ?    5231.48 180          2125.52  180         943.876   -2.02188e-14 
1 1 1 2  16 6  f 1 1530.2  46.5  ?      ?    5116.98 -12.7358     2724.13  -12.7358    206.462   167.264      
1 1 1 4  16 6  o 0 2148.4  70    ?      ?    6100.55 -86.9448     3228.68  -86.9448    195.787   93.0552      
1 1 1 6  12 16 o 0 884.7   34.1  ?      ?    3178.23 -175.607     2390.37  -175.607    553.771   -175.607     
1 1 1 6  14 16 o 0 1767.9  66.8  ?      ?    5962.61 -44.8423     2684.67  -44.8423    683.377   135.158      
1 1 1 3  16 7  o 0 11355.4 362.8 ?      ?    13354   -29.6579     7986.65  -29.6579    479.316   -29.6579     
1 1 1 7  13 16 o 0 1097.9  42.2  ?      ?    3695.73 -125.775     2597.89  -125.775    493.787   -125.775     
1 1 1 0  16 8  o 0 330.8   16.2  ?      ?    4803.1  -1.79465e-14 1380.37  0           1420.31   180          
1 1 1 4  16 8  o 0 3451.4  111.8 ?      ?    8021.89 -166.909     3946.47  -166.909    510.028   13.0909      
1 1 1 6  16 8  o 0 1532.3  52.6  ?      ?    5522.39 162.623      2447.16  162.623     603.84    -17.377      
1 1 1 8  14 16 o 0 1612.6  64.8  ?      ?    5158.14 158.36       2946.3   158.36      147.733   158.36       
1 1 1 1  16 9  o 0 1694.5  53.2  ?      ?    4845.6  -17.3238     3192.41  -17.3238    429.532   -17.3238     
1 1 1 3  16 9  o 0 4016.5  120.1 ?      ?    7370.4  -132.499     4975.17  -132.499    875.487   -132.499     
1 1 1 5  16 9  o 0 2169.2  71    ?      ?    5387.89 69.4832      3565.18  69.4832     605.774   69.4832      
1 1 1 9  15 16 o 0 917.4   35.4  ?      ?    4841.72 94.1636      1646.23  94.1636     935.876   -85.8364     
1 1 1 0  16 10 o 0 894.7   42.2  ?      ?    2874.9  1.57176e-15  2243.23  0           586.294   -4.44196e-15 
1 1 1 2  16 10 o 0 5637.1  174.4 ?      ?    9212.97 146.91       5680.5   146.91      533.742   146.91       
1 1 1 6  16 10 o 0 3857.1  136.6 ?      ?    9129.91 -30.0401     3733.54  -30.0401    1224.37   149.96       
1 1 1 8  16 10 o 0 1641.4  58.8  ?      ?    4471.74 130.387      3404.86  130.387     768.229   130.387      
1 1 1 10 16 10 o 0 766     31.8  ?      ?    3355.13 -122.507     2036.85  -122.507    52.1454   -122.507     
1 1 1 10 12 16 o 0 1886.1  75.4  ?      ?    7046.13 69.3393      2488.87  69.3393     1430.44   -110.661     
1 1 1 3  16 11 o 0 1141.2  36.2  ?      ?    5768.29 158.115      1534.11  158.115     1627.86   -21.8849     
1 1 1 9  16 11 o 0 2654.7  100   ?      ?    6891.61 62.0615      3680.46  62.0615     337.04    -117.938     
1 1 1 11 15 16 o 0 657     25.9  ?      ?    2249.98 173.588      2210.39  173.588     1016.52   173.588      
1 1 1 0  16 12 o 0 10.8    2.2   ?      ?    5.06073 -180         0.206722 180         2.91012   1.28604e-11  
1 1 1 4  16 12 f 1 1739.4  52.6  ?      ?    6231.02 107.419      2564.59  107.419     1103.06   -72.5806     
1 1 1 8  16 12 o 0 3254.5  110.2 ?      ?    6377.04 -40.2075     4748.88  -40.2075    1077.51   -40.2075     
1 1 1 12 16 12 f 1 891.8   34.6  ?      ?    3780    -124.722     2202.29  -124.722    84.5192   -124.722     
1 1 1 12 14 16 o 0 880.4   34    ?      ?    5037.34 24.6825      1471.98  24.6825     1241.4    -155.318     
1 1 1 1  16 13 o 0 1449.3  47.7  ?      ?    4933.3  -17.9493     2823.38  -17.9493    135.244   162.051      
1 1 1 3  16 13 o 0 1096.7  34.9  ?      ?    3890.47 88.895       2565.02  88.895      289.975   88.895       
1 1 1 7  16 13 o 0 2199.8  71.9  ?      ?    6352.18 -109.774     3215.86  -109.774    403.746   70.2264      
1 1 1 9  16 13 o 0 834.5   30.7  ?      ?    3424.26 -43.8056     2218.7   -43.8056    337.637   -43.8056     
1 1 1 11 16 13 o 0 2135.8  80.7  ?      ?    5932.75 158.219      3456.14  158.219     202.78    158.219      
1 1 1 0  16 14 o 0 76.5    5     ?      ?    847.2   3.6952e-14   237.02   0           273.146   -180         
1 1 1 8  16 14 o 0 1872.2  67.1  ?      ?    4437.44 -120.124     3775.89  -120.124    1367.14   -120.124     
1 1 1 14 16 14 o 0 777.3   28.6  ?      ?    1943.92 44.046       3329.91  44.046      2034.62   44.046       
1 1 1 5  16 15 o 0 1836.2  62.7  ?      ?    6993.86 33.7624      2379.19  33.7624     1422.28   -146.238     
1 1 1 9  16 15 o 0 1384.8  50    ?      ?    5613.53 174.848      2242.25  174.848     751.988   -5.15181     
1 1 1 0  16 16 o 0 484.6   23.6  ?      ?    2668.62 180          1676.78  180         163.533   -180         
1 1 1 16 16 16 f 1 2846.8  184.8 ?      ?    8059.24 -152.579     3544.74  -152.579    1594.38   27.4211      
1 1 1 0  1  17 o 0 416.4   18.5  ?      ?    3467.9  90           1535.67  90          472.385   -90          
1 1 1 0  3  17 o 0 78.8    4.6   ?      ?    465.325 -90          133.456  -90         137.307   90           
1 1 1 0  5  17 o 0 2875.9  131.8 ?      ?    4531.41 90           4058.56  90          1422.56   90           
1 1 1 0  7  17 o 0 180.1   8.5   ?      ?    714.994 -90          440.932  -90         27.3285   -90          
1 1 1 0  9  17 f 1 369.1   17.8  ?      ?    3339.22 90           1426.13  90          495.457   -90          
1 1 1 0  11 17 o 0 6313.6  265.6 ?      ?    9587.85 90           6318.37  90          448.215   90           
1 1 1 0  13 17 f 1 1886    87.1  ?      ?    6496.59 -90          3387.9   -90         530.275   90           
1 1 1 0  15 17 o 0 1489.3  69.3  ?      ?    5546.61 -90          2935.7   -90         204.657   90           
1 1 1 0  17 1  o 0 3804.8  150.3 ?      ?    6919.11 -90          4603.74  -90         635.184   -90          
1 1 1 1  2  17 o 0 2009.5  62.7  ?      ?    5934.05 152.473      3150.19  152.473     238.605   -27.5266     
1 1 1 1  4  17 o 0 3514.4  113.3 ?      ?    8346.73 -48.9053     3961.55  -48.9053    812.34    131.095      
1 1 1 1  14 17 o 0 1202    39.9  ?      ?    3780.4  171.035      2854.1   171.035     646.936   171.035      
1 1 1 1  16 17 o 0 935.6   31.5  ?      ?    5520.28 -162.264     1386.8   -162.264    1652.81   17.736       
1 1 1 1  17 2  o 0 1345.9  39.4  ?      ?    4399.44 131.834      2755.27  131.834     256.717   131.834      
1 1 1 2  3  17 o 0 3461.8  111.8 ?      ?    7135.53 -149.089     4509.78  -149.089    484.431   -149.089     
1 1 1 2  11 17 o 0 1470.2  46.2  ?      ?    5190.18 -167.486     2694.37  -167.486    387.916   12.5142      
1 1 1 2  15 17 o 0 2006.6  65.9  ?      ?    5802.59 -173.748     3339.51  -173.748    141.423   -173.748     
1 1 1 0  17 3  o 0 8171.8  343   ?      ?    10066.6 90           6774.73  90          967.627   90           
1 1 1 3  4  17 o 0 2195.2  68.7  ?      ?    5593.96 48.4792      3555.44  48.4792     432.801   48.4792      
1 1 1 3  6  17 o 0 3414.8  102   ?      ?    7390.9  156.746      4247.4   156.746     139.967   156.746      
1 1 1 3  8  17 o 0 2359.6  73.8  ?      ?    6184.77 -15.8339     3443.02  -15.8339    34.731    -15.8339     
1 1 1 3  14 17 o 0 3773.1  127.7 ?      ?    8932.69 117.145      3920.64  117.145     1169.16   -62.8553     
1 1 1 1  17 4  o 0 1305.7  38.4  ?      ?    4315.67 -62.573      2723.38  -62.573     267.311   -62.573      
1 1 1 3  17 4  o 0 1349    40.9  ?      ?    4245.95 14.0259      2795.07  14.0259     423.575   14.0259      
1 1 1 4  5  17 o 0 1960.1  59.1  ?      ?    5097.32 -8.89304     3413.8   -8.89304    593.98    -8.89304     
1 1 1 4  9  17 o 0 1050.6  36.5  ?      ?    3686.65 -135.926     2382.45  -135.926    380.349   -135.926     
1 1 1 0  17 5  o 0 126.3   6     ?      ?    345.668 90           158.117  90          41.554    -90          
1 1 1 5  6  17 o 0 4766.7  147.5 ?      ?    8870.37 -41.062      4907.69  -41.062     39.5256   -41.062      
1 1 1 5  8  17 o 0 2297.3  75.1  ?      ?    6419.23 150.519      3178.45  150.519     308.308   -29.4814     
1 1 1 5  12 17 o 0 1717.4  61.7  ?      ?    3829.98 143.364      3777.85  143.364     1586.78   143.364      
1 1 1 5  16 17 o 0 1656.2  54.3  ?      ?    4045.1  -175.251     3506.78  -175.251    1368.93   -175.251     
1 1 1 1  17 6  o 0 1309.8  39.9  ?      ?    5701.1  -3.82409     1983.13  -3.82409    1254.73   176.176      
1 1 1 3  17 6  o 0 1513.2  47.7  ?      ?    5619.72 80.3652      2375.96  80.3652     747.771   -99.6348     
1 1 1 6  7  17 f 1 2100.7  71.5  ?      ?    4002.94 -47.3796     4125.14  -47.3796    1932.27   -47.3796     
1 1 1 6  9  17 o 0 3200.4  113.7 ?      ?    6269.54 104.635      4810.41  104.635     1147.23   104.635      
1 1 1 6  11 17 o 0 764.5   29.7  ?      ?    3066.49 154.269      2117.32  154.269     355.67    154.269      
1 1 1 6  15 17 o 0 1120.3  38.8  ?      ?    4384.1  7.71709      2328.82  7.71709     3.05014   -172.283     
1 1 1 0  17 7  o 0 4194.5  177.6 ?      ?    6945.77 90           4848.34  90          850.502   90           
1 1 1 6  17 7  f 1 2602.9  88.5  ?      ?    4598.46 -112.818     4575.33  -112.818    2045.99   -112.818     
1 1 1 7  10 17 o 0 826     30.2  ?      ?    3431.48 -4.57858     2112.86  -4.57858    129.351   -4.57858     
1 1 1 1  17 8  o 0 1600.2  50.3  ?      ?    5208    51.4502      2794.83  51.4502     143.627   -128.55      
1 1 1 3  17 8  o 0 6614.2  204   ?      ?    9517.71 -92.4321     6329.86  -92.4321    1083.97   -92.4321     
1 1 1 5  17 8  o 0 3316    107.4 ?      ?    7782.13 137.024      3829.34  137.024     407.984   -42.9763     
1 1 1 0  17 9  f 1 1002.2  47.3  ?      ?    4736.47 90           2351.15  90          366.458   -90          
1 1 1 2  17 9  o 0 8296.5  255.6 ?      ?    11064.5 -23.5131     6909.24  -23.5131    780.627   -23.5131     
1 1 1 4  17 9  o 0 1111.6  37    ?      ?    3448.64 66.1809      2632.01  66.1809     756.962   66.1809      
1 1 1 6  17 9  o 0 3069.3  104.4 ?      ?    6292.36 83.8915      4633.89  83.8915     947.657   83.8915      
1 1 1 9  16 17 o 0 643.9   25.1  ?      ?    3986.74 -80.5635     1651.56  -80.5635    907.673   99.4365      
1 1 1 1  17 10 o 0 4933.7  152.7 ?      ?    9652.54 -70.6394     4729.24  -70.6394    655.393   109.361      
1 1 1 3  17 10 o 0 1109.4  35.2  ?      ?    4726.91 171.537      2168.18  171.537     629.224   -8.46331     
1 1 1 5  17 10 o 0 6459.7  199.3 ?      ?    9418.86 -47.5633     6603.94  -47.5633    1110.55   -47.5633     
1 1 1 10 15 17 o 0 1803.4  68.4  ?      ?    3986.94 -63.0196     4644.44  -63.0196    2054.99   -63.0196     
1 1 1 0  17 11 o 0 811.7   38.6  ?      ?    2084.05 -90          2253.95  -90         979.551   -90          
1 1 1 2  17 11 o 0 1036.1  32.9  ?      ?    2526.24 -173.455     3154.34  -173.455    1654.23   -173.455     
1 1 1 4  17 11 o 0 4917    152.4 ?      ?    8560.42 -164.432     5538.68  -164.432    555.75    -164.432     
1 1 1 10 17 11 o 0 1732.2  65.6  ?      ?    5775.02 -75.1521     2894.99  -75.1521    301.667   104.848      
1 1 1 11 14 17 o 0 1520.1  58    ?      ?    3165.92 128.896      4587.34  128.896     2504.86   128.896      
1 1 1 3  17 12 o 0 1649.2  52.1  ?      ?    5476.07 116.847      2825.32  116.847     362.36    -63.1531     
1 1 1 9  17 12 o 0 1698.2  64.5  ?      ?    5797.17 -157.982     2787.86  -157.982    382.212   22.0176      
1 1 1 0  17 13 f 1 449.5   22.1  ?      ?    3242.93 -90          1651.28  -90         304.465   90           
1 1 1 4  17 13 o 0 1471.8  46.4  ?      ?    5247.77 92.2555      2561.51  92.2555     435.145   -87.7445     
1 1 1 12 17 13 o 0 732     28.7  ?      ?    3596.08 174.414      1816.69  174.413     112.769   -5.5865      
1 1 1 1  17 14 o 0 1081    36    ?      ?    3705.01 -62.5119     2622.4   -62.5119    458.503   -62.5119     
1 1 1 5  17 14 o 0 1451.4  47.7  ?      ?    3388.15 10.3996      3551.69  10.3996     1713.8    10.3996      
1 1 1 9  17 14 f 1 3729.5  132.3 ?      ?    8580.38 -13.2121     4056.57  -13.2121    536       166.788      
1 1 1 11 17 14 o 0 1451.5  55    ?      ?    3601.25 149.353      4171.95  149.353     1802.88   149.353      
1 1 1 0  17 15 o 0 112     7     ?      ?    2429.95 -90          750.329  -90         625.967   90           
1 1 1 8  17 15 o 0 1877.3  61.4  ?      ?    5343.19 -138.895     3215.18  -138.895    401.183   -138.895     
1 1 1 1  17 16 o 0 834.4   28    ?      ?    3696.91 140.899      2087.02  140.899     50.8322   140.899      
1 1 1 7  17 16 o 0 1183.8  39.2  ?      ?    4808.12 41.7748      2204.62  41.7748     303.842   -138.225     
1 1 1 9  17 16 o 0 725.6   27    ?      ?    2671.66 142.431      2679.3   142.431     964.1     142.431      
1 1 1 11 17 16 o 0 1280.7  46.5  ?      ?    3397.52 -22.3452     3760.65  -22.3452    1597.47   -22.3452     
1 1 1 15 17 16 o 0 575.2   22.8  ?      ?    2735.15 -93.2365     2074.37  -93.2365    366.371   -93.2365     
1 1 1 0  17 17 o 0 273.8   14.1  ?      ?    1828.5  90           1175.72  90          170.538   90           
1 1 1 10 17 17 o 0 813.6   30.3  ?      ?    2986.49 -133.807     2720.17  -133.807    842.467   -133.807     
1 1 1 12 17 17 o 0 1414.2  53.9  ?      ?    4405.08 -49.6102     3395.08  -49.6102    651.688   -49.6102     
1 1 1 0  18 0  o 0 690.2   40    ?      ?    1411.28 -1.07535e-13 1376.97  0           584.677   1.4572e-13   
1 1 1 0  2  18 o 0 10.9    1.6   ?      ?    1527.33 180          58.1265  180         812.11    -5.42757e-14 
1 1 1 0  4  18 f 1 2156.8  100   ?      ?    7791.12 180          3451.16  180         1023.56   -1.21685e-13 
1 1 1 0  6  18 o 0 30.3    2.4   ?      ?    486.144 180          52.7668  180         224.107   -8.14748e-14 
1 1 1 0  8  18 o 0 678.9   29.7  ?      ?    4748.97 2.9956e-14   1916.99  0           766.305   -180         
1 1 1 0  10 18 o 0 205.6   10.6  ?      ?    2516.59 180          1066.49  180         459.316   -4.25504e-14 
1 1 1 0  12 18 o 0 3237.6  136.8 ?      ?    5942.79 -8.39329e-15 4405.9   0           866.592   3.42796e-14  
1 1 1 0  14 18 o 0 414.6   20.7  ?      ?    3004.23 180          1542.32  180         151.328   -3.07584e-14 
1 1 1 0  16 18 o 0 10      3.3   ?      ?    570.658 -180         24.2558  180         288.908   4.27806e-14  
1 1 1 1  3  18 o 0 4774.7  153.7 ?      ?    9148.69 145.196      4877.56  145.196     261.607   -34.8044     
1 1 1 1  5  18 o 0 1137.7  37.6  ?      ?    4906    90.6361      2023.99  90.6361     729.945   -89.3639     
1 1 1 1  7  18 o 0 1795.2  56.3  ?      ?    5524.26 -139.649     2941.12  -139.649    143.273   40.3511      
1 1 1 0  18 2  o 0 64      4.2   ?      ?    409.851 180          93.1975  180         138.63    -1.07764e-13 
1 1 1 2  18 2  o 0 5860.3  180.9 ?      ?    9243.45 53.2142      5823.63  53.2142     708.746   53.2142      
1 1 1 2  6  18 o 0 2461.2  77.1  ?      ?    7572.57 54.8734      2856.19  54.8734     1328.08   -125.127     
1 1 1 2  8  18 o 0 1534.8  48.2  ?      ?    4857.99 -136.343     2778.8   -136.343    115.416   -136.343     
1 1 1 2  10 18 o 0 1295.2  40.9  ?      ?    4343.14 12.1187      2778.37  12.1187     221.316   12.1187      
1 1 1 2  14 18 o 0 1846.6  63.5  ?      ?    5713.06 -38.4747     3104.68  -38.4747    31.8234   141.525      
1 1 1 2  16 18 o 0 954.9   32.2  ?      ?    4314.51 145.547      2009.36  145.547     300.388   -34.4529     
1 1 1 1  18 3  o 0 3000.8  86.9  ?      ?    8268.98 -17.7306     3264.15  -17.7306    1361.66   162.269      
1 1 1 3  7  18 o 0 1455.4  45.8  ?      ?    5005.41 71.9373      2539.49  71.9373     186.814   -108.063     
1 1 1 3  9  18 o 0 2890.2  90    ?      ?    7310.51 -142.096     3809.09  -142.096    475.167   37.904       
1 1 1 0  18 4  f 1 2068.6  88.2  ?      ?    5409.16 180          3359.94  180         272.509   180          
1 1 1 2  18 4  o 0 1326.8  40.3  ?      ?    3882.62 -94.8892     2910.98  -94.8892    761.233   -94.8892     
1 1 1 4  10 18 o 0 1518    52.1  ?      ?    5270.96 77.2361      2664.25  77.2361     376.316   -102.764     
1 1 1 4  12 18 o 0 3556.8  126.2 ?      ?    7486.03 10.2046      4443.91  10.2046     197.397   10.2046      
1 1 1 1  18 5  o 0 3655.3  113.3 ?      ?    7482.44 143.982      4518.03  143.982     332.036   143.982      
1 1 1 3  18 5  o 0 2950.1  88.5  ?      ?    7483.12 -65.2718     3553.81  -65.2718    549.879   114.728      
1 1 1 5  9  18 o 0 990     34.5  ?      ?    4143.73 -9.47359     2148.57  -9.47359    242.276   170.526      
1 1 1 5  11 18 o 0 1108.6  38.6  ?      ?    4999.18 -42.0726     1932.46  -42.0726    907.704   137.927      
1 1 1 0  18 6  o 0 585.2   26.3  ?      ?    3342.87 -2.95639e-14 1784.4   0           110.683   180          
1 1 1 2  18 6  o 0 6735.5  193.3 ?      ?    11769.5 -154.705     5220.89  -154.705    1275.06   25.295       
1 1 1 4  18 6  o 0 1762.2  55.4  ?      ?    5886.34 30.6673      2618.63  30.6673     580.037   -149.333     
1 1 1 6  18 6  o 0 2113.8  69.1  ?      ?    6821.89 -161.599     2908.47  -161.599    1097.6    18.4006      
1 1 1 6  10 18 o 0 1717.9  61.7  ?      ?    3170    -131.268     4097     -131.268    2290.56   -131.268     
1 1 1 3  18 7  o 0 2296.2  71.6  ?      ?    6626.64 -154.935     3078.37  -154.935    532.786   25.0653      
1 1 1 5  18 7  o 0 3682.5  124.6 ?      ?    7107.07 22.393       4970.4   22.393      809.742   22.393       
1 1 1 7  18 7  o 0 1078.1  37.3  ?      ?    4809.5  -68.2999     2018.97  -68.2999    786.248   111.7        
1 1 1 7  9  18 o 0 1915.1  68.6  ?      ?    5042.27 53.1685      3481.95  53.1685     594.628   53.1685      
1 1 1 7  15 18 o 0 813.1   31.5  ?      ?    3878.9  44.1023      1830.1   44.1023     188.228   -135.898     
1 1 1 7  17 18 o 0 912.8   32    ?      ?    2412.7  -9.85033     3311.62  -9.85033    1794.95   -9.85033     
1 1 1 0  18 8  o 0 1158.4  53.8  ?      ?    3695.97 3.33079e-16  2496.07  0           413.627   -1.67691e-15 
1 1 1 2  18 8  o 0 1028.4  34.3  ?      ?    4768.26 -41.0355     1809.26  -41.0355    803.535   138.964      
1 1 1 4  18 8  o 0 3224.8  104.1 ?      ?    5755.76 -126.481     5143.17  -126.481    1774.94   -126.481     
1 1 1 6  18 8  o 0 1142.9  41.5  ?      ?    4853.45 -8.60397     2130.12  -8.60397    684.954   171.396      
1 1 1 8  18 8  f 1 1137.9  43.7  ?      ?    3611.69 -52.8557     2763.94  -52.8557    662.184   -52.8557     
1 1 1 8  10 18 f 1 1118.3  40.8  ?      ?    4045.73 -28.3389     2439.29  -28.3389    133.963   -28.3389     
1 1 1 5  18 9  o 0 941.2   31.3  ?      ?    3558.62 -147.863     2341.04  -147.863    283.615   -147.863     
1 1 1 9  18 9  o 0 2134.5  80.6  ?      ?    7117.28 -153.393     2701.19  -153.393    1378.6    26.6071      
1 1 1 9  15 18 o 0 880.9   34.4  ?      ?    3330.51 -136.966     2773.3   -136.966    640.451   -136.966     
1 1 1 0  18 10 o 0 1597.9  74.1  ?      ?    2021.43 5.20554e-14  3147.52  0           1923.34   -3.31328e-14 
1 1 1 2  18 10 o 0 1858.8  58.2  ?      ?    3636.3  -165.671     4250.08  -165.671    2108.91   -165.671     
1 1 1 4  18 10 o 0 2362.8  74.1  ?      ?    6186.06 53.0591      3610.45  53.0591     37.4038   53.0591      
1 1 1 6  18 10 o 0 5447.5  175.8 ?      ?    8274.06 -131.289     6130.92  -131.289    1406.04   -131.289     
1 1 1 1  18 11 o 0 1104.7  35.1  ?      ?    3505.54 7.37374      2819.94  7.37374     744.437   7.37374      
1 1 1 5  18 11 o 0 1851.6  58.2  ?      ?    7077.54 140.187      2239.72  140.187     1787.28   -39.813      
1 1 1 9  18 11 f 1 1247.4  45.2  ?      ?    4319.76 44.6612      2667.22  44.6612     308.307   44.6612      
1 1 1 0  18 12 o 0 1600.3  74.8  ?      ?    4827.67 180          3099.85  180         224.272   180          
1 1 1 2  18 12 f 1 3723.9  115.9 ?      ?    6087.85 8.33001      5521.47  8.33001     1973.92   8.33001      
1 1 1 6  18 12 o 0 2295.2  72    ?      ?    7151.27 58.4779      3028.13  58.4779     851.394   -121.522     
1 1 1 12 14 18 o 0 592.7   23.6  ?      ?    2963.34 49.4209      2072.73  49.4209     167.358   49.4209      
1 1 1 12 16 18 f 1 1142.6  44.4  ?      ?    4906.71 29.6363      2445.8   29.6363     624.168   -150.364     
1 1 1 11 18 13 o 0 1269.4  48.7  ?      ?    4206.93 -20.4737     3349.25  -20.4737    595.474   -20.4737     
1 1 1 13 17 18 f 1 659.3   26.3  ?      ?    2464.65 -4.81887     2425.87  -4.81887    919.357   -4.81887     
1 1 1 0  18 14 o 0 1228.1  57.3  ?      ?    4916.62 6.77158e-15  2657.15  0           116.912   -180         
1 1 1 4  18 14 o 0 923     29.7  ?      ?    4056.04 67.7098      2077.4   67.7098     106.382   -112.29      
1 1 1 10 18 14 o 0 1890.3  71.7  ?      ?    5783.96 -81.5702     3692.91  -81.5702    50.9527   98.4298      
1 1 1 14 18 14 o 0 640.3   24    ?      ?    3981.14 -52.9184     1629.62  -52.9184    906.897   127.082      
1 1 1 5  18 15 o 0 1096.2  36.4  ?      ?    4860.25 -114.396     2019.96  -114.396    544.223   65.6035      
1 1 1 9  18 15 o 0 956.5   35    ?      ?    3409.55 5.73534      2943.69  5.73534     759.596   5.73534      
1 1 1 11 18 15 f 1 701.6   27.4  ?      ?    3111.17 168.475      2320.37  168.475     333.262   168.475      
1 1 1 0  18 16 o 0 11.8    3.5   ?      ?    2026.8  180          99.0584  180         1014.09   -4.66166e-17 
1 1 1 6  18 16 o 0 1659.4  54.6  ?      ?    4912.55 169.93       3738.48  169.93      583.226   169.93       
1 1 1 5  18 17 f 1 1025.9  34.2  ?      ?    3387.48 -8.516       3122.79  -8.516      949.819   -8.516       
1 1 1 13 18 17 f 1 1165.2  42.8  ?      ?    4325.52 -103.976     2780.79  -103.976    137.842   -103.976     
1 1 1 17 18 17 o 0 469.1   19.8  ?      ?    3105.07 -40.0105     1478.42  -40.0105    307.918   139.99       
1 1 1 0  18 18 o 0 41.4    4.9   ?      ?    1051.8  0            234.152  0           461.165   180          
1 1 1 8  18 18 o 0 2054.8  67.2  ?      ?    6598.84 -141.622     3326.13  -141.622    731.428   38.3785      
1 1 1 18 18 18 o 0 1249.7  84.5  ?      ?    4061.75 -106.764     3441.22  -106.764    589.503   -106.764     
1 1 1 0  1  19 f 1 368.6   16.7  ?      ?    700.382 -90          803.867  -90         411.758   -90          
1 1 1 0  3  19 o 0 7582.6  343.9 ?      ?    10917.5 90           6321.44  90          214.73    90           
1 1 1 0  5  19 o 0 3941.2  180   ?      ?    5419.95 -90          4563.97  -90         1532.72   -90          
1 1 1 0  7  19 o 0 5157.9  234.6 ?      ?    8039.85 90           5642.01  90          779.066   90           
1 1 1 0  9  19 o 0 64.9    4.2   ?      ?    194.447 90           47.7732  90          68.6499   -90          
1 1 1 0  11 19 o 0 749.8   35.5  ?      ?    2264.35 90           2092.1   90          756.614   90           
1 1 1 0  13 19 o 0 99.3    5.7   ?      ?    2871.27 90           714.278  90          893.08    -90          
1 1 1 0  15 19 o 0 35.6    4.3   ?      ?    642.112 90           105.805  90          245.018   -90          
1 1 1 0  17 19 o 0 192.1   10.6  ?      ?    2257.44 90           1187.64  90          301.85    -90          
1 1 1 0  19 1  f 1 2350.5  93.7  ?      ?    6370.22 90           3493.81  90          52.9752   -90          
1 1 1 1  2  19 o 0 1700.1  51.4  ?      ?    5937.17 -72.9825     2519.26  -72.9825    748.783   107.018      
1 1 1 1  6  19 o 0 1272.8  40.1  ?      ?    4113.74 -109.88      2898.27  -109.88     439.969   -109.88      
1 1 1 1  8  19 o 0 2942.8  91.6  ?      ?    6946.71 -3.62523     4139.35  -3.62523    19.3049   -3.62523     
1 1 1 1  10 19 o 0 1285.9  39.2  ?      ?    4897.65 157.691      2441.22  157.691     428.372   -22.3088     
1 1 1 1  12 19 o 0 3026.2  94.5  ?      ?    8028.72 -21.9353     3693.83  -21.9353    784.7     158.065      
1 1 1 1  14 19 f 1 990.5   31.7  ?      ?    4015.19 139.923      2276.19  139.923     71.1383   139.923      
1 1 1 1  16 19 o 0 1186    39.4  ?      ?    4729.45 -6.68923     2849.76  -6.68923    278.87    173.311      
1 1 1 2  13 19 f 1 938.6   30    ?      ?    5726.81 -115.225     1255.75  -115.225    1886      64.7748      
1 1 1 2  15 19 o 0 1054.8  36.9  ?      ?    4561.59 -37.5603     2101.72  -37.5603    330.503   142.44       
1 1 1 0  19 3  o 0 1328.5  57.1  ?      ?    2678.94 -90          2640.8   -90         1149.64   -90          
1 1 1 3  6  19 o 0 1303    41.1  ?      ?    5077.42 27.0191      2370.16  27.0191     594.331   -152.981     
1 1 1 3  12 19 o 0 1265    39.9  ?      ?    3637.96 -155.747     3073.93  -155.747    1091.39   -155.747     
1 1 1 4  5  19 o 0 4060.5  125.9 ?      ?    7187.05 153.925      5347.28  153.925     1172.24   153.925      
1 1 1 4  9  19 o 0 1738.9  54.7  ?      ?    4900.46 177.129      3244.06  177.129     446.473   177.129      
1 1 1 0  19 5  o 0 492.7   20.5  ?      ?    4733.93 -90          1610.65  -90         1027.09   90           
1 1 1 2  19 5  f 1 2348.3  70.7  ?      ?    6773.99 101.386      3049.7   101.386     653.575   -78.6141     
1 1 1 1  19 6  o 0 1795.9  56.6  ?      ?    6558.39 93.7059      2549.7   93.7059     1363.01   -86.2941     
1 1 1 3  19 6  o 0 1982.5  62.4  ?      ?    5686.51 96.0973      3314.68  96.0973     8.64054   -83.9027     
1 1 1 5  19 6  o 0 5411.9  174.6 ?      ?    8960.6  -11.6868     5782.06  -11.6868    605.527   -11.6868     
1 1 1 0  19 7  o 0 57.7    3.8   ?      ?    1676.06 90           328.66   90          682.848   -90          
1 1 1 2  19 7  o 0 2552.5  74.2  ?      ?    6660.47 -26.5694     3700.24  -26.5694    216       153.431      
1 1 1 3  19 8  o 0 1991.4  62.6  ?      ?    5281.64 -95.2853     3526.78  -95.2853    464.556   -95.2853     
1 1 1 8  9  19 o 0 687.4   25.7  ?      ?    2579.41 -101.852     2203.97  -101.852    803.967   -101.852     
1 1 1 8  17 19 o 0 996.2   38.7  ?      ?    3803.16 -131.329     2701.88  -131.329    366.292   -131.329     
1 1 1 0  19 9  o 0 141.7   7.7   ?      ?    268.541 90           143.196  90          17.4752   -90          
1 1 1 4  19 9  o 0 1194    39.6  ?      ?    5318.99 -9.35666     1959.63  -9.35666    1082.09   170.643      
1 1 1 5  19 10 o 0 905.2   30.1  ?      ?    2928.02 -38.6724     2503.27  -38.6724    851.801   -38.6724     
1 1 1 9  19 10 o 0 723     28.4  ?      ?    3645.36 54.5558      1773.85  54.5558     186.966   -125.444     
1 1 1 10 11 19 o 0 738     28.8  ?      ?    2842.77 -152.125     2168.8   -152.125    661.135   -152.125     
1 1 1 0  19 11 o 0 271.8   13.8  ?      ?    522.374 90           502.159  90          193.89    90           
1 1 1 6  19 11 o 0 1012    33.6  ?      ?    4627.46 11.7026      1994.2   11.7026     497.058   -168.297     
1 1 1 11 14 19 o 0 822.9   31.9  ?      ?    3779.94 -94.6062     2308.86  -94.6062    81.0339   85.3938      
1 1 1 11 16 19 o 0 694.7   27.2  ?      ?    2521.47 -49.3787     2538.58  -49.3787    992.23    -49.3787     
1 1 1 3  19 12 o 0 885.9   28.5  ?      ?    4483.46 -87.349      1796.01  -87.349     650.826   92.651       
1 1 1 7  19 12 o 0 870.9   30.4  ?      ?    3346.27 28.284       2268.27  28.284      493.374   28.284       
1 1 1 12 15 19 o 0 868.7   34    ?      ?    5083.96 167.552      1630.47  167.552     1521.72   -12.4482     
1 1 1 0  19 13 o 0 14.6    3     ?      ?    2080.94 -90          132.605  -90         1033.98   90           
1 1 1 6  19 13 o 0 1587.9  50.4  ?      ?    5014.91 -120.467     2896.82  -120.467    250.825   -120.467     
1 1 1 3  19 14 o 0 875.5   28.2  ?      ?    4523.84 121.096      1713.25  121.096     705.538   -58.9039     
1 1 1 7  19 14 o 0 757.2   25.5  ?      ?    4260.79 -124.578     1864.73  -124.578    880.359   55.4219      
1 1 1 0  19 15 o 0 374.4   19    ?      ?    631.752 -90          939.712  -90         593.975   -90          
1 1 1 7  19 16 o 0 1076    35.6  ?      ?    4656.08 90.4736      2470.33  90.4736     451.173   -89.5264     
1 1 1 0  19 17 o 0 533     26    ?      ?    3991.66 90           2049.8   90          587.124   -90          
1 1 1 6  19 17 o 0 606.8   21.6  ?      ?    3816.68 -50.5766     1576.7   -50.5766    800.336   129.423      
1 1 1 8  19 17 o 0 735     24.9  ?      ?    3671.23 103.413      2046.56  103.413     208.593   -76.5874     
1 1 1 17 18 19 o 0 1059.8  41.5  ?      ?    3777.39 173.093      3429.26  173.093     804.647   173.093      
1 1 1 13 19 18 o 0 655.2   25    ?      ?    2473.03 -165.047     2403.05  -165.047    991.111   -165.047     
1 1 1 15 19 18 o 0 1421.6  58.1  ?      ?    3988.23 -138.597     3454.12  -138.597    1213.17   -138.597     
1 1 1 17 19 18 o 0 385.9   16.9  ?      ?    2466.87 30.3914      1786.01  30.3914     73.9344   30.3914      
1 1 1 0  19 19 o 0 350.2   18.6  ?      ?    1834.74 -90          1568.79  -90         397.357   -90          
1 1 1 0  20 0  o 0 2055.3  116.3 ?      ?    6947.24 4.50712e-14  3465.01  0           620.312   -180         
1 1 1 0  2  20 f 1 142.3   7.1   ?      ?    2431.3  -180         821.207  180         631.596   2.559e-14    
1 1 1 0  4  20 o 0 37.8    2.8   ?      ?    1374.79 1.11333e-14  185.536  0           633.25    -180         
1 1 1 0  6  20 f 1 1127.8  52.9  ?      ?    4807.07 180          2596.55  180         275.39    4.30189e-14  
1 1 1 0  8  20 o 0 1759.9  75.8  ?      ?    5057.94 -180         3218.96  180         236.334   180          
1 1 1 0  10 20 o 0 1817.2  77.9  ?      ?    4840.84 2.55114e-14  3230.38  0           500.529   -1.39137e-13 
1 1 1 0  12 20 o 0 2494.3  114.7 ?      ?    6967.06 180          3716.21  180         146.172   1.08631e-13  
1 1 1 0  14 20 o 0 1995.5  86.1  ?      ?    6802.01 -4.63454e-15 3253.96  0           436.072   180          
1 1 1 0  16 20 o 0 125     7.9   ?      ?    1033.5  2.39088e-14  626.388  0           52.4367   -180         
1 1 1 0  18 20 o 0 357.9   18.7  ?      ?    831.955 7.28856e-15  1247.62  0           717.542   -5.38432e-15 
1 1 1 1  7  20 o 0 1492.1  47.3  ?      ?    4756.9  -0.0412787   2930.74  -0.0412787  152.984   -0.0412787   
1 1 1 0  20 2  f 1 321.2   14.6  ?      ?    2791.61 2.92625e-14  1362     0           300.85    -180         
1 1 1 2  20 2  o 0 3271    98    ?      ?    7520.47 117.013      4170.83  117.013     193.022   -62.9869     
1 1 1 2  6  20 o 0 3395.3  105.9 ?      ?    7167.03 -49.9118     4517.98  -49.9118    370.097   -49.9118     
1 1 1 2  8  20 o 0 2031.6  63.7  ?      ?    5882.53 -30.3686     3229.97  -30.3686    148.981   149.631      
1 1 1 2  12 20 o 0 1215    38.7  ?      ?    3129.24 -51.2412     3195.24  -51.2412    1503.18   -51.2412     
1 1 1 2  14 20 f 1 947.5   30.3  ?      ?    2907.65 109.848      2645.15  109.848     1096.11   109.848      
1 1 1 3  5  20 o 0 1632.4  51.5  ?      ?    4963.91 102.69       3036.45  102.69      185.167   102.69       
1 1 1 3  7  20 o 0 8301.9  255.8 ?      ?    10894.8 -103.636     7205.63  -103.636    984.297   -103.636     
1 1 1 3  9  20 o 0 1653.7  51.9  ?      ?    3804.39 88.2897      3633.89  88.2896     1482.92   88.2896      
1 1 1 3  11 20 o 0 1098.8  36.5  ?      ?    3538.13 -140.747     2742.31  -140.747    832.682   -140.747     
1 1 1 3  19 20 o 0 1054.6  34    ?      ?    4021.76 107.079      2704.07  107.079     257.777   107.079      
1 1 1 0  20 4  o 0 1455    62.5  ?      ?    4832.55 180          2950.03  180         78.705    -180         
1 1 1 2  20 4  f 1 1031.9  31.6  ?      ?    3354.96 -24.7282     2665.67  -24.7282    706.032   -24.7282     
1 1 1 4  10 20 o 0 1654.1  54.3  ?      ?    5388.05 13.1452      2886.03  13.1452     18.2084   -166.855     
1 1 1 3  20 5  o 0 1454.4  44.2  ?      ?    5920.95 -24.0738     2177.5   -24.0738    1228.79   155.926      
1 1 1 5  11 20 o 0 803.6   28.2  ?      ?    5537.25 -52.9475     1008.58  -52.9475    1930.85   127.052      
1 1 1 5  13 20 o 0 1276.7  44.2  ?      ?    4348.01 18.146       2613.45  18.146      348.187   18.146       
1 1 1 0  20 6  f 1 3644.2  154.3 ?      ?    6192.65 -180         4657.06  180         961.818   180          
1 1 1 2  20 6  o 0 1103.8  35.2  ?      ?    4409.17 110.453      2280.34  110.453     273.162   -69.5467     
1 1 1 4  20 6  o 0 1934.3  60.9  ?      ?    6023.1  -167.159     2965.89  -167.159    466.233   12.8414      
1 1 1 6  12 20 o 0 829.2   29.2  ?      ?    4323.35 -1.31702     1661.61  -1.31702    598.132   178.683      
1 1 1 1  20 7  o 0 2472.4  77.4  ?      ?    6810.44 33.7448      3466.51  33.7448     511.087   -146.255     
1 1 1 3  20 7  o 0 3092.6  92.8  ?      ?    6315.63 160.211      4543.46  160.211     931.11    160.211      
1 1 1 7  13 20 f 1 861.6   33.6  ?      ?    2798.26 -123.537     3004.31  -123.537    1205.55   -123.537     
1 1 1 0  20 8  o 0 1196.4  51.9  ?      ?    4138.15 2.83508e-15  2655.12  0           214.668   -3.22306e-14 
1 1 1 6  20 8  o 0 3188.2  108.4 ?      ?    6144.7  -152.008     4785.09  -152.008    1462.38   -152.008     
1 1 1 8  20 8  o 0 1188.5  41.4  ?      ?    4489.6  2.05091      2443.73  2.05092     31.8028   2.05092      
1 1 1 8  14 20 o 0 618     24.9  ?      ?    2680.77 -117.508     2265.26  -117.508    580.7     -117.508     
1 1 1 1  20 9  o 0 1631.4  51.4  ?      ?    4763.13 -59.8343     3167.07  -59.8343    409.416   -59.8343     
1 1 1 3  20 9  o 0 1535.4  48.7  ?      ?    5888.98 -2.09572     2314.09  -2.09572    1021.58   177.904      
1 1 1 7  20 9  o 0 1983.1  71.3  ?      ?    5008.83 158.865      3609.16  158.865     930.392   158.865      
1 1 1 9  17 20 o 0 620.1   25    ?      ?    2366.22 116.804      2321.06  116.804     903.199   116.804      
1 1 1 0  20 10 o 0 676.8   32.2  ?      ?    5036.77 -180         1975.01  180         869.052   7.54577e-14  
1 1 1 2  20 10 o 0 2444.9  76.5  ?      ?    6607.35 -128.128     3592.44  -128.128    44.9169   51.8725      
1 1 1 10 12 20 o 0 902     37.2  ?      ?    3760.28 178.538      2571.32  178.538     172.142   178.538      
1 1 1 10 14 20 o 0 580     24.3  ?      ?    3085.58 100.349      1894.2   100.349     25.7147   -79.6506     
1 1 1 1  20 11 o 0 1021.2  32.9  ?      ?    4810.42 169.849      1973.78  169.849     686.502   -10.1513     
1 1 1 3  20 11 o 0 979.5   31.6  ?      ?    5096.1  13.7597      1686.52  13.7597     1069.59   -166.24      
1 1 1 11 13 20 f 1 673.4   28.4  ?      ?    2035.34 -80.0986     2762.77  -80.0986    1477.75   -80.0986     
1 1 1 0  20 12 o 0 402.5   19.7  ?      ?    1852.56 1.88114e-15  1474.88  0           445.582   -4.34546e-15 
1 1 1 2  20 12 o 0 1213.2  39    ?      ?    4317.72 165.622      2605.25  165.622     265.556   165.622      
1 1 1 4  20 12 o 0 1191.2  36.8  ?      ?    4210.76 -74.3038     2563.05  -74.3038    325.644   -74.3038     
1 1 1 6  20 12 o 0 1001.7  33.6  ?      ?    5384.85 94.1222      1535.88  94.1222     1283.69   -85.8778     
1 1 1 10 20 12 o 0 909.8   33.3  ?      ?    3095.04 161.542      2981.05  161.542     1006.11   161.542      
1 1 1 12 18 20 o 0 1320.3  50.9  ?      ?    4086.82 120.671      3204.25  120.671     899.032   120.671      
1 1 1 1  20 13 o 0 1530.3  50.7  ?      ?    6674.26 41.1352      2001.59  41.1352     1622.69   -138.865     
1 1 1 13 15 20 o 0 565.3   22.6  ?      ?    1660.1  78.9887      2554.77  78.9887     1575.95   78.9887      
1 1 1 13 19 20 f 1 916.1   36.2  ?      ?    3185.97 82.6649      3351.7   82.6649     1134.54   82.6649      
1 1 1 0  20 14 o 0 26.7    4.1   ?      ?    467.539 -9.1339e-15  57.7899  0           196.518   180          
1 1 1 2  20 14 f 1 784.9   25.4  ?      ?    2640.08 30.5888      2379.01  30.5888     969.326   30.5888      
1 1 1 14 18 20 o 0 1042.4  40.6  ?      ?    4277.07 4.91836      2441.41  4.91836     65.7204   4.91836      
1 1 1 3  20 15 o 0 1534.6  48.6  ?      ?    5400.18 35.695       3184.35  35.695      300.616   -144.305     
1 1 1 5  20 15 o 0 2236.7  73.2  ?      ?    4530.43 169.049      5029.11  169.049     2157.08   169.049      
1 1 1 9  20 15 o 0 887.8   31.2  ?      ?    3644.31 139.903      2515.43  139.903     266.55    139.903      
1 1 1 15 19 20 o 0 449.2   19.5  ?      ?    2461.57 -41.1708     2042.48  -41.1708    369.061   -41.1708     
1 1 1 0  20 16 o 0 273.2   14.7  ?      ?    1729.39 180          1392.85  180         254.16    -180         
1 1 1 2  20 16 o 0 787.8   25.5  ?      ?    3802.66 -43.1739     2232.52  -43.1739    214.712   136.826      
1 1 1 6  20 16 f 1 806.6   27.1  ?      ?    3182.99 -127.392     2548.93  -127.392    561.533   -127.392     
1 1 1 8  20 16 o 0 808.8   27.3  ?      ?    3555.92 15.4969      2322.99  15.4969     145.769   15.4969      
1 1 1 16 20 16 o 0 519.3   20.4  ?      ?    2207.89 -25.8727     2065.93  -25.8727    818.525   -25.8727     
1 1 1 13 20 17 o 0 573.3   23.2  ?      ?    1597.97 44.9194      2514.38  44.9194     1604.65   44.9194      
1 1 1 17 20 17 o 0 489.2   19.9  ?      ?    3360.25 170.025      1702.41  170.025     620.949   -9.97506     
1 1 1 0  20 18 o 0 107.8   7.8   ?      ?    1945.1  180          768.871  180         472.404   -6.70984e-14 
1 1 1 12 20 18 o 0 1250.7  46    ?      ?    3508.59 -79.9028     3359.98  -79.9028    1382.22   -79.9028     
1 1 1 14 20 18 o 0 446.9   18.8  ?      ?    1966.57 23.4819      1880.11  23.4819     789.157   23.4819      
1 1 1 5  20 19 o 0 875     29.7  ?      ?    3662.17 -75.0685     2475.34  -75.0685    336.724   -75.0685     
1 1 1 7  20 19 o 0 836.2   28.4  ?      ?    3274.46 117.865      2537.65  117.865     655.583   117.865      
1 1 1 13 20 19 f 1 893.5   33.6  ?      ?    2687.79 -22.1858     3590.23  -22.1858    1720.68   -22.1858     
1 1 1 0  20 20 o 0 185.5   11.1  ?      ?    704.21  2.26285e-14  717.585  0           294.358   -3.25352e-14 
1 1 1 20 20 20 o 0 666.5   49.6  ?      ?    4543.08 -111.504     1221.83  -111.504    1580.29   68.4965      
1 1 1 0  1  21 o 0 465.3   21    ?      ?    3253.19 -90          1623.81  -90         260.978   90           
1 1 1 0  3  21 o 0 4561.8  192.1 ?      ?    8005.05 -90          5108.42  -90         448.94    -90          
1 1 1 0  5  21 o 0 23.3    2.4   ?      ?    1096.63 -90          91.7386  -90         546.573   90           
1 1 1 0  7  21 o 0 26.8    2.8   ?      ?    1387.71 90           130.513  90          673.364   -90          
1 1 1 0  9  21 o 0 1177.1  51.2  ?      ?    5055.04 90           2561.71  90          246.164   -90          
1 1 1 0  11 21 o 0 1021    44.4  ?      ?    5114.92 -90          2351.73  -90         448.854   90           
1 1 1 0  13 21 o 0 2547.5  117   ?      ?    4887.91 -90          4519.5   -90         1256.13   -90          
1 1 1 0  15 21 o 0 1124    49.9  ?      ?    3297.07 90           2936.89  90          786.834   90           
1 1 1 0  17 21 o 0 12.8    5.1   ?      ?    118.284 -90          6.93509  -90         68.0766   90           
1 1 1 0  19 21 o 0 1000.7  47.8  ?      ?    5875.09 -90          2608.43  -90         914.515   90           
1 1 1 0  21 1  o 0 164     7.5   ?      ?    1396.61 90           677.635  90          130.637   -90          
1 1 1 1  2  21 o 0 2244.5  67.5  ?      ?    5259.95 101.146      3914.81  101.146     895.054   101.146      
1 1 1 1  4  21 o 0 1756.4  57.4  ?      ?    5967.59 -95.4647     2713.71  -95.4647    718.13    84.5353      
1 1 1 1  12 21 o 0 3022.1  94.1  ?      ?    5901.86 175.456      4652.87  175.456     1489.13   175.456      
1 1 1 2  3  21 o 0 2188.5  68.5  ?      ?    5299.48 86.6387      3769.04  86.6387     754.193   86.6387      
1 1 1 2  9  21 o 0 1959.1  61.5  ?      ?    4586.2  22.4015      3841.14  22.4015     1354.93   22.4015      
1 1 1 0  21 3  o 0 310.1   14.2  ?      ?    1741.4  -90          1205.89  -90         192.913   -90          
1 1 1 2  21 3  o 0 7161.9  212.9 ?      ?    10541.2 -105.875     6441.62  -105.875    436.724   -105.875     
1 1 1 3  4  21 o 0 1115.5  34.2  ?      ?    4936.39 55.4166      1967.4   55.4166     815.788   -124.583     
1 1 1 3  8  21 o 0 1502.5  47.3  ?      ?    5872.69 -44.1979     2360.87  -44.1979    808.21    135.802      
1 1 1 3  14 21 f 1 1375.3  43.7  ?      ?    5337.02 121.378      2816.36  121.378     614.68    -58.6223     
1 1 1 3  16 21 o 0 732.2   24.8  ?      ?    4385.6  11.2666      1654.28  11.2666     1082.05   -168.733     
1 1 1 1  21 4  o 0 1592.6  46.8  ?      ?    3795.99 88.2396      3590.75  88.2396     1406.47   88.2396      
1 1 1 3  21 4  o 0 3634.1  108.9 ?      ?    7485.96 178.897      4530.3   178.897     300.142   178.897      
1 1 1 4  11 21 o 0 1303.6  43.1  ?      ?    4624.62 -147.407     2548.44  -147.407    121.96    -147.407     
1 1 1 0  21 5  o 0 895.3   38.7  ?      ?    3176.72 90           2267.4   90          417.953   90           
1 1 1 4  21 5  o 0 1374.4  42    ?      ?    5483.63 65.3746      2200.03  65.3746     873.137   -114.625     
1 1 1 5  16 21 o 0 1241.4  43.5  ?      ?    4311    -99.6775     3012.04  -99.6775    367.97    -99.6775     
1 1 1 1  21 6  o 0 1854.9  56.3  ?      ?    3582.36 -129.822     4164.87  -129.822    2107.71   -129.822     
1 1 1 6  17 21 o 0 718.2   25.8  ?      ?    4558.67 159.094      1450.13  159.094     1286.44   -20.9055     
1 1 1 0  21 7  o 0 654.5   29    ?      ?    3321.24 90           1930.92  90          4.52092   90           
1 1 1 4  21 7  o 0 952.5   30.7  ?      ?    3526.69 -124.927     2414.15  -124.927    512.971   -124.927     
1 1 1 7  14 21 o 0 600.3   24    ?      ?    1874.39 142.687      2561.55  142.687     1399.69   142.687      
1 1 1 3  21 8  o 0 1402.2  41.4  ?      ?    4177.33 53.2859      3053.95  53.2859     794.066   53.2859      
1 1 1 8  13 21 o 0 852.3   31.6  ?      ?    4123.18 -30.8948     2162.92  -30.8948    407.389   149.105      
1 1 1 8  17 21 o 0 1066.9  41.6  ?      ?    3753.45 54.6147      2885.41  54.6147     716.643   54.6147      
1 1 1 0  21 9  o 0 3006.1  128   ?      ?    8977.68 90           4098.29  90          900.244   -90          
1 1 1 4  21 9  o 0 1654.7  54.3  ?      ?    5892.53 -54.682      2597.09  -54.682     547.134   125.318      
1 1 1 6  21 9  o 0 2608.2  85.1  ?      ?    7566.23 -163.78      3166.53  -163.78     817.924   16.2196      
1 1 1 9  10 21 o 0 696.6   26.1  ?      ?    2845.57 119.839      2481.3   119.839     660.842   119.839      
1 1 1 1  21 10 o 0 2909.1  90.9  ?      ?    6074.32 59.9545      4503.14  59.9545     1184.39   59.9545      
1 1 1 5  21 10 o 0 1286.7  42.9  ?      ?    4373.65 154.367      2647.63  154.367     346.533   154.367      
1 1 1 7  21 10 o 0 1183.8  41.4  ?      ?    3559.57 -127.86      2804.9   -127.86     954.306   -127.86      
1 1 1 10 11 21 o 0 1631.8  62.3  ?      ?    5409.36 58.9938      3308.11  58.9938     107.177   -121.006     
1 1 1 10 13 21 o 0 603     24.3  ?      ?    4091.06 171.509      1390.68  171.509     1134.45   -8.49089     
1 1 1 10 15 21 o 0 560.1   23    ?      ?    3304.9  120.616      1645.18  120.616     342.149   -59.3842     
1 1 1 0  21 11 o 0 81.7    6.5   ?      ?    82.8497 -90          32.3252  -90         13.186    90           
1 1 1 2  21 11 o 0 1823.5  57.5  ?      ?    5874.55 58.3657      2909.98  58.3657     240.22    -121.634     
1 1 1 10 21 11 o 0 1412.1  53.9  ?      ?    3467.13 13.0986      3989.43  13.0986     1800.75   13.0986      
1 1 1 12 17 21 o 0 505.6   21    ?      ?    3983.24 -160.738     1115.34  -160.738    1124.32   19.2616      
1 1 1 0  21 13 o 0 892.6   42.6  ?      ?    1783.94 -90          2685.01  -90         1489.45   -90          
1 1 1 8  21 13 o 0 1066.8  37.3  ?      ?    3640.71 155.044      3025.53  155.044     753.83    155.044      
1 1 1 12 21 13 o 0 978.3   38.2  ?      ?    4497.26 162.307      2239.69  162.307     504.112   -17.6935     
1 1 1 14 17 21 o 0 595.5   24.1  ?      ?    2670.04 63.1196      2055.1   63.1196     576.475   63.1196      
1 1 1 0  21 15 o 0 140.2   8.8   ?      ?    3210.18 -90          1026.66  -90         1074.74   90           
1 1 1 6  21 15 o 0 1420.6  45.3  ?      ?    3927.34 123.088      3663.98  123.088     1238.6    123.088      
1 1 1 10 21 15 o 0 574.4   22.1  ?      ?    1482.79 -120.533     2531.21  -120.533    1639.94   -120.533     
1 1 1 12 21 15 o 0 584.2   23.6  ?      ?    2402.03 14.6373      2245.83  14.6373     854.37    14.6373      
1 1 1 14 21 15 o 0 895     35.4  ?      ?    4010.33 160.767      2281.34  160.767     7.86388   -19.2333     
1 1 1 11 21 16 o 0 689.3   26.1  ?      ?    4039.51 -169.402     1705.71  -169.402    615.49    10.5984      
1 1 1 0  21 17 o 0 282.7   15.1  ?      ?    3053.25 90           1434.1   90          508.419   -90          
1 1 1 16 21 17 o 0 672.9   28    ?      ?    2430.36 -147.027     2958.25  -147.027    1299.83   -147.027     
1 1 1 17 18 21 o 0 381.6   16.2  ?      ?    2443.23 40.7577      1714.57  40.7577     110.357   40.7577      
1 1 1 17 20 21 o 0 334     16.3  ?      ?    2513.99 -58.1131     1384.72  -58.1131    198.206   121.887      
1 1 1 5  21 18 o 0 728.7   24.3  ?      ?    2956.33 -121.379     2433.75  -121.379    710.488   -121.379     
1 1 1 17 21 18 o 0 684.4   26.6  ?      ?    3938.43 92.4152      2036.18  92.4152     540.483   -87.5848     
1 1 1 0  21 19 o 0 66.9    6.9   ?      ?    1254.37 -90          449.123  -90         304.523   90           
1 1 1 10 21 19 f 1 857.7   29.3  ?      ?    3703.91 -5.96522     2260.32  -5.96522    206.435   -5.96522     
1 1 1 3  21 20 o 0 873.7   28.7  ?      ?    4493.36 -129.815     1977.05  -129.815    600.609   50.1849      
1 1 1 19 21 20 o 0 679.7   29.2  ?      ?    2040.45 -53.7748     2909.34  -53.7748    1661.24   -53.7748     
1 1 1 0  21 21 o 0 -5      8     ?      ?    459.152 90           5.28085  90          260.233   -90          
1 1 1 16 21 21 o 0 366.7   17.8  ?      ?    2349.63 -7.45108     1608.43  -7.45108    143.175   -7.45108     
1 1 1 20 21 21 o 0 495.9   23.8  ?      ?    3071.12 150.5        1660.62  150.5       130.561   -29.5003     
1 1 1 0  22 0  f 1 2179.2  123.4 ?      ?    5475.69 -180         3421.94  180         313.906   180          
1 1 1 0  2  22 o 0 1310.4  56.5  ?      ?    3783.68 4.70343e-16  2674.05  0           526.439   -1.91877e-15 
1 1 1 0  4  22 o 0 1728.7  80.4  ?      ?    4148.61 -1.25332e-15 3076.66  0           791.555   3.61815e-15  
1 1 1 0  6  22 o 0 3366.7  154.9 ?      ?    7933.54 -3.06535e-15 4277.64  0           82.2958   180          
1 1 1 0  8  22 o 0 387.9   18.1  ?      ?    3307.61 2.86987e-14  1444.75  0           360.277   -180         
1 1 1 0  10 22 o 0 92.9    5.3   ?      ?    1670.36 -7.65677e-14 544.937  0           355.984   180          
1 1 1 0  12 22 o 0 3419.8  145.3 ?      ?    6818.18 -1.80769e-15 5168.67  0           672.707   1.20815e-14  
1 1 1 0  14 22 o 0 1080.1  50.9  ?      ?    2977.77 180          2850.08  180         927.205   -180         
1 1 1 0  16 22 o 0 533.2   24.5  ?      ?    2313.75 -180         1950.16  180         493.508   180          
1 1 1 0  18 22 o 0 286.2   15.7  ?      ?    1579.85 -3.04551e-14 1348.32  0           405.525   7.0804e-14   
1 1 1 0  20 22 o 0 6.2     6.5   ?      ?    804.117 -3.47996e-14 21.5277  0           442.344   180          
1 1 1 1  5  22 o 0 4816.2  155.5 ?      ?    8516.96 -87.5338     5427.92  -87.5338    794.292   -87.5338     
1 1 1 1  13 22 o 0 924.8   29.7  ?      ?    3201.49 -124.532     2999.97  -124.532    932.816   -124.532     
1 1 1 0  22 2  o 0 324.8   14.9  ?      ?    1624.95 180          1188.45  180         264.81    -180         
1 1 1 2  8  22 o 0 1022.4  32.7  ?      ?    2475.67 -164.273     3038.93  -164.273    1718.2    -164.273     
1 1 1 2  10 22 f 1 1233.1  39.4  ?      ?    3598.9  41.9649      2918.09  41.9649     1009.38   41.9649      
1 1 1 2  14 22 f 1 988.2   31.8  ?      ?    1842.33 42.0648      3805.88  42.0648     2634.35   42.0648      
1 1 1 2  18 22 o 0 775.7   26.8  ?      ?    4143.69 54.7481      1938.97  54.7481     487.864   -125.252     
1 1 1 3  19 22 o 0 1497.5  52    ?      ?    5949.49 -79.9996     2593.38  -79.9996    806.588   100          
1 1 1 0  22 4  o 0 115.1   6     ?      ?    1445.02 -3.33671e-14 608.455  0           189.07    180          
1 1 1 2  22 4  o 0 1750.9  53.1  ?      ?    4322.7  -115.827     3615.07  -115.827    1278.84   -115.827     
1 1 1 4  6  22 o 0 1431.1  45.2  ?      ?    5102.85 134.128      2571.64  134.128     124.964   -45.872      
1 1 1 4  20 22 o 0 1327.3  44.4  ?      ?    4403.48 -174.036     3019.42  -174.036    565.194   -174.036     
1 1 1 5  7  22 o 0 859.2   26.6  ?      ?    4047.78 96.2274      1872.17  96.2274     245.327   -83.7726     
1 1 1 5  19 22 o 0 1112.4  37.3  ?      ?    4770.5  109.254      2372.07  109.254     309.062   -70.7464     
1 1 1 0  22 6  o 0 1476.8  64.1  ?      ?    3630.27 3.93795e-15  2846.28  0           845.607   -9.31706e-15 
1 1 1 7  9  22 o 0 851.5   28.7  ?      ?    2532.85 -158.939     3113.8   -158.939    1502.55   -158.939     
1 1 1 7  11 22 o 0 1731.2  62.8  ?      ?    5693.4  -129.839     3314.53  -129.839    250.92    50.1614      
1 1 1 7  13 22 o 0 947.6   35.3  ?      ?    4144.65 145.82       2379.79  145.82      165.933   -34.18       
1 1 1 7  17 22 o 0 1152.5  44.5  ?      ?    4386.82 40.742       2707.58  40.742      204.981   40.742       
1 1 1 0  22 8  o 0 12.1    2.7   ?      ?    539.687 -180         29.8457  180         265.777   2.91223e-14  
1 1 1 2  22 8  o 0 1763.2  53.6  ?      ?    6321.69 156.735      2571.73  156.735     812.724   -23.2654     
1 1 1 8  16 22 o 0 1143.2  44.4  ?      ?    3456.15 -94.311      3208.39  -94.311     1222.85   -94.311      
1 1 1 8  20 22 o 0 435.2   18    ?      ?    2564.38 1.44186      1921.57  1.44186     178.504   1.44186      
1 1 1 3  22 9  o 0 1956.5  59.2  ?      ?    5717.85 55.0908      3159.69  55.0908     143.18    55.0908      
1 1 1 7  22 9  o 0 893.3   31.3  ?      ?    3328.44 -16.0367     2799.59  -16.0367    677.767   -16.0367     
1 1 1 9  11 22 o 0 885.7   33    ?      ?    4179.34 67.1943      2212.75  67.1943     378.814   -112.806     
1 1 1 9  17 22 o 0 461.7   19.5  ?      ?    2515.42 -176.773     1710.17  -176.773    295.514   -176.773     
1 1 1 0  22 10 o 0 135     7.6   ?      ?    478.795 1.28587e-13  292.859  0           33.4327   -9.97794e-13 
1 1 1 2  22 10 f 1 907.7   30.4  ?      ?    3828.99 -34.9446     2107.1   -34.9446    68.3071   -34.9446     
1 1 1 6  22 10 o 0 734     24.9  ?      ?    3575.93 -13.2817     2174.52  -13.2817    101.775   166.718      
1 1 1 10 14 22 f 1 804.8   31.7  ?      ?    2644.3  113.625      2722.49  113.625     1136.04   113.625      
1 1 1 10 18 22 f 1 558.2   23.9  ?      ?    3102.87 93.2658      1702.11  93.2658     13.0415   -86.7342     
1 1 1 11 19 22 o 0 749.2   28.8  ?      ?    3057.31 -2.23867     2824.07  -2.23867    759.291   -2.23867     
1 1 1 0  22 12 o 0 389.9   19.5  ?      ?    2123.65 180          1744.2   180         336.618   -180         
1 1 1 12 18 22 f 1 657.7   26.9  ?      ?    3356.73 -40.8709     2329.12  -40.8709    28.0046   -40.8709     
1 1 1 12 20 22 o 0 429.6   18.9  ?      ?    2822.78 -142.205     1700.18  -142.205    133.173   37.7949      
1 1 1 13 22 13 o 0 612.6   24.8  ?      ?    3295.46 90.127       1876.13  90.127      28.027    -89.873      
1 1 1 13 19 22 o 0 527.7   22.5  ?      ?    1639.17 174.193      2735.55  174.193     1647.24   174.193      
1 1 1 0  22 14 o 0 282     15.3  ?      ?    2559.76 3.39274e-14  1454.21  0           207.527   -180         
1 1 1 12 22 14 o 0 577.2   22    ?      ?    2257.85 -13.9668     2272.31  -13.9668    975.714   -13.9668     
1 1 1 14 18 22 o 0 384.6   17.7  ?      ?    2793.73 -6.17132     1528.56  -6.17132    343.549   173.829      
1 1 1 7  22 15 f 1 1158.4  37.3  ?      ?    4212.01 21.2422      2802.78  21.2422     256.776   21.2422      
1 1 1 13 22 15 o 0 473.4   20    ?      ?    3277.34 -75.9666     1371     -75.9666    470.638   104.033      
1 1 1 15 17 22 o 0 669.9   26    ?      ?    3246.22 -30.86       2434.08  -30.86      239.692   -30.86       
1 1 1 15 19 22 o 0 552.2   23.9  ?      ?    2920.19 -131.709     2125.21  -131.709    246.725   -131.709     
1 1 1 0  22 16 o 0 185.9   11.2  ?      ?    1164.24 -1.70564e-14 896.782  0           160.194   7.84271e-14  
1 1 1 16 20 22 o 0 666.2   28.6  ?      ?    3319.46 175.222      2236.22  175.222     166.509   175.222      
1 1 1 5  22 17 o 0 803     26.5  ?      ?    2893.87 -35.6593     2670.59  -35.6593    990.641   -35.6593     
1 1 1 11 22 17 o 0 573.1   22.2  ?      ?    2971.43 117.023      1838.04  117.023     192.251   117.023      
1 1 1 0  22 18 o 0 537.2   27.3  ?      ?    2239.44 -1.37691e-14 1909.57  0           567.872   3.25321e-14  
1 1 1 10 22 18 f 1 709.8   24.8  ?      ?    2332.35 -58.6341     2531.4   -58.6341    1242.59   -58.6341     
1 1 1 12 22 18 f 1 888.2   33.4  ?      ?    2919.18 113.522      3375.34  113.522     1377.03   113.522      
1 1 1 14 22 18 o 0 694.5   28    ?      ?    3124.12 -116.12      2566.1   -116.12     478.211   -116.12      
1 1 1 16 22 18 o 0 536.3   22.9  ?      ?    2650.02 175.065      2226.5   175.065     513.949   175.065      
1 1 1 18 20 22 o 0 178.3   12.9  ?      ?    2608.39 68.1124      449.624  68.1124     1135.55   -111.888     
1 1 1 11 22 19 o 0 833.1   30.2  ?      ?    2932.03 -66.7938     3175.66  -66.7938    1196.74   -66.7938     
1 1 1 15 22 19 o 0 980.9   39.1  ?      ?    4239.58 119.896      2731.75  119.896     11.5096   119.896      
1 1 1 19 22 19 o 0 168.3   12.4  ?      ?    1216.55 110.512      917.671  110.512     176.645   110.512      
1 1 1 19 21 22 f 1 172.4   13.2  ?      ?    839.943 122.682      784.95   122.682     295.31    122.682      
1 1 1 0  22 20 o 0 340.5   18.9  ?      ?    1704.14 -3.15881e-14 1447.18  0           461.836   6.73948e-14  
1 1 1 12 22 20 o 0 555.1   22.3  ?      ?    2710.76 -30.3936     2275.32  -30.3936    515.973   -30.3936     
1 1 1 20 22 20 o 0 129.7   13    ?      ?    1528.06 5.38934      503.418  5.38934     384.997   -174.611     
1 1 1 3  22 21 o 0 1159.2  37.6  ?      ?    3264.88 101.158      4058.8   101.158     1786.31   101.158      
1 1 1 7  22 21 o 0 816.4   29.9  ?      ?    3490.19 9.19433      2771.62  9.19433     421.651   9.19433      
1 1 1 11 22 21 o 0 1679.3  56.4  ?      ?    5438.69 177.759      3719.19  177.759     223.423   177.759      
1 1 1 15 22 21 f 1 403.1   19.1  ?      ?    2657.92 -71.6127     1584.14  -71.6127    65.51     108.387      
1 1 1 19 22 21 f 1 26.9    11.8  ?      ?    2044.25 49.599       720.385  -130.401    1910.09   -130.401     
1 1 1 21 22 21 f 1 510     25.3  ?      ?    2193.49 -91.2997     2046.89  -91.2997    813.427   -91.2997     
1 1 1 0  22 22 o 0 -1.4    8.4   ?      ?    476.168 -180         9.03003  180         324.029   4.15407e-14  
1 1 1 12 22 22 o 0 488.8   19.7  ?      ?    2898.71 44.0009      1834.25  44.0009     24.5976   44.0009      
1 1 1 18 22 22 f 1 319.8   18.5  ?      ?    2237.15 -46.6553     1318.94  -46.6553    25.0683   -46.6553     
1 1 1 20 22 22 o 0 48.9    14.1  ?      ?    1580.69 42.2876      231.947  -137.712    1112.26   -137.712     
1 1 1 22 22 22 o 0 3768.9  250.4 ?      ?    8034.22 175.257      4814.96  175.257     394.525   175.257      
1 1 1 0  1  23 o 0 669.4   29.4  ?      ?    1993.79 90           1855.63  90          789.568   90           
1 1 1 0  3  23 o 0 12.2    2.2   ?      ?    1574.2  -90          84.4034  -90         761.206   90           
1 1 1 0  5  23 o 0 4.3     2.3   ?      ?    291.29  90           4.30068  90          152.189   -90          
1 1 1 0  7  23 o 0 22.7    3.1   ?      ?    1142.41 -90          114.83   -90         496.154   90           
1 1 1 0  9  23 f 1 414.9   19.3  ?      ?    2826.81 90           1801.84  90          70.4416   -90          
1 1 1 0  11 23 o 0 616.3   27.5  ?      ?    3251.35 90           2167.68  90          55.64     90           
1 1 1 0  13 23 o 0 660.9   31.8  ?      ?    2525.89 90           2202.15  90          591.206   90           
1 1 1 0  15 23 o 0 41.6    4.7   ?      ?    148.505 -90          33.2829  -90         59.2912   90           
1 1 1 0  17 23 o 0 179     10.2  ?      ?    1713.43 90           1032.92  90          17.9405   90           
1 1 1 0  19 23 o 0 401.2   20.9  ?      ?    1848.49 90           1572.82  90          511.747   90           
1 1 1 0  21 23 o 0 11.4    9.8   ?      ?    977.232 -90          55.4554  -90         626.314   90           
1 1 1 0  23 1  o 0 381.8   16.4  ?      ?    2457.74 90           1405.02  90          85.9559   90           
1 1 1 1  2  23 o 0 2522.2  76    ?      ?    5544.57 -51.8456     4122.06  -51.8456    1178.62   -51.8456     
1 1 1 2  3  23 o 0 1151.8  36.7  ?      ?    3465.64 148.162      2823.54  148.162     997.773   148.162      
1 1 1 2  11 23 o 0 883.6   27.6  ?      ?    3915.94 46.4946      2424.22  46.4946     67.5392   -133.505     
1 1 1 0  23 3  o 0 268.8   12.6  ?      ?    2046.9  -90          1159.18  -90         55.1451   -90          
1 1 1 2  23 3  o 0 5302.7  158.3 ?      ?    9129.86 96.8738      5440     96.8738     610.891   96.8738      
1 1 1 3  10 23 o 0 1235.9  37.8  ?      ?    4151.22 -11.1402     3206.4   -11.1402    569.726   -11.1402     
1 1 1 4  5  23 o 0 1811.6  57.1  ?      ?    5214.1  140.828      3123.33  140.828     421.081   140.828      
1 1 1 4  15 23 o 0 670.2   23.2  ?      ?    3446.49 -33.8615     1927.94  -33.8615    143.555   146.138      
1 1 1 4  17 23 o 0 772.5   27.8  ?      ?    3623.5  150.47       2162.86  150.47      90.5899   150.47       
1 1 1 0  23 5  o 0 9.6     2.5   ?      ?    615.423 90           26.0846  90          306.095   -90          
1 1 1 5  16 23 o 0 583.5   21.4  ?      ?    3486.03 -62.8378     1673.56  -62.8378    331.037   117.162      
1 1 1 5  18 23 o 0 699.4   26.1  ?      ?    3317.87 146.914      2065.17  146.914     209.907   146.914      
1 1 1 5  20 23 o 0 555.2   20.1  ?      ?    2854.73 38.8921      2263.81  38.8921     316.57    38.8921      
1 1 1 6  11 23 o 0 1317.3  46.1  ?      ?    4986.54 -126.538     2807.83  -126.538    266.569   53.4623      
1 1 1 6  17 23 f 1 762.4   27.9  ?      ?    3676.71 -43.5793     2061.32  -43.5793    20.2188   136.421      
1 1 1 0  23 7  o 0 203.4   10.3  ?      ?    2089.54 90           989.029  90          134.593   -90          
1 1 1 7  8  23 o 0 1377.3  45.9  ?      ?    4012.56 3.32053      3568.73  3.32053     1056.13   3.32053      
1 1 1 7  10 23 o 0 1903.8  62.7  ?      ?    5851.23 170.679      3512.51  170.679     102.402   -9.32126     
1 1 1 7  14 23 o 0 762.2   28.8  ?      ?    3292.36 79.1896      2263.75  79.1896     305.792   79.1896      
1 1 1 7  20 23 o 0 555.5   22.1  ?      ?    2299.03 -117.183     2547.58  -117.183    1004.22   -117.183     
1 1 1 3  23 8  o 0 905.8   28.3  ?      ?    3813.74 162.216      2080.42  162.216     99.8608   162.216      
1 1 1 5  23 8  o 0 986     32    ?      ?    3796.73 35.296       2776.98  35.296      364.697   35.296       
1 1 1 8  19 23 o 0 473.4   19.1  ?      ?    1742.34 134.699      2519.23  134.699     1339.14   134.699      
1 1 1 0  23 9  f 1 968.2   42.5  ?      ?    2952.64 -90          2771.26  -90         803.525   -90          
1 1 1 6  23 9  o 0 2877.6  93.8  ?      ?    5675.34 -3.45542     5350.62  -3.45542    1789.56   -3.45542     
1 1 1 8  23 9  o 0 1150.4  40.3  ?      ?    3608.49 167.405      3233.17  167.405     995.879   167.405      
1 1 1 9  14 23 f 1 1308.5  48.1  ?      ?    3817.22 -55.0924     3369.29  -55.0924    1168.56   -55.0924     
1 1 1 9  18 23 o 0 434.4   18.8  ?      ?    2988.2  25.4908      1672.89  25.4908     367.986   -154.509     
1 1 1 7  23 10 o 0 1423.7  45.5  ?      ?    4347.52 -6.52745     3436.31  -6.52745    744.894   -6.52745     
1 1 1 10 13 23 o 0 731.7   27.8  ?      ?    4128.66 -167.242     1789.1   -167.242    591.653   12.7581      
1 1 1 10 19 23 o 0 1000.3  39.9  ?      ?    3089.24 -20.8224     3543.4   -20.8224    1484      -20.8224     
1 1 1 0  23 11 o 0 24.4    4     ?      ?    444.109 -90          60.2214  -90         230.217   90           
1 1 1 11 14 23 o 0 610.6   23.6  ?      ?    3830.15 27.0548      1551.4   27.0548     617.238   -152.945     
1 1 1 11 16 23 o 0 881.5   33.1  ?      ?    3608.84 102.592      2376.93  102.592     389.223   102.592      
1 1 1 11 22 23 o 0 604.5   25.2  ?      ?    3586.41 -17.9457     1853.61  -17.9457    360.773   162.054      
1 1 1 0  23 13 o 0 10.1    4.7   ?      ?    495.577 90           21.6514  90          296.626   -90          
1 1 1 2  23 13 o 0 1660.3  52.8  ?      ?    4291.14 129.619      4029.15  129.619     1331.76   129.619      
1 1 1 13 18 23 o 0 372.3   16.8  ?      ?    2317.91 -80.0264     1719.46  -80.0264    186.85    -80.0264     
1 1 1 7  23 14 o 0 628.6   21.8  ?      ?    3529.87 169.019      1735.3   169.019     367.852   -10.9813     
1 1 1 14 21 23 o 0 484.3   22.2  ?      ?    2814.44 165.669      1822.64  165.669     102.45    165.669      
1 1 1 0  23 15 o 0 35      6.5   ?      ?    1402.7  -90          239.443  -90         640.901   90           
1 1 1 6  23 15 f 1 657.8   21.7  ?      ?    2781.76 -44.4828     2286.48  -44.4828    665.574   -44.4828     
1 1 1 15 18 23 o 0 784.1   32.4  ?      ?    4608.31 -52.8715     1913.79  -52.8715    1039.02   127.128      
1 1 1 15 20 23 f 1 426.1   20    ?      ?    2009.62 53.4638      2007.82  53.4638     761.333   53.4638      
1 1 1 15 22 23 o 0 266.2   16.5  ?      ?    2576.97 130.905      944.824  130.905     579.979   -49.0953     
1 1 1 3  23 16 o 0 903.2   29.6  ?      ?    3381.25 66.8961      2718.3   66.8961     733.123   66.8961      
1 1 1 16 19 23 o 0 806.4   33.2  ?      ?    4122.31 -118.347     2213.18  -118.347    350.546   61.6532      
1 1 1 16 21 23 o 0 260.4   16.5  ?      ?    2441.79 26.0999      990.995  26.0999     467.003   -153.9       
1 1 1 0  23 17 o 0 117.3   9     ?      ?    995.462 -90          611.331  -90         18.0918   -90          
1 1 1 6  23 17 f 1 768.3   26.6  ?      ?    2977.33 168.112      2447.61  168.112     758.177   168.112      
1 1 1 17 20 23 o 0 501.1   21.8  ?      ?    3720.09 67.4835      1364.86  67.4835     874.639   -112.517     
1 1 1 15 23 18 o 0 533.2   22.9  ?      ?    3760.7  18.248       1546.63  18.248      852.704   -161.752     
1 1 1 18 19 23 o 0 384.6   18.3  ?      ?    1328.81 -49.2599     2050.87  -49.2599    1245.14   -49.2599     
1 1 1 18 21 23 o 0 318.4   16.6  ?      ?    1513.95 48.7971      1581.06  48.7971     710.17    48.7971      
1 1 1 0  23 19 o 0 1.5     6.6   ?      ?    607.986 -90          9.67307  -90         340.954   90           
1 1 1 6  23 19 o 0 651.1   23.6  ?      ?    3279.97 160.139      1900.84  160.139     105.974   160.139      
1 1 1 19 20 23 o 0 283.1   17.1  ?      ?    2624.74 -122.387     981.148  -122.387    539.093   57.6134      
1 1 1 19 22 23 o 0 632     30.3  ?      ?    3700.76 -27.8427     1711.59  -27.8427    337.617   152.157      
1 1 1 11 23 20 o 0 938.7   32.4  ?      ?    2229.56 59.3516      3770.64  59.3516     2341.11   59.3516      
1 1 1 19 23 20 o 0 212.8   15.2  ?      ?    497.545 172.732      751.119  172.732     464.38    172.732      
1 1 1 20 21 23 o 0 -25.2   14.8  ?      ?    580.173 -168.874     293.508  11.1256     616.825   11.1256      
1 1 1 0  23 21 o 0 3.8     9.1   ?      ?    755.427 90           22.7419  90          505.69    -90          
1 1 1 10 23 21 o 0 468.4   18    ?      ?    3510.48 -51.9198     1432.8   -51.9198    797.316   128.08       
1 1 1 16 23 21 o 0 670.6   29.8  ?      ?    3714.63 -53.6778     1934.77  -53.6778    278.562   126.322      
1 1 1 18 23 21 o 0 212.1   14.8  ?      ?    952.549 139.256      1041.46  139.256     495.105   139.256      
1 1 1 20 23 21 o 0 112.1   15.3  ?      ?    2210.51 19.2648      130.492  19.2648     1096.73   -160.735     
1 1 1 21 22 23 o 0 1472    61.1  ?      ?    4966.25 96.9478      3119.82  96.9478     396.567   96.9478      
1 1 1 5  23 22 o 0 518.9   19.3  ?      ?    3165.93 110.888      1877.5   110.888     181.75    -69.1119     
1 1 1 13 23 22 o 0 357.6   17.1  ?      ?    2026.27 56.296       1674.41  56.296      448.683   56.296       
1 1 1 15 23 22 o 0 950.9   39.6  ?      ?    3862.27 -167.998     2649.62  -167.998    366.274   -167.998     
1 1 1 17 23 22 o 0 496.6   25.2  ?      ?    3200.89 -45.5802     1559.28  -45.5802    265.174   134.42       
1 1 1 19 23 22 o 0 838.5   37.2  ?      ?    4277.28 -79.6288     2005.79  -79.6288    358.703   100.371      
1 1 1 21 23 22 o 0 191.2   19.3  ?      ?    2165.32 -34.0362     625.145  -34.0362    559.712   145.964      
1 1 1 0  23 23 o 0 91      11.8  ?      ?    1330.94 90           649.814  90          231.659   -90          
1 1 1 4  23 23 o 0 537.1   20    ?      ?    2597.12 87.4631      2248.09  87.4631     579.347   87.4631      
1 1 1 8  23 23 o 0 291.2   14.3  ?      ?    2344.2  -27.3472     1244.47  -27.3472    213.047   152.653      
1 1 1 12 23 23 o 0 1219.9  44.9  ?      ?    4238.69 -115.543     3153.43  -115.543    615.107   -115.543     
1 1 1 14 23 23 o 0 932     39    ?      ?    5631.89 72.4037      1604.89  72.4037     1661.23   -107.596     
1 1 1 16 23 23 o 0 1094.3  45.3  ?      ?    3629.39 144.698      3045.07  144.698     992.257   144.698      
1 1 1 18 23 23 o 0 176.4   17.1  ?      ?    1711.96 141.694      733.395  141.694     207.381   -38.306      
1 1 1 20 23 23 o 0 212.6   20.7  ?      ?    3386.41 -142.719     207.671  -142.719    1638.42   37.2812      
1 1 1 22 23 23 o 0 462.4   30.4  ?      ?    3031.29 15.9347      1398.57  15.9347     191.329   -164.065     
1 1 1 0  24 0  f 1 340.9   21.1  ?      ?    808.956 180          585.438  180         160.427   -180         
1 1 1 0  2  24 f 1 338.3   15.6  ?      ?    1908.75 -2.32979e-15 1266.71  0           263.364   8.87593e-15  
1 1 1 0  4  24 o 0 46.2    4     ?      ?    1210.23 180          233.048  180         401.072   -1.72094e-14 
1 1 1 0  6  24 o 0 435.2   21.4  ?      ?    2975.97 180          1821.27  180         112.593   3.64729e-14  
1 1 1 0  8  24 o 0 165.5   9     ?      ?    1538.89 -180         957.518  180         35.8601   7.24409e-13  
1 1 1 0  10 24 o 0 58.5    4.4   ?      ?    260.505 180          84.2104  180         82.069    -2.45152e-13 
1 1 1 0  12 24 f 1 82.1    5.5   ?      ?    1083.22 180          432.104  180         252.318   -6.29002e-14 
1 1 1 0  14 24 o 0 100.2   7.4   ?      ?    344.647 6.9713e-15   182.009  0           30.1786   -180         
1 1 1 0  16 24 o 0 3.4     4.1   ?      ?    1153.82 1.16147e-15  17.9958  0           658.723   -180         
1 1 1 0  18 24 o 0 1206.6  53.7  ?      ?    3890.88 180          2721.34  180         504.569   180          
1 1 1 0  20 24 f 1 890.3   44    ?      ?    844.332 8.23129e-15  2741.68  0           2152.31   -2.25399e-15 
1 1 1 0  22 24 o 0 392.7   23    ?      ?    2718.94 180          1821.1   180         25.2885   -180         
1 1 1 1  3  24 f 1 1786.9  54.3  ?      ?    3731.98 -117.076     3802.51  -117.076    1855.75   -117.076     
1 1 1 1  15 24 o 0 682.6   22.7  ?      ?    1924.36 -3.62275     2825.69  -3.62275    1692.75   -3.62275     
1 1 1 1  21 24 o 0 805.5   28.4  ?      ?    2882.67 -39.022      3123.81  -39.022     1173.48   -39.022      
1 1 1 0  24 2  f 1 1152.3  49.9  ?      ?    6010.57 6.62228e-15  2400.04  0           779.843   -180         
1 1 1 2  4  24 o 0 1028.3  32.9  ?      ?    4667.33 86.3976      1920.26  86.3976     480.775   -93.6024     
1 1 1 3  24 3  o 0 1177.2  37.6  ?      ?    3772.48 58.3874      2655.92  58.3874     720.03    58.3874      
1 1 1 3  9  24 o 0 746     24.5  ?      ?    2169.4  -97.7435     2923.91  -97.7435    1568.95   -97.7435     
1 1 1 3  17 24 o 0 698.2   23.3  ?      ?    2610.62 97.7127      2437.2   97.7127     964.951   97.7127      
1 1 1 0  24 4  o 0 586     26.2  ?      ?    2509.1  180          1715.82  180         392.094   -180         
1 1 1 2  24 4  o 0 1857.1  56.4  ?      ?    6140.86 45.3197      2727.62  45.3197     449.547   -134.68      
1 1 1 4  6  24 o 0 964.9   30.9  ?      ?    3245.12 -14.7506     3003.21  -14.7506    965.734   -14.7506     
1 1 1 4  16 24 o 0 1019.2  32.8  ?      ?    3317.61 -133.655     2948.73  -133.655    1067.8    -133.655     
1 1 1 3  24 5  o 0 1906.7  58.1  ?      ?    3719.86 -35.7944     4926.37  -35.7944    2556.48   -35.7944     
1 1 1 5  24 5  f 1 1324.7  40.4  ?      ?    2988.08 111.922      4038.2   111.922     2150.91   111.922      
1 1 1 5  11 24 o 0 802.8   27.2  ?      ?    2933.04 -169.421     2623.97  -169.421    843.866   -169.421     
1 1 1 5  21 24 o 0 605.4   22.1  ?      ?    3577.76 -14.1454     1955.65  -14.1454    362.877   165.855      
1 1 1 0  24 6  o 0 280.2   12.9  ?      ?    2359.36 180          1456.35  180         88.2494   -4.86924e-14 
1 1 1 6  24 6  f 1 855.5   27.5  ?      ?    2119.52 145.775      3256.69  145.775     1929.87   145.775      
1 1 1 6  16 24 o 0 563.2   20.9  ?      ?    3063.99 73.2932      1774.5   73.2932     63.8221   73.2932      
1 1 1 6  20 24 f 1 544     21.6  ?      ?    1383.54 -95.3876     2886.79  -95.3876    1965.27   -95.3876     
1 1 1 5  24 7  o 0 2392.8  75.3  ?      ?    5612.39 -78.8596     4576.7   -78.8596    1073.39   -78.8596     
1 1 1 7  24 7  o 0 974.4   32.8  ?      ?    3871.22 128.903      2618.87  128.903     232.939   128.903      
1 1 1 7  9  24 o 0 1777    58.3  ?      ?    4899.25 -93.9825     3774.31  -93.9825    794.9     -93.9825     
1 1 1 7  11 24 o 0 801.6   28.7  ?      ?    3979.46 130.455      2016.96  130.455     367.071   -49.5449     
1 1 1 7  13 24 o 0 631.3   24.1  ?      ?    3768.41 -87.9646     1672.6   -87.9646    490.884   92.0354      
1 1 1 7  17 24 o 0 1002.4  39.6  ?      ?    3885.9  -63.6747     2511.61  -63.6747    387.177   -63.6747     
1 1 1 7  21 24 o 0 461     20.4  ?      ?    1806.18 41.163       2322.52  41.163      1170.58   41.163       
1 1 1 0  24 8  o 0 1302.1  56    ?      ?    3141.26 4.71079e-15  3154.37  0           1110.26   -8.67311e-15 
1 1 1 8  16 24 o 0 504.9   21.7  ?      ?    3259.7  -73.5688     1459.13  -73.5688    334.465   106.431      
1 1 1 8  20 24 o 0 610.4   24.4  ?      ?    2897.61 131.102      2356.92  131.102     491.284   131.102      
1 1 1 8  22 24 o 0 760.5   30.7  ?      ?    4095.62 -48.2309     2084.22  -48.2309    458.585   131.769      
1 1 1 5  24 9  o 0 775.5   24.5  ?      ?    4213.89 99.1873      1870.36  99.1873     733.878   -80.8127     
1 1 1 9  24 9  f 1 1382.7  46.3  ?      ?    3426.77 94.6887      3753.9   94.6887     1679.73   94.6887      
1 1 1 9  15 24 o 0 644.4   24.7  ?      ?    2607.52 33.2859      2234.34  33.2859     790.88    33.2859      
1 1 1 9  19 24 o 0 431.1   19.7  ?      ?    3285.94 9.38066      1417.29  9.38066     743.383   -170.619     
1 1 1 9  23 24 o 0 1003.4  37.2  ?      ?    4834.66 -132.922     2290.65  -132.922    626.782   47.0782      
1 1 1 0  24 10 o 0 4.1     3.6   ?      ?    38.7471 180          0.605297 180         24.3396   -4.75196e-13 
1 1 1 10 24 10 o 0 1024.2  37.7  ?      ?    3779.76 -24.5424     2693.99  -24.5424    450.936   -24.5424     
1 1 1 10 12 24 o 0 879.3   33    ?      ?    3329.18 177.43       2599.07  177.43      703       177.43       
1 1 1 10 18 24 f 1 676.5   28.2  ?      ?    1917.12 -106.828     3152.71  -106.828    1874.62   -106.828     
1 1 1 10 20 24 o 0 706.4   30    ?      ?    3019.44 -58.0835     2577.77  -58.0835    665.86    -58.0835     
1 1 1 10 22 24 o 0 2031.2  74.9  ?      ?    5845.37 152.012      3974.59  152.012     408.842   152.012      
1 1 1 1  24 11 o 0 1356.5  43.5  ?      ?    4149.05 -149.372     3474.82  -149.372    851.319   -149.372     
1 1 1 11 13 24 o 0 2467    89.3  ?      ?    6761.02 91.6336      3764.67  91.6336     20.5822   -88.3664     
1 1 1 11 15 24 o 0 573.4   22.5  ?      ?    3532.83 -122.277     1532.7   -122.277    395.885   57.723       
1 1 1 11 19 24 o 0 914     37    ?      ?    3090.73 -122.876     3207.17  -122.876    1232.86   -122.876     
1 1 1 11 21 24 f 1 287.7   16.3  ?      ?    2350.26 66.6343      1204.43  66.6343     251.867   -113.366     
1 1 1 11 23 24 o 0 240.3   14.4  ?      ?    1536.49 -55.5674     1257.22  -55.5674    347.391   -55.5674     
1 1 1 0  24 12 f 1 121.1   7.9   ?      ?    2558.53 1.23957e-14  890.774  0           740.155   -180         
1 1 1 2  24 12 o 0 1674.9  53.5  ?      ?    4745.52 128.227      3740.63  128.227     794.538   128.227      
1 1 1 4  24 12 o 0 729.1   24.8  ?      ?    2098.27 73           2833.66  73          1554.84   73           
1 1 1 12 24 12 o 0 1411.9  55.1  ?      ?    6505.87 45.5488      2061.45  45.5488     1583.69   -134.451     
1 1 1 12 18 24 o 0 363.3   15.9  ?      ?    2871.64 7.95127      1359.45  7.95127     489.955   -172.049     
1 1 1 12 22 24 o 0 1157.8  44    ?      ?    3932.77 -98.6608     3173.33  -98.6608    820.114   -98.6608     
1 1 1 1  24 13 o 0 1323.1  42.5  ?      ?    3981.06 -54.8142     3434.55  -54.8142    961.299   -54.8142     
1 1 1 11 24 13 o 0 522.5   20.5  ?      ?    3344.22 -102.667     1497.58  -102.667    369.774   77.3328      
1 1 1 13 19 24 o 0 525     23.3  ?      ?    2690.52 -128.435     2096.17  -128.435    408.569   -128.435     
1 1 1 13 23 24 o 0 242.5   15.4  ?      ?    3441.32 74.0975      360.207  74.0975     1615.05   -105.902     
1 1 1 0  24 14 o 0 521.8   25.9  ?      ?    4020.17 180          1906.33  180         590.496   -1.21087e-14 
1 1 1 2  24 14 o 0 712.2   23.9  ?      ?    2819.34 -16.9643     2422.11  -16.9643    706.063   -16.9643     
1 1 1 4  24 14 o 0 1181.2  38.1  ?      ?    3530.5  -174.528     3312.3   -174.528    1252.28   -174.528     
1 1 1 14 16 24 o 0 1214.9  50.9  ?      ?    3982.49 -70.082      3575.41  -70.082     972.932   -70.082      
1 1 1 14 18 24 o 0 405.1   18.8  ?      ?    1733.48 119.381      2095.11  119.381     999.207   119.381      
1 1 1 14 20 24 f 1 941.7   38.7  ?      ?    2294.47 -149.202     3551.91  -149.202    2145.54   -149.202     
1 1 1 14 22 24 o 0 218.6   14.8  ?      ?    2107.02 19.4334      879.72   19.4334     341.626   -160.567     
1 1 1 3  24 15 o 0 720.2   24    ?      ?    3549.98 36.06        2089.41  36.06       23.1851   36.06        
1 1 1 15 23 24 o 0 747.3   33.2  ?      ?    2403.86 -30.1407     2715.12  -30.1407    1367.76   -30.1407     
1 1 1 0  24 16 o 0 128.1   10    ?      ?    570.444 180          429.788  180         92.4704   -180         
1 1 1 4  24 16 o 0 743.9   24.9  ?      ?    2801    1.00649      2500.23  1.00649     904.636   1.00649      
1 1 1 8  24 16 o 0 833.1   28.9  ?      ?    4186.84 -114.836     1954.22  -114.836    352.398   65.1639      
1 1 1 10 24 16 o 0 519     20.5  ?      ?    2523.66 84.3233      2314.94  84.3233     592.407   84.3233      
1 1 1 14 24 16 o 0 432     19.4  ?      ?    1669.32 -26.5627     2299.5   -26.5627    1214.69   -26.5627     
1 1 1 16 18 24 o 0 331.8   15.7  ?      ?    2764.56 149.483      1218.39  149.483     492.447   -30.517      
1 1 1 16 20 24 o 0 856.7   36    ?      ?    2688.88 -34.3632     3045.05  -34.3632    1443.53   -34.3632     
1 1 1 16 22 24 o 0 246.9   17.3  ?      ?    2190.77 -137.524     973.571  -137.524    265.394   42.4758      
1 1 1 1  24 17 o 0 613.9   21.8  ?      ?    3308.31 144.958      1873.1   144.958     37.0367   -35.0422     
1 1 1 3  24 17 o 0 1362.3  44.1  ?      ?    4735.95 -69.4181     2964.78  -69.4182    279.877   -69.4182     
1 1 1 7  24 17 o 0 778.1   26    ?      ?    3343.09 131.641      2230.49  131.641     398.992   131.641      
1 1 1 9  24 17 o 0 524.1   19    ?      ?    2317.75 75.8312      2440.32  75.8312     867.515   75.8312      
1 1 1 17 21 24 o 0 164.6   14.9  ?      ?    644.861 -96.6836     631.584  -96.6836    263.978   -96.6836     
1 1 1 17 23 24 o 0 152.5   15.8  ?      ?    2398.4  143.401      329.097  143.401     979.071   -36.5988     
1 1 1 0  24 18 o 0 51.6    8.1   ?      ?    400.129 -180         123.69   180         105.894   2.76651e-13  
1 1 1 8  24 18 f 1 1050.8  36    ?      ?    3745.56 -10.8211     3313.42  -10.8211    773.962   -10.8211     
1 1 1 18 20 24 o 0 1102    43    ?      ?    3526.1  -131.145     3163.14  -131.145    1139.18   -131.145     
1 1 1 18 22 24 o 0 227.9   16.8  ?      ?    890.575 -48.6469     1063.57  -48.6469    574.048   -48.6469     
1 1 1 19 21 24 o 0 410.6   22.2  ?      ?    1200.24 -73.1891     1953.1   -73.1891    1289      -73.1891     
1 1 1 19 23 24 o 0 207     20    ?      ?    2520.06 51.9594      568.38   51.9594     797.867   -128.041     
1 1 1 0  24 20 f 1 149.6   12    ?      ?    96.1481 -180         108.434  180         40.96     180          
1 1 1 12 24 20 o 0 1103.3  40.1  ?      ?    2609.56 3.91865      3898.82  3.91865     2278.25   3.91865      
1 1 1 16 24 20 o 0 448.1   21.8  ?      ?    1693.44 -133.626     2153.78  -133.626    1149.42   -133.626     
1 1 1 20 24 20 o 0 253.8   17.8  ?      ?    1584.56 79.0258      1196.05  79.0258     321.272   79.0258      
1 1 1 20 22 24 o 0 378.4   24.3  ?      ?    1802.47 -128.016     1634.82  -128.016    651.553   -128.016     
1 1 1 7  24 21 o 0 555     21.4  ?      ?    2951.03 176.453      2104.53  176.453     220.031   176.453      
1 1 1 13 24 21 o 0 1278    48.4  ?      ?    4158.15 -81.9818     3358.64  -81.9818    850.354   -81.9818     
1 1 1 15 24 21 f 1 221.3   14.6  ?      ?    679.273 145.79       1078.9   145.79      676.344   145.79       
1 1 1 17 24 21 o 0 310.6   18.9  ?      ?    1868.45 164.828      1414.18  164.828     353.073   164.828      
1 1 1 19 24 21 o 0 838     37.4  ?      ?    4127.55 -178.309     2073.58  -178.309    198.771   1.69145      
1 1 1 21 24 21 o 0 140.1   18.3  ?      ?    1136.22 -87.9559     505.981  -87.9559    112.9     92.0441      
1 1 1 21 23 24 o 0 953.1   45.5  ?      ?    3152.77 26.8891      2733.99  26.8891     1085.59   26.8891      
1 1 1 0  24 22 o 0 5.9     10.1  ?      ?    1253.89 -180         43.3877  180         787.267   4.07838e-15  
1 1 1 6  24 22 o 0 1298.6  44.2  ?      ?    4679.74 22.8672      3257.12  22.8672     299.695   22.8672      
1 1 1 8  24 22 o 0 920.3   34.2  ?      ?    4199.84 151.109      2501.64  151.109     107.512   -28.8914     
1 1 1 12 24 22 o 0 941.8   33.6  ?      ?    3862.1  -117.93      2659.12  -117.93     349.701   -117.93      
1 1 1 16 24 22 o 0 293.3   17.7  ?      ?    2122.01 22.8783      1227.54  22.8783     29.9943   22.8783      
1 1 1 18 24 22 o 0 835.8   39.7  ?      ?    3655.61 85.357       2297.71  85.357      294.173   85.357       
1 1 1 20 24 22 o 0 662.2   32.2  ?      ?    2862.4  177.21       2183.63  177.21      628.047   177.21       
1 1 1 22 24 22 f 1 429.9   28.5  ?      ?    1634.14 -112.611     1800.49  -112.611    941.63    -112.611     
1 1 1 5  24 23 o 0 345     15.3  ?      ?    1310.79 56.2335      1932.58  56.2335     1113.95   56.2335      
1 1 1 7  24 23 o 0 878     32.7  ?      ?    2395.4  -39.4072     3357.08  -39.4072    1885.58   -39.4072     
1 1 1 9  24 23 o 0 920.2   34.3  ?      ?    2840.1  76.6056      3186.92  76.6056     1472.77   76.6056      
1 1 1 11 24 23 o 0 810     30.1  ?      ?    3475.26 -119.595     2478.63  -119.595    421.046   -119.595     
1 1 1 15 24 23 o 0 1378.9  56.2  ?      ?    5096.39 -87.6965     2879.41  -87.6965    25.3368   -87.6965     
1 1 1 17 24 23 o 0 510.4   29    ?      ?    3530.11 17.6095      1377.27  17.6095     545.765   -162.391     
1 1 1 19 24 23 o 0 986.6   44.4  ?      ?    3988.51 40.3975      2506.93  40.3975     348.161   40.3975      
1 1 1 21 24 23 o 0 603.4   34.5  ?      ?    2702.16 164.553      1990.85  164.553     581.023   164.553      
1 1 1 23 24 23 o 0 241.9   29.2  ?      ?    2667.57 -95.0473     581.457  -95.0473    776.522   84.9527      
1 1 1 0  24 24 o 0 74.7    13.9  ?      ?    1362.74 1.02747e-14  531.223  0           332.293   -180         
1 1 1 12 24 24 o 0 667.1   26.1  ?      ?    3844.36 152.193      1789.37  152.193     393.657   -27.8067     
1 1 1 14 24 24 o 0 55.1    12.6  ?      ?    863.86  54.7377      21.0149  -125.262    500.419   -125.262     
1 1 1 16 24 24 o 0 -3.2    15.2  ?      ?    894.165 152.228      400.526  -27.7717    883.935   -27.7717     
1 1 1 18 24 24 o 0 631.5   35.1  ?      ?    5047.38 31.331       996.965  31.331      1719.16   -148.669     
1 1 1 20 24 24 o 0 70.8    20.5  ?      ?    2116.49 148.142      219.639  -31.8581    1319.94   -31.8581     
1 1 1 22 24 24 o 0 477.1   34.9  ?      ?    2056.83 -91.7103     1708.79  -91.7103    662.837   -91.7103     
1 1 1 24 24 24 f 1 1115.2  100   ?      ?    3333.84 -89.7374     2262.75  -89.7374    633.338   -89.7374     
1 1 1 0  1  25 o 0 177     9.3   ?      ?    711.342 -90          617.114  -90         168.429   -90          
1 1 1 0  3  25 o 0 95.4    5.7   ?      ?    142.868 -90          75.1025  -90         15.4301   90           
1 1 1 0  5  25 o 0 4.9     3     ?      ?    498.184 -90          9.45778  -90         306.308   90           
1 1 1 0  7  25 o 0 339.4   17.3  ?      ?    1300.26 90           1429.23  90          608.558   90           
1 1 1 0  9  25 f 1 1116.9  49    ?      ?    2367.51 90           2808.49  90          1318.88   90           
1 1 1 0  11 25 f 1 638.3   28.6  ?      ?    2305.41 -90          2094.26  -90         662.879   -90          
1 1 1 0  13 25 o 0 117.7   7.2   ?      ?    767.566 90           507.898  90          53.319    90           
1 1 1 0  15 25 o 0 253.1   13.9  ?      ?    2003.05 -90          1251.37  -90         91.1468   -90          
1 1 1 0  17 25 o 0 6.5     5.3   ?      ?    999.037 -90          26.4466  -90         537.064   90           
1 1 1 0  19 25 o 0 584.2   27.7  ?      ?    2709.08 90           2290.53  90          424.37    90           
1 1 1 0  21 25 o 0 124.8   12.8  ?      ?    638.199 -90          501.467  -90         82.1455   -90          
1 1 1 0  23 25 o 0 22.3    13.3  ?      ?    514.825 -90          52.9373  -90         272.346   90           
1 1 1 0  25 1  o 0 25      3.2   ?      ?    130.7   90           17.9397  90          65.2433   -90          
1 1 1 1  24 25 o 0 399.6   18.2  ?      ?    2397.52 -139.718     1707.45  -139.718    233.193   -139.718     
1 1 1 0  25 3  o 0 567.5   25.2  ?      ?    2787.86 90           2047.63  90          264.606   90           
1 1 1 3  10 25 o 0 738.9   24.3  ?      ?    2326.31 -58.0757     2740.78  -58.0757    1331.16   -58.0757     
1 1 1 3  22 25 o 0 994.6   37.3  ?      ?    2574.73 -39.1673     3688.57  -39.1673    2062.72   -39.1673     
1 1 1 3  24 25 o 0 385     18    ?      ?    1043.69 108.819      2080.6   108.819     1447.29   108.819      
1 1 1 4  19 25 o 0 517.7   20.1  ?      ?    1633.76 -172.505     2717.33  -172.505    1625.32   -172.505     
1 1 1 4  21 25 o 0 507.5   19.2  ?      ?    3004.22 -117.864     1891.08  -117.864    26.8625   62.1356      
1 1 1 4  23 25 o 0 398.2   16.7  ?      ?    2549.81 -162.668     1623.44  -162.668    55.7286   -162.668     
1 1 1 0  25 5  o 0 51      4.3   ?      ?    1343.81 -90          338.831  -90         521.203   90           
1 1 1 2  25 5  o 0 1169.5  33.7  ?      ?    3360.72 179.962      3466.62  179.962     1356.84   179.962      
1 1 1 4  25 5  o 0 1779.5  54.2  ?      ?    4955.17 -173.82      3809.47  -173.82     748.642   -173.82      
1 1 1 5  6  25 o 0 714     23.2  ?      ?    3404.38 -31.9256     2114.62  -31.9256    41.0065   -31.9256     
1 1 1 5  14 25 o 0 599.8   22.2  ?      ?    2309.84 -177.429     2275.31  -177.429    975.182   -177.429     
1 1 1 5  22 25 o 0 483     18.9  ?      ?    2374.42 82.3392      2084.73  82.3392     607.612   82.3392      
1 1 1 6  21 25 o 0 680.3   25.8  ?      ?    4054.35 -96.0638     1875.6   -96.0638    673.224   83.9362      
1 1 1 0  25 7  o 0 193.7   10.3  ?      ?    1037.1  -90          875.144  -90         213.877   -90          
1 1 1 2  25 7  o 0 758.4   24.7  ?      ?    3503.1  49.568       2251.33  49.568      61.7454   49.568       
1 1 1 4  25 7  o 0 774.1   26.2  ?      ?    3980.94 47.5502      1988.6   47.5502     457.538   -132.45      
1 1 1 7  24 25 f 1 222.5   14.2  ?      ?    2520.34 -88.5096     714.823  -88.5096    761.579   91.4904      
1 1 1 3  25 8  o 0 704.6   23.2  ?      ?    3166.71 17.4853      2244.72  17.4853     290.561   17.4853      
1 1 1 8  19 25 o 0 331.9   16    ?      ?    1200.19 -135.702     1932.62  -135.702    1164.4    -135.702     
1 1 1 8  21 25 f 1 578.1   24.7  ?      ?    2729.93 90.1399      2232.61  90.1399     534.411   90.1399      
1 1 1 8  23 25 o 0 371.8   19.2  ?      ?    2148.35 -114.177     1653.94  -114.177    374.624   -114.177     
1 1 1 0  25 9  f 1 64.7    5.5   ?      ?    773.168 90           262.327  90          229.337   -90          
1 1 1 9  14 25 o 0 1194.4  44.7  ?      ?    4209.52 160.876      2783.04  160.876     478.813   160.876      
1 1 1 9  20 25 f 1 287     16.1  ?      ?    2481.79 52.4471      1148.86  52.4471     409.388   -127.553     
1 1 1 9  22 25 o 0 289.7   16.5  ?      ?    1440.79 -19.6488     1565.47  -19.6488    698.154   -19.6488     
1 1 1 9  24 25 o 0 264.5   16.1  ?      ?    1923.39 -130.061     1182.97  -130.061    82.1118   -130.061     
1 1 1 3  25 10 o 0 1565.4  49.7  ?      ?    5079.8  -103.616     3260.61  -103.616    159.998   -103.616     
1 1 1 9  25 10 o 0 551.1   20.7  ?      ?    2585.25 -149.727     2009.49  -149.727    538.397   -149.727     
1 1 1 10 15 25 o 0 505     21.1  ?      ?    2927.55 -43.7076     1996.02  -43.7076    16.3227   -43.7076     
1 1 1 10 19 25 o 0 275.9   15.2  ?      ?    1279.8  119.089      1600.2   119.089     794.353   119.089      
1 1 1 10 21 25 f 1 748.8   32.1  ?      ?    2261.43 -136.446     2997.57  -136.446    1614.96   -136.446     
1 1 1 10 23 25 f 1 434     21.7  ?      ?    1482.44 82.0539      2091.55  82.0539     1228.53   82.0539      
1 1 1 0  25 11 f 1 248.4   12.5  ?      ?    437.302 -90          557.564  -90         283.075   -90          
1 1 1 8  25 11 o 0 568.9   19.5  ?      ?    3424.64 -177.115     1639.87  -177.115    307.107   2.88494      
1 1 1 11 16 25 o 0 478.4   21    ?      ?    2489.19 -53.4377     2096.92  -53.4377    448.79    -53.4377     
1 1 1 11 18 25 o 0 475.7   22.4  ?      ?    3275.37 -29.825      1594.88  -29.825     483.62    150.175      
1 1 1 11 20 25 o 0 266.4   15.9  ?      ?    1859.05 166.879      1324.13  166.879     183.646   166.879      
1 1 1 11 22 25 o 0 259.5   16.3  ?      ?    1815.37 98.4397      1257.68  98.4397     184.985   98.4397      
1 1 1 1  25 12 o 0 851.5   27.9  ?      ?    3508.72 -97.8403     2472.92  -97.8403    322.971   -97.8403     
1 1 1 3  25 12 o 0 873.5   29.5  ?      ?    4681.09 145.931      1827.51  145.931     986.692   -34.069      
1 1 1 12 21 25 o 0 766.4   31.4  ?      ?    2830.38 17.6238      2713.95  17.6238     1025.57   17.6238      
1 1 1 12 23 25 o 0 86.4    11.3  ?      ?    1118.93 -84.7931     211.797  -84.7931    423.054   95.2069      
1 1 1 0  25 13 o 0 -10.4   5.7   ?      ?    606.934 -90          3.03485  -90         360.348   90           
1 1 1 10 25 13 o 0 1190.3  44.3  ?      ?    4258.95 -19.3263     2757.05  -19.3263    418.312   -19.3263     
1 1 1 13 16 25 o 0 743.2   32.3  ?      ?    2361.04 169.277      3105.29  169.277     1586.47   169.277      
1 1 1 13 18 25 o 0 425.4   19.8  ?      ?    2128.22 -116.289     1974.74  -116.289    648.332   -116.289     
1 1 1 13 20 25 o 0 601.3   25.3  ?      ?    2506.86 97.8099      2376.15  97.8099     867.806   97.8099      
1 1 1 13 22 25 o 0 324.9   17.8  ?      ?    2342.56 -110.306     1296.19  -110.306    45.9837   69.6943      
1 1 1 13 24 25 o 0 133.5   14.3  ?      ?    964.044 -110.529     536.254  -110.529    6.8225    -110.529     
1 1 1 1  25 14 o 0 1046.9  34    ?      ?    3785.34 61.8664      2866.06  61.8664     645.711   61.8664      
1 1 1 5  25 14 o 0 852.1   28.3  ?      ?    4055.21 145.606      2128.09  145.606     165.962   -34.3935     
1 1 1 11 25 14 o 0 964.1   36.3  ?      ?    3440.55 -128.452     3282.9   -128.452    950.03    -128.452     
1 1 1 14 15 25 o 0 697.7   29.1  ?      ?    2854.55 9.34097      2699.05  9.34097     852.033   9.34097      
1 1 1 14 19 25 o 0 721.8   30.8  ?      ?    3413.06 173.477      2302.11  173.477     232.449   173.477      
1 1 1 14 23 25 o 0 306.9   18.8  ?      ?    2420.06 161.53       1142.32  161.53      200.048   -18.4705     
1 1 1 0  25 15 o 0 779.3   38.3  ?      ?    3148.6  -90          2247.07  -90         404.12    -90          
1 1 1 4  25 15 o 0 714.8   24    ?      ?    3518.81 28.7389      2025.01  28.7389     39.9025   28.7389      
1 1 1 6  25 15 o 0 868.1   28.8  ?      ?    2026.6  140.681      3127.69  140.681     2003.76   140.681      
1 1 1 10 25 15 o 0 506.8   20.4  ?      ?    1910.66 -100.632     2572.87  -100.632    1282.17   -100.632     
1 1 1 15 16 25 o 0 402.4   18.8  ?      ?    2227.59 -99.2747     1851.33  -99.2747    445.111   -99.2747     
1 1 1 15 18 25 o 0 779.3   32.4  ?      ?    3774.26 27.7792      2292.07  27.7792     12.588    -152.221     
1 1 1 15 20 25 o 0 177.5   13.6  ?      ?    1786.82 106.788      760.214  106.788     280.881   -73.212      
1 1 1 15 22 25 o 0 54.9    12.8  ?      ?    854.479 88.602       22.0536  -91.398     500.287   -91.398      
1 1 1 15 24 25 o 0 521.7   28.7  ?      ?    2978.79 66.2264      1715.85  66.2264     63.112    66.2264      
1 1 1 5  25 16 o 0 729     25.6  ?      ?    3364.37 -7.34746     2101.83  -7.34746    243.432   -7.34746     
1 1 1 11 25 16 o 0 546.8   22.1  ?      ?    2367.61 158.99       2435.77  158.99      871.437   158.99       
1 1 1 13 25 16 o 0 1159.5  43.8  ?      ?    4083.86 12.5902      3304.42  12.5902     690.133   12.5902      
1 1 1 16 17 25 o 0 752.1   31.7  ?      ?    3223.97 173.793      2533.34  173.793     552.738   173.793      
1 1 1 16 21 25 o 0 122.4   14.1  ?      ?    834.333 50.8214      453.237  50.8214     17.4503   -129.179     
1 1 1 16 23 25 o 0 799.8   36.2  ?      ?    3240.51 -145.999     2375.36  -145.999    623.668   -145.999     
1 1 1 0  25 17 o 0 45.2    8.6   ?      ?    94.6267 -90          25.5607  -90         28.3262   90           
1 1 1 10 25 17 o 0 591.6   22.4  ?      ?    2895.13 57.5984      2294.3   57.5984     391.132   57.5984      
1 1 1 17 18 25 o 0 571.9   24.7  ?      ?    3224.78 41.9395      1877.26  41.9395     45.6192   -138.061     
1 1 1 17 20 25 o 0 170.7   14.1  ?      ?    1472.15 -126.356     782.516  -126.356    53.7552   53.6439      
1 1 1 17 22 25 o 0 201.2   17    ?      ?    1743.52 165.749      860.859  165.749     89.0627   -14.2508     
1 1 1 17 24 25 o 0 410.9   26.5  ?      ?    1980.95 -111.199     1669.93  -111.199    611.807   -111.199     
1 1 1 1  25 18 o 0 602.5   22.1  ?      ?    2144.69 -114.617     2934.04  -114.617    1432.56   -114.617     
1 1 1 9  25 18 o 0 785.6   27.8  ?      ?    2910.55 -116.561     2953.54  -116.561    1074.82   -116.561     
1 1 1 13 25 18 o 0 705.8   28.2  ?      ?    3532.47 52.1879      2237.41  52.1879     43.9784   52.1879      
1 1 1 17 25 18 o 0 281.9   16.6  ?      ?    2462.78 -100.746     1079.07  -100.746    376.466   79.2539      
1 1 1 18 19 25 o 0 905.5   35.9  ?      ?    4030.31 -27.3348     2385.8   -27.3348    83.0224   -27.3348     
1 1 1 18 21 25 o 0 39.7    12.7  ?      ?    1614.38 -8.14935     340.095  171.851     1225.59   171.851      
1 1 1 18 23 25 o 0 347.8   25.3  ?      ?    3841.97 136.566      610.44   136.566     1457.58   -43.4336     
1 1 1 0  25 19 o 0 213.8   15.2  ?      ?    1513.61 90           1311.74  90          260.619   90           
1 1 1 8  25 19 o 0 889.4   31.1  ?      ?    3438.17 -175.776     2946.92  -175.776    742.866   -175.776     
1 1 1 12 25 19 f 1 383.9   17.9  ?      ?    3113.5  -38.4694     1251.61  -38.4694    681.068   141.531      
1 1 1 16 25 19 o 0 198.8   14.1  ?      ?    2494.34 104.573      615.398  104.573     853.605   -75.4271     
1 1 1 18 25 19 o 0 96.6    13.1  ?      ?    1142.47 24.59        290.877  24.59       356.159   -155.41      
1 1 1 19 20 25 o 0 125.9   14.7  ?      ?    571.069 -5.58013     374.889  -5.58013    59.9212   -5.58013     
1 1 1 19 22 25 o 0 2012    76.7  ?      ?    5058.11 -179.655     4032.29  -179.655    1292.05   -179.655     
1 1 1 19 24 25 o 0 188.4   23.5  ?      ?    1705.65 -20.7375     708.437  -20.7375    173.491   159.263      
1 1 1 7  25 20 o 0 667.3   25.1  ?      ?    3004.59 38.7079      2468.22  38.7079     557.337   38.7079      
1 1 1 13 25 20 o 0 1257.8  47.9  ?      ?    4149.87 160.911      3298.96  160.911     808.427   160.911      
1 1 1 17 25 20 o 0 273.9   17.5  ?      ?    1311.84 -58.8502     1375.44  -58.8502    634.93    -58.8502     
1 1 1 19 25 20 o 0 113.9   14    ?      ?    1680.27 -17.9138     322.842  -17.9138    596.148   162.086      
1 1 1 20 21 25 o 0 447.8   25.3  ?      ?    3034.16 -23.4254     1399.02  -23.4254    253.213   156.575      
1 1 1 20 23 25 o 0 280.6   25.3  ?      ?    982.345 138.175      1186.42  138.175     675.39    138.175      
1 1 1 0  25 21 o 0 7.8     11.5  ?      ?    101.878 90           4.35145  90          62.9903   -90          
1 1 1 4  25 21 o 0 398     15.7  ?      ?    1023.99 134.443      2256.48  134.443     1600.39   134.443      
1 1 1 6  25 21 o 0 723     25.7  ?      ?    3037.66 -86.0673     2613.43  -86.0673    699.093   -86.0673     
1 1 1 8  25 21 f 1 528.5   22.1  ?      ?    3291.65 8.16415      1741.65  8.16415     308.548   -171.836     
1 1 1 14 25 21 f 1 1144.2  46.9  ?      ?    3602.33 21.7977      3224.92  21.7977     1136.52   21.7977      
1 1 1 16 25 21 o 0 585.8   27.8  ?      ?    3417.96 -155.852     1732.22  -155.852    187.869   24.1476      
1 1 1 18 25 21 o 0 14.5    13.7  ?      ?    1546.79 76.4772      606.986  -103.523    1450.46   -103.523     
1 1 1 20 25 21 o 0 361.5   22.1  ?      ?    2109.15 -128.903     1449.42  -128.903    309.548   -128.903     
1 1 1 21 22 25 o 0 545     31.5  ?      ?    3443.41 -34.2399     1480.1   -34.2399    319.652   145.76       
1 1 1 21 24 25 o 0 1035    51.7  ?      ?    4446.01 88.2936      2149.11  88.2935     104.898   -91.7065     
1 1 1 7  25 22 o 0 433.4   19    ?      ?    2680.5  -155.423     1697.6   -155.423    53.8602   -155.423     
1 1 1 11 25 22 o 0 843.6   31.2  ?      ?    2808.14 99.1112      2924.07  99.1112     1265.45   99.1112      
1 1 1 13 25 22 o 0 479.4   20.6  ?      ?    2754.64 -89.318      1727.15  -89.318     151.173   -89.318      
1 1 1 15 25 22 o 0 66.3    13.5  ?      ?    1384.09 130.714      5.66525  -49.286     778.324   -49.286      
1 1 1 17 25 22 o 0 48.6    14.6  ?      ?    1419.05 -157.675     184.406  22.3247     954.647   22.3247      
1 1 1 19 25 22 o 0 169.4   19.4  ?      ?    2530.15 5.47243      346.657  5.47243     1017.21   -174.528     
1 1 1 21 25 22 o 0 328.5   26.1  ?      ?    2433.09 160.257      1136.98  160.257     126.691   -19.7434     
1 1 1 22 23 25 o 0 35.7    25.8  ?      ?    1338    16.9281      348.281  -163.072    1029.45   -163.072     
1 1 1 0  25 23 o 0 13.8    13.8  ?      ?    538.878 -90          33.7566  -90         307.858   90           
1 1 1 10 25 23 f 1 305.7   15.5  ?      ?    1800.12 -12.2506     1441.04  -12.2506    392.975   -12.2506     
1 1 1 12 25 23 o 0 340.3   17.1  ?      ?    2385.57 88.8641      1332.08  88.8641     20.6416   -91.1359     
1 1 1 14 25 23 o 0 44      11.4  ?      ?    1447.07 -11.7201     243.414  168.28      1045.03   168.28       
1 1 1 16 25 23 o 0 524.2   28.2  ?      ?    2719.2  152.404      1797.29  152.404     330.463   152.404      
1 1 1 18 25 23 o 0 238     24.5  ?      ?    3021.92 -101.013     502.918  -101.013    1118.98   78.9875      
1 1 1 20 25 23 o 0 1907.1  77.5  ?      ?    5526.71 -34.9891     3450.13  -34.9891    585.824   -34.9891     
1 1 1 22 25 23 o 0 662.2   37.7  ?      ?    2103.47 94.0373      2243.53  94.0373     1177.65   94.0373      
1 1 1 23 24 25 o 0 655.3   44.5  ?      ?    2917.73 178.219      1829.19  178.219     411.722   178.219      
1 1 1 1  25 24 o 0 286.1   14.9  ?      ?    2425.61 138.43       1165.85  138.43      328.016   -41.57       
1 1 1 5  25 24 o 0 327.7   16    ?      ?    2631.19 -95.5358     1228.5   -95.5358    346.275   84.4642      
1 1 1 7  25 24 f 1 486.9   21.4  ?      ?    1172.56 -150.638     2359.92  -150.638    1672.64   -150.638     
1 1 1 11 25 24 f 1 208.4   13.5  ?      ?    2545.47 -174.624     601.517  -174.624    835.216   5.37638      
1 1 1 13 25 24 o 0 761.7   30.3  ?      ?    3427.49 -77.1678     2215.37  -77.1678    333.924   -77.1678     
1 1 1 15 25 24 o 0 23.6    15.5  ?      ?    638.732 108.428      201.215  -71.5717    555.312   -71.5717     
1 1 1 17 25 24 o 0 1020.1  46.2  ?      ?    4353.31 44.5674      2370.42  44.5674     47.9669   44.5674      
1 1 1 19 25 24 o 0 401.7   27.7  ?      ?    2875.48 -103.075     1229.87  -103.075    254.472   76.9254      
1 1 1 21 25 24 o 0 288.9   30.1  ?      ?    2771.76 77.4306      742.967  77.4306     659.299   -102.569     
1 1 1 23 25 24 o 0 663.6   44.7  ?      ?    2286.98 -111.313     2086.24  -111.313    978.026   -111.313     
1 1 1 0  25 25 o 0 303.2   23.3  ?      ?    1672.49 90           1408.1   90          406.242   90           
1 1 1 4  25 25 o 0 234.9   14.3  ?      ?    1926.09 -75.1246     1049.37  -75.1246    75.0567   104.875      
1 1 1 6  25 25 o 0 244.5   15    ?      ?    899.494 119.544      1203.95  119.544     686.809   119.544      
1 1 1 8  25 25 f 1 355.1   18.5  ?      ?    3682.46 43.0213      742.597  43.0213     1350.77   -136.979     
1 1 1 10 25 25 o 0 625     27.3  ?      ?    4140.8  151.177      1466.88  151.177     830.182   -28.8233     
1 1 1 14 25 25 o 0 2568.8  95.6  ?      ?    4834.16 151.939      5060.86  151.939     2431.07   151.939      
1 1 1 16 25 25 o 0 1272.8  55.4  ?      ?    5024.38 -16.185      2578.8   -16.185     81.2584   163.815      
1 1 1 18 25 25 o 0 188.8   24.1  ?      ?    2018.04 -124.354     620.284  -124.354    415.466   55.6458      
1 1 1 20 25 25 o 0 1128.8  54.5  ?      ?    3881.41 155.789      2599.87  155.789     643.192   155.789      
1 1 1 22 25 25 o 0 140.3   32.9  ?      ?    1232.89 8.06932      373.735  8.06932     223.071   -171.931     
1 1 1 24 25 25 o 0 403.7   45.5  ?      ?    2290.38 103.545      1212.82  103.545     155.671   103.545      
1 1 1 0  26 0  f 1 1891.9  107.4 ?      ?    5960.13 8.7097e-14   3601.17  0           104.963   -180         
1 1 1 0  2  26 o 0 2918.8  124.4 ?      ?    7720.66 -180         4455.88  180         294.661   1.4504e-13   
1 1 1 0  4  26 o 0 348.8   16.2  ?      ?    2872.9  3.3783e-14   1546.01  0           226.09    -180         
1 1 1 0  6  26 o 0 536.6   26.1  ?      ?    2670.01 180          1915.38  180         271.537   -180         
1 1 1 0  8  26 o 0 486.7   23.7  ?      ?    676.852 180          1356.7   180         942.622   180          
1 1 1 0  10 26 o 0 539.9   24.6  ?      ?    2425.96 -2.57606e-14 1887.55  0           419.382   9.01823e-14  
1 1 1 0  12 26 o 0 3.4     3.9   ?      ?    438.118 180          6.71248  180         248.26    -2.20845e-14 
1 1 1 0  14 26 o 0 119.6   8.5   ?      ?    2210.99 -5.94118e-15 820.57   0           441.035   180          
1 1 1 0  16 26 o 0 1038    49.6  ?      ?    3337.45 -180         3107.35  180         765.925   180          
1 1 1 0  18 26 o 0 1061.6  47.6  ?      ?    3658.28 -6.22929e-16 3054.44  0           559.761   2.7762e-15   
1 1 1 0  20 26 o 0 -0.6    6.9   ?      ?    303.683 180          4.54091  180         193.457   -3.62632e-14 
1 1 1 0  22 26 o 0 395     24.8  ?      ?    2580.76 180          1736.97  180         115.08    -180         
1 1 1 0  24 26 o 0 1007.9  51.9  ?      ?    4177.16 180          2665     180         170.41    -180         
1 1 1 1  3  26 o 0 1188.4  36.6  ?      ?    3641.35 -173.207     3264.63  -173.207    1037.36   -173.207     
1 1 1 1  19 26 o 0 702     24.1  ?      ?    2775.72 -70.7592     2811.41  -70.7592    983.512   -70.7592     
1 1 1 1  25 26 o 0 166.6   15.2  ?      ?    1798.95 -55.7772     683.328  -55.7772    362.082   124.223      
1 1 1 0  26 2  o 0 261.7   12.8  ?      ?    1565.93 -9.87077e-14 1256.74  0           281.741   3.4159e-13   
1 1 1 2  6  26 o 0 1012.6  32.7  ?      ?    3758.44 -73.6468     2736.41  -73.6468    459.139   -73.6468     
1 1 1 2  22 26 o 0 2396.1  80.5  ?      ?    5534.35 -106.653     4901.72  -106.653    1467.04   -106.653     
1 1 1 2  24 26 o 0 866.1   32.8  ?      ?    4204.79 104.039      2258.3   104.039     223.715   -75.9613     
1 1 1 3  26 3  o 0 2189.3  66.4  ?      ?    4394.15 -7.03397     4821.67  -7.03397    2150.08   -7.03397     
1 1 1 3  21 26 o 0 639.5   24    ?      ?    3378.48 121.222      2129.19  121.222     8.14509   121.222      
1 1 1 3  23 26 o 0 451     20.8  ?      ?    3065.76 98.9061      1539.02  98.9061     314.622   -81.0939     
1 1 1 3  25 26 o 0 124.3   12.6  ?      ?    1185.37 97.7416      505.41   97.7416     175.103   -82.2584     
1 1 1 0  26 4  o 0 129.7   7.3   ?      ?    848.882 -1.10196e-13 531.569  0           1.54418   3.78238e-11  
1 1 1 4  22 26 o 0 632.7   24.2  ?      ?    4483.24 -30.2063     1419.92  -30.2063    1324.19   149.794      
1 1 1 4  24 26 o 0 315.2   16.6  ?      ?    2309.86 69.849       1288.2   69.849      57.1864   -110.151     
1 1 1 5  21 26 f 1 780     29.9  ?      ?    2245.34 -164.578     3157.39  -164.578    1760.23   -164.578     
1 1 1 5  23 26 o 0 646.6   25.6  ?      ?    3398.59 -30.7047     2034.06  -30.7047    8.33193   -30.7047     
1 1 1 0  26 6  o 0 27.5    4     ?      ?    1580    -180         212.987  180         772.056   1.66642e-14  
1 1 1 6  26 6  o 0 1028.4  33.3  ?      ?    3720.65 63.0608      2737.05  63.0608     531.1     63.0608      
1 1 1 6  16 26 o 0 1275.9  45.8  ?      ?    3356.17 -160.921     4157.63  -160.921    1905.91   -160.921     
1 1 1 6  24 26 o 0 348.1   17.1  ?      ?    1013.34 113.574      1740.77  113.574     1159.3    113.574      
1 1 1 1  26 7  o 0 778.2   24.7  ?      ?    2017.03 169.397      3049.2   169.397     1807.01   169.397      
1 1 1 7  26 7  o 0 704.1   23.3  ?      ?    2748.74 -5.10993     2346.28  -5.10993    733.654   -5.10993     
1 1 1 7  11 26 f 1 646.5   21.6  ?      ?    2631.45 -158.037     2238.89  -158.037    763.759   -158.037     
1 1 1 7  19 26 o 0 717.4   27.5  ?      ?    2986.05 58.3234      2622.35  58.3234     740.882   58.3234      
1 1 1 7  23 26 o 0 813.3   32.2  ?      ?    2501.88 -131.992     2959.08  -131.992    1505.86   -131.992     
1 1 1 7  25 26 o 0 1381.9  49.4  ?      ?    3929.65 -22.6169     3491.99  -22.6169    1302.2    -22.6169     
1 1 1 0  26 8  o 0 653.4   29.4  ?      ?    3185.1  1.77071e-15  2128.9   0           154.984   -2.25522e-14 
1 1 1 6  26 8  o 0 1224.7  39.4  ?      ?    3957.89 -86.2249     3047.39  -86.2249    719.194   -86.2249     
1 1 1 8  22 26 o 0 345.3   18.4  ?      ?    2672.32 92.0605      1275.38  92.0604     309.981   -87.9396     
1 1 1 8  24 26 o 0 60.3    14.6  ?      ?    2175.54 -121.997     320.712  58.0035     1548.55   58.0035      
1 1 1 9  15 26 o 0 1267.6  47.3  ?      ?    4088.85 159.333      3640.87  159.333     922.898   159.333      
1 1 1 9  17 26 o 0 823.7   31.9  ?      ?    4029.2  23.5912      2385.23  23.5912     190.562   -156.409     
1 1 1 9  21 26 f 1 568.8   25.2  ?      ?    3474.29 -21.4764     1727.52  -21.4764    365.888   158.524      
1 1 1 9  23 26 o 0 870.1   37    ?      ?    3036.69 -44.5915     2803.2   -44.5915    1069.49   -44.5915     
1 1 1 9  25 26 o 0 147.7   14.5  ?      ?    863.273 -152.763     603.287  -152.763    130.677   -152.763     
1 1 1 0  26 10 o 0 156.3   9.3   ?      ?    2205.43 180          974.252  180         378.165   -3.15381e-14 
1 1 1 6  26 10 o 0 917.7   28.9  ?      ?    3552.73 17.633       2576.36  17.633      559.524   17.633       
1 1 1 8  26 10 o 0 625.2   21.9  ?      ?    3640.45 120.456      1677.14  120.456     357.894   -59.5438     
1 1 1 10 18 26 o 0 1037.7  42.9  ?      ?    5290.89 -100.327     2184.66  -100.327    1120.84   79.6735      
1 1 1 10 20 26 o 0 469.3   22.7  ?      ?    3049.22 -15.8588     1618.73  -15.8588    224.649   164.141      
1 1 1 10 22 26 o 0 281.3   17.2  ?      ?    647.7   126.011      1225.35  126.011     851.69    126.011      
1 1 1 10 24 26 o 0 637.1   29.7  ?      ?    3362.71 -72.6456     1899.25  -72.6456    36.1198   -72.6456     
1 1 1 1  26 11 f 1 606.6   21.7  ?      ?    3195.94 -50.1968     1937.57  -50.1968    45.2081   -50.1968     
1 1 1 11 26 11 o 0 851.6   32.1  ?      ?    2684.83 -44.2098     2714.04  -44.2098    1260.41   -44.2098     
1 1 1 11 17 26 f 1 1188.9  48    ?      ?    3186.6  128.529      3833.59  128.529     1817.88   128.529      
1 1 1 11 19 26 f 1 3200.9  122   ?      ?    4781.42 -69.6198     6496.5   -69.6198    3566.03   -69.6198     
1 1 1 11 21 26 o 0 775.5   34.8  ?      ?    3872.72 -161.844     2141.84  -161.844    136.548   18.1556      
1 1 1 11 23 26 o 0 609.7   29.4  ?      ?    3213.6  172.223      1907.05  172.223     107.118   172.223      
1 1 1 11 25 26 o 0 99.1    13.9  ?      ?    1488.3  104.766      249.864  104.766     548.849   -75.2343     
1 1 1 0  26 12 o 0 414.3   19.4  ?      ?    2299.15 180          1650.3   180         294.471   -180         
1 1 1 2  26 12 o 0 647.7   22.7  ?      ?    3475.83 -123.385     1895.4   -123.385    115.61    56.6147      
1 1 1 10 26 12 o 0 788.3   29    ?      ?    3228.3  -104.968     2284.87  -104.968    538.538   -104.968     
1 1 1 12 16 26 o 0 397.8   17.7  ?      ?    1585.34 75.2639      2122.62  75.2639     1119.37   75.2639      
1 1 1 12 20 26 o 0 200.6   15.6  ?      ?    2343.03 -164.924     703.267  -164.924    686.951   15.0756      
1 1 1 12 22 26 o 0 278.5   19.1  ?      ?    3775.14 50.0374      359.668  50.0374     1775.61   -129.963     
1 1 1 12 24 26 o 0 1446.5  56.9  ?      ?    5850.74 101.832      2536.34  101.832     638.78    -78.1681     
1 1 1 3  26 13 o 0 784.1   26.2  ?      ?    3360.78 162.685      2319.78  162.685     410.434   162.685      
1 1 1 5  26 13 o 0 577.2   20.7  ?      ?    3634.8  -75.8545     1527.46  -75.8545    501.986   104.146      
1 1 1 13 15 26 o 0 1367.3  54    ?      ?    3898.12 -102.739     3908.35  -102.739    1428.2    -102.739     
1 1 1 13 19 26 o 0 422.7   20    ?      ?    2733.09 135.337      1584.49  135.337     49.5696   -44.6626     
1 1 1 13 21 26 o 0 932.6   38.3  ?      ?    4398.36 -14.3985     2255.13  -14.3985    254.68    165.602      
1 1 1 13 23 26 o 0 1239.2  49.2  ?      ?    4388.92 -26.6165     2894.2   -26.6165    488.286   -26.6165     
1 1 1 13 25 26 o 0 57.2    16.1  ?      ?    1311.33 -67.9396     128.505  112.06      834.248   112.06       
1 1 1 0  26 14 o 0 428.8   23.2  ?      ?    2944.03 -180         1646.43  180         55.2523   3.70283e-13  
1 1 1 6  26 14 o 0 948.9   32.5  ?      ?    4232.03 128.366      2212.58  128.366     106.463   -51.634      
1 1 1 10 26 14 o 0 856.5   32.4  ?      ?    4057.46 -170.975     2517.55  -170.975    188.965   9.02516      
1 1 1 14 26 14 o 0 515.9   21.9  ?      ?    2644.05 166.623      2108.03  166.623     432.736   166.623      
1 1 1 14 18 26 o 0 597.9   26.5  ?      ?    4088.58 -108.499     1502.24  -108.499    958.785   71.5012      
1 1 1 14 20 26 f 1 246.4   16.5  ?      ?    2225.02 -35.0117     966.867  -35.0117    320.026   144.988      
1 1 1 14 22 26 o 0 532.2   25.2  ?      ?    2727.52 -160.87      1866.86  -160.87     358.145   -160.87      
1 1 1 14 24 26 o 0 1390.3  55.8  ?      ?    4809.18 -133.128     3008.76  -133.128    393.904   -133.128     
1 1 1 3  26 15 o 0 645.8   21.9  ?      ?    1668.56 -144.701     2658.89  -144.701    1731.15   -144.701     
1 1 1 5  26 15 o 0 1035.4  35.5  ?      ?    3052.15 -67.4957     3011.25  -67.4957    1343.44   -67.4957     
1 1 1 9  26 15 o 0 443.1   17.6  ?      ?    1442.65 24.4513      2462.87  24.4513     1503.5    24.4513      
1 1 1 11 26 15 o 0 968.4   36.5  ?      ?    3268.68 118.693      3275.44  118.693     1140.85   118.693      
1 1 1 15 26 15 o 0 561.2   23.6  ?      ?    2987.34 90.521       2038.9   90.521      192.076   90.521       
1 1 1 15 21 26 o 0 19.7    11.6  ?      ?    702.205 130.075      252.69   -49.9253    644.221   -49.9253     
1 1 1 15 23 26 o 0 1487.7  61.2  ?      ?    5713.56 78.8291      2746.08  78.8291     419.367   -101.171     
1 1 1 15 25 26 o 0 657.7   33.6  ?      ?    2751.64 -0.219848    2142.66  -0.219848   699.256   -0.219848    
1 1 1 0  26 16 o 0 73.1    8.9   ?      ?    1676.32 6.11163e-16  671.534  0           518.876   -180         
1 1 1 4  26 16 o 0 539.2   18.9  ?      ?    1705.93 143.923      2845.86  143.923     1676.17   143.923      
1 1 1 8  26 16 o 0 509.7   19.1  ?      ?    2497.42 9.32917      2223.77  9.32917     569.414   9.32917      
1 1 1 10 26 16 f 1 426.9   17.2  ?      ?    1226.85 -91.7098     2384.17  -91.7098    1591.22   -91.7098     
1 1 1 12 26 16 o 0 348.3   15.8  ?      ?    2484.66 -7.39059     1470.65  -7.39059    95.6494   172.609      
1 1 1 14 26 16 o 0 744.3   29.7  ?      ?    2874.09 -3.25867     2713.1   -3.25867    940.002   -3.25867     
1 1 1 16 26 16 o 0 196     14.1  ?      ?    1749.31 -53.2359     946.976  -53.2359    105.837   126.764      
1 1 1 16 18 26 o 0 302.8   18.1  ?      ?    2078.42 106.268      1330.05  106.268     119.303   106.268      
1 1 1 16 20 26 o 0 755.6   33.9  ?      ?    2424.41 166.729      2734.3   166.729     1373.11   166.729      
1 1 1 16 22 26 o 0 3042.5  118   ?      ?    6113.66 -19.6525     4965.56  -19.6525    1668.83   -19.6525     
1 1 1 16 24 26 o 0 118.7   19.6  ?      ?    1896.22 71.5206      233.93   71.5206     769.852   -108.479     
1 1 1 11 26 17 f 1 559.3   23.1  ?      ?    2123.02 56.8017      2516.56  56.8017     1176.25   56.8017      
1 1 1 13 26 17 o 0 285.9   15.1  ?      ?    1839.41 -130.284     1437.8   -130.284    306.802   -130.284     
1 1 1 15 26 17 o 0 2598.9  95.3  ?      ?    5874.8  -105.241     4874.67  -105.241    1346.28   -105.241     
1 1 1 17 19 26 f 1 312.8   18.2  ?      ?    1904.71 167.826      1400.3   167.826     318.557   167.826      
1 1 1 17 21 26 o 0 203.9   18.4  ?      ?    1297.05 -102.317     964.975  -102.317    260.744   -102.317     
1 1 1 17 23 26 o 0 2       17.1  ?      ?    1278.83 -138.446     549.071  41.5537     1231.4    41.5537      
1 1 1 17 25 26 o 0 158.5   24.1  ?      ?    842.735 -133.011     527.496  -133.011    98.1893   -133.011     
1 1 1 0  26 18 o 0 81.2    10.3  ?      ?    2259.15 9.03211e-15  782.075  0           775.367   -180         
1 1 1 8  26 18 o 0 426.1   16.9  ?      ?    2787.57 149.768      1671.37  149.768     102.041   -30.2318     
1 1 1 10 26 18 o 0 472.2   19.1  ?      ?    1849.7  -8.91629     2302.17  -8.91629    1146.97   -8.91629     
1 1 1 12 26 18 o 0 407.1   18.4  ?      ?    2339.26 18.8425      1760.22  18.8425     328.338   18.8425      
1 1 1 16 26 18 o 0 545.9   26.5  ?      ?    3062.98 97.4981      1825.83  97.4981     56.8777   97.4981      
1 1 1 18 26 18 o 0 52.9    13.9  ?      ?    868.702 -162.182     40.1962  17.818      527.287   17.818       
1 1 1 18 20 26 o 0 576.4   27.8  ?      ?    3114.22 64.35        1803.98  64.35       103.491   64.35        
1 1 1 18 22 26 o 0 1216.4  50.1  ?      ?    5321.25 -164.31      2343.71  -164.31     514.568   15.6899      
1 1 1 18 24 26 o 0 970.3   46.2  ?      ?    4220.93 -62.8423     2229.23  -62.8423    62.2945   -62.8423     
1 1 1 5  26 19 o 0 757.6   26.2  ?      ?    2301.73 118.814      3187.54  118.814     1707.63   118.814      
1 1 1 11 26 19 f 1 285.5   14.5  ?      ?    1529.84 -179.852     1533.4   -179.852    596.979   -179.852     
1 1 1 17 26 19 f 1 65      13.6  ?      ?    1291.5  30.3241      0.660825 -149.676    727.646   -149.676     
1 1 1 19 26 19 f 1 1146.7  46.3  ?      ?    2538.7  -21.3648     3556.85  -21.3648    2173.04   -21.3648     
1 1 1 19 21 26 o 0 262.6   21    ?      ?    2084.43 -144.953     1019.13  -144.953    106.597   35.0467      
1 1 1 19 23 26 o 0 219.7   22.9  ?      ?    2257.32 63.253       706.315  63.253      460.024   -116.747     
1 1 1 19 25 26 f 1 916     49.7  ?      ?    4683.59 119.851      1734.17  119.851     627.391   -60.1494     
1 1 1 0  26 20 o 0 52.5    11.9  ?      ?    211.653 1.52124e-13  73.5001  0           65.7535   -180         
1 1 1 10 26 20 o 0 383.3   16.5  ?      ?    1510.02 -88.8543     1991.16  -88.8543    1078.29   -88.8543     
1 1 1 14 26 20 f 1 177.6   13.5  ?      ?    2590.05 136.788      410.797  136.788     1081.07   -43.2123     
1 1 1 16 26 20 o 0 7.3     13.6  ?      ?    558.567 91.7574      241.466  -88.2426    553.077   -88.2426     
1 1 1 18 26 20 o 0 203.3   17    ?      ?    1638.64 24.9972      896.442  24.9972     9.53379   24.9972      
1 1 1 20 26 20 o 0 242.9   20.3  ?      ?    2295.22 124.382      837.729  124.382     392.797   -55.6185     
1 1 1 20 22 26 f 1 232.2   22    ?      ?    1727.39 -53.4153     936.109  -53.4153    33.9707   -53.4153     
1 1 1 20 24 26 f 1 341.5   30.5  ?      ?    2149.34 -60.0687     1180.73  -60.0687    90.3582   -60.0687     
1 1 1 13 26 21 o 0 736.6   29.8  ?      ?    2875.93 94.8378      2499.46  94.8378     862.402   94.8378      
1 1 1 15 26 21 o 0 118.1   15.3  ?      ?    1283.6  -0.342644    436.639  -0.342644   275.989   179.657      
1 1 1 17 26 21 o 0 999.6   42.9  ?      ?    3422.73 35.8925      2788.62  35.8925     941.883   35.8925      
1 1 1 19 26 21 o 0 784.6   36.4  ?      ?    2857.26 -37.2971     2501.45  -37.2971    971.215   -37.2971     
1 1 1 21 26 21 o 0 -1.4    18.8  ?      ?    1782.77 20.3938      745.349  -159.606    1664.79   -159.606     
1 1 1 21 23 26 o 0 569.3   38.1  ?      ?    3635.93 -135.18      1346.14  -135.18     496.602   44.8196      
1 1 1 21 25 26 o 0 1228    61.3  ?      ?    4120.12 -98.3626     2578.41  -98.3626    590.117   -98.3626     
1 1 1 0  26 22 o 0 21.2    13.7  ?      ?    416.046 1.09047e-13  40.0107  0           223.204   -180         
1 1 1 8  26 22 o 0 704.1   27.6  ?      ?    4050.91 -141.515     1849.72  -141.515    557.163   38.4855      
1 1 1 10 26 22 o 0 263.5   14.3  ?      ?    686.512 -127.41      1177.93  -127.41     781.791   -127.41      
1 1 1 12 26 22 o 0 781.8   30    ?      ?    3681.39 107.791      2203.93  107.791     124.121   107.791      
1 1 1 14 26 22 o 0 884.7   35.7  ?      ?    4033.18 -36.0013     2250.99  -36.0013    25.929    -36.0013     
1 1 1 16 26 22 o 0 701.8   33.7  ?      ?    3994.12 -143.452     1718.39  -143.452    426.417   36.5475      
1 1 1 18 26 22 o 0 1537.1  63.5  ?      ?    3628.51 -75.741      3830.45  -75.741     1892.72   -75.741      
1 1 1 20 26 22 f 1 336.6   25    ?      ?    2097.33 145.771      1282.51  145.771     195.392   145.771      
1 1 1 22 26 22 o 0 15.3    26.8  ?      ?    1030.51 -167.549     340.857  12.4511     859.915   12.4511      
1 1 1 22 24 26 o 0 289.3   34.9  ?      ?    1097.67 20.4923      1066.82  20.4923     534.89    20.4923      
1 1 1 1  26 23 o 0 707.4   27.5  ?      ?    3072.46 69.1696      2482.32  69.1696     591.654   69.1696      
1 1 1 3  26 23 o 0 292     14.4  ?      ?    2396.58 -162.21      1193.18  -162.21     261.244   17.7901      
1 1 1 7  26 23 o 0 175.8   13    ?      ?    1535.11 77.7069      820.752  77.7069     72.4817   -102.293     
1 1 1 9  26 23 o 0 593     25.3  ?      ?    3050.56 115.472      1973.17  115.472     230.225   115.472      
1 1 1 11 26 23 o 0 230.8   14.5  ?      ?    2722.95 -66.6829     644.695  -66.6829    879.997   113.317      
1 1 1 13 26 23 o 0 1380.2  49.6  ?      ?    4000.81 -74.5126     3391.08  -74.5126    1200.9    -74.5126     
1 1 1 15 26 23 o 0 2386.1  89.4  ?      ?    6315.91 108.316      4009.22  108.316     518.805   108.316      
1 1 1 17 26 23 o 0 409.9   26.5  ?      ?    2786.82 -75.8222     1336.98  -75.8222    144.466   104.178      
1 1 1 19 26 23 o 0 568.4   36.4  ?      ?    2326    75.7297      2007.53  75.7297     811.662   75.7297      
1 1 1 21 26 23 o 0 68.7    26.4  ?      ?    1521.33 38.7231      145.608  -141.277    911.805   -141.277     
1 1 1 23 26 23 o 0 361.6   36.7  ?      ?    2470.82 171.949      1095.02  171.949     96.3071   -8.05136     
1 1 1 23 25 26 o 0 64.5    38.3  ?      ?    855.324 14.4235      85.663   -165.576    480.272   -165.576     
1 1 1 0  26 24 o 0 639.4   36.3  ?      ?    4199.15 -3.87668e-15 2130.99  0           385.893   180          
1 1 1 4  26 24 o 0 262.6   14.9  ?      ?    2171.42 -158.128     1095.74  -158.128    171.879   21.8717      
1 1 1 8  26 24 o 0 154.6   14    ?      ?    1220.52 -47.9639     704.629  -47.9639    15.1565   -47.9639     
1 1 1 10 26 24 o 0 227.3   15.1  ?      ?    2172.3  -84.5311     862.474  -84.5311    341.367   95.4689      
1 1 1 12 26 24 o 0 430.9   21.5  ?      ?    3631.09 13.928       1042.46  13.928      927.111   -166.072     
1 1 1 14 26 24 o 0 578.6   26.3  ?      ?    3466.53 30.8176      1637.9   30.8176     244.57    -149.182     
1 1 1 16 26 24 o 0 263.9   21.4  ?      ?    2394.22 112.605      887.438  112.605     377.384   -67.395      
1 1 1 18 26 24 o 0 724.6   43.6  ?      ?    3424.19 -135.129     1977.31  -135.129    224.437   -135.129     
1 1 1 20 26 24 f 1 160     27.5  ?      ?    2363.39 -57.9494     264.96   -57.9494    929.539   122.051      
1 1 1 22 26 24 o 0 2147.9  92.2  ?      ?    5957.98 -1.44424     3259.35  -1.44424    385.398   -1.44424     
1 1 1 24 26 24 o 0 511.2   44.4  ?      ?    3597.67 123.355      1056.62  123.355     597.302   -56.6451     
1 1 1 1  26 25 o 0 720.8   29.3  ?      ?    3984.66 -91.9022     1924.61  -91.9022    394.941   88.0978      
1 1 1 3  26 25 o 0 2038    67.3  ?      ?    5296.66 56.4717      4136.87  56.4717     1091.95   56.4717      
1 1 1 5  26 25 o 0 378.9   18.7  ?      ?    2250.46 165.715      1555.23  165.715     279.924   165.715      
1 1 1 7  26 25 o 0 108.3   13.3  ?      ?    2281.45 159.396      73.6547  159.396     1198.53   -20.6037     
1 1 1 9  26 25 o 0 1249    48.4  ?      ?    4967.34 -165.394     2612.11  -165.394    108.2     14.6058      
1 1 1 11 26 25 o 0 147.2   14.8  ?      ?    1670.57 97.1881      548.612  97.1881     347.885   -82.8119     
1 1 1 13 26 25 o 0 81.2    14.4  ?      ?    1147.5  -174.743     93.3611  -174.743    523.956   5.25729      
1 1 1 15 26 25 o 0 1118.1  51    ?      ?    4022.01 -25.5441     2712.58  -25.5441    604.48    -25.5441     
1 1 1 17 26 25 o 0 1378.4  62    ?      ?    4960.94 114.106      2718.54  114.106     194.388   114.106      
1 1 1 19 26 25 f 1 810.7   49.3  ?      ?    4270.81 -63.2847     1673.46  -63.2847    476.447   116.715      
1 1 1 21 26 25 o 0 148.7   33.3  ?      ?    1045    -44.0946     408.078  -44.0946    95.175    135.905      
1 1 1 23 26 25 o 0 7.6     40.6  ?      ?    1173.48 168.96       337.343  -11.0397    877.368   -11.0397     
1 1 1 25 26 25 o 0 1721.2  88.5  ?      ?    4479.99 38.9229      2970.18  38.9229     1008.39   38.9229      
1 1 1 0  26 26 o 0 178.5   23.9  ?      ?    1408.98 180          907.436  180         102.948   -180         
1 1 1 2  26 26 o 0 400.6   21.1  ?      ?    3491.6  -74.8229     1038.68  -74.8229    933.652   105.177      
1 1 1 4  26 26 o 0 174.7   14.4  ?      ?    1720.72 -57.3557     732.153  -57.3557    227.447   122.644      
1 1 1 6  26 26 o 0 130.6   13.5  ?      ?    837.255 -167.214     494.418  -167.214    34.3719   -167.214     
1 1 1 8  26 26 o 0 301.6   19.7  ?      ?    1641.06 143.343      1379.04  143.343     492.383   143.343      
1 1 1 10 26 26 o 0 2598.9  92.9  ?      ?    6327.01 124.74       4326.78  124.74      886.682   124.74       
1 1 1 12 26 26 o 0 1496.9  54.9  ?      ?    5990.57 -49.6138     2556.58  -49.6138    630.979   130.386      
1 1 1 14 26 26 o 0 1193.2  53.1  ?      ?    5757.27 95.9778      1997.74  95.9778     991.368   -84.0222     
1 1 1 16 26 26 o 0 304.1   27    ?      ?    2758.33 -54.5074     875.755  -54.5074    516.793   125.493      
1 1 1 18 26 26 o 0 668.2   43    ?      ?    2843.02 135.743      1939.09  135.743     524.266   135.743      
1 1 1 20 26 26 o 0 1969.7  86.6  ?      ?    5627.46 -9.00333     3132.19  -9.00333    431.914   -9.00333     
1 1 1 22 26 26 o 0 482.2   47.6  ?      ?    2363.48 -176.851     1428.16  -176.851    341.723   -176.851     
1 1 1 24 26 26 o 0 224.7   51    ?      ?    2217.52 -150.341     528.252  -150.341    444.403   29.6593      
1 1 1 26 26 26 o 0 2147.4  175   ?      ?    5049.97 -54.685      2817.93  -54.685     687.475   -54.685      
1 1 1 0  1  27 o 0 258.6   13    ?      ?    1670.57 -90          1212.27  -90         216.315   -90          
1 1 1 0  3  27 o 0 994.2   44    ?      ?    2611.98 90           2536.86  90          972.389   90           
1 1 1 0  5  27 o 0 61.6    5.5   ?      ?    875.224 90           263.473  90          260.949   -90          
1 1 1 0  7  27 o 0 62.6    5.8   ?      ?    324.876 90           104.412  90          89.4732   -90          
1 1 1 0  9  27 o 0 151.3   8.6   ?      ?    243.651 90           226.166  90          85.3686   90           
1 1 1 0  11 27 o 0 1174.8  52    ?      ?    3765.78 -90          2688.46  -90         540.14    -90          
1 1 1 0  13 27 o 0 563.9   26.3  ?      ?    3022.96 90           1832.52  90          137.485   90           
1 1 1 0  15 27 o 0 767.2   37.7  ?      ?    3278.97 -90          2632.23  -90         366.149   -90          
1 1 1 0  17 27 o 0 238.4   15.2  ?      ?    3146.09 90           1428.56  90          689.99    -90          
1 1 1 0  19 27 o 0 332.5   18.4  ?      ?    1193.78 -90          1522.68  -90         752.243   -90          
1 1 1 0  21 27 o 0 737.8   36.1  ?      ?    4488.9  -90          2358.45  -90         440.617   90           
1 1 1 0  23 27 o 0 36.2    16.8  ?      ?    899.852 -90          135.784  -90         398.661   90           
1 1 1 0  25 27 o 0 75.2    22.5  ?      ?    2522.61 90           587.809  90          847.942   -90          
1 1 1 0  27 1  o 0 53.1    4.9   ?      ?    800.307 90           213.208  90          270.927   -90          
1 1 1 1  2  27 o 0 858.3   26.8  ?      ?    4229.93 40.0331      2019.04  40.0331     493.098   -139.967     
1 1 1 1  4  27 o 0 991.1   30.9  ?      ?    3728.31 -55.8448     2650.19  -55.8448    431.356   -55.8448     
1 1 1 1  24 27 o 0 522.1   23.6  ?      ?    2711.06 88.1674      1923.77  88.1674     354.796   88.1674      
1 1 1 1  26 27 o 0 1105.9  43    ?      ?    3890.7  161.677      2880.24  161.677     725.826   161.677      
1 1 1 1  27 2  o 0 1507    46.3  ?      ?    4591.99 2.92865      3374.37  2.92865     612.297   2.92865      
1 1 1 2  3  27 o 0 907.8   28.5  ?      ?    3044.89 -92.17       2782.58  -92.17      983.208   -92.17       
1 1 1 2  9  27 o 0 950.8   31    ?      ?    4612.57 -110.664     2097.54  -110.664    528.357   69.3355      
1 1 1 2  21 27 o 0 449.5   18.8  ?      ?    2174.49 40.1555      2030.68  40.1555     690.961   40.1555      
1 1 1 2  23 27 o 0 1054.8  38.9  ?      ?    3903.71 -163.986     2914.65  -163.986    621.918   -163.986     
1 1 1 2  25 27 o 0 1039    39.9  ?      ?    4129.13 12.1485      2642.56  12.1485     316.602   12.1485      
1 1 1 0  27 3  o 0 625.3   27.8  ?      ?    3186.15 -90          2043.03  -90         106.145   -90          
1 1 1 2  27 3  o 0 1651.6  50.5  ?      ?    5690.72 -153.479     3012.67  -153.479    387.468   26.5206      
1 1 1 3  4  27 f 1 685.5   22.6  ?      ?    2310.69 -94.5622     2499.74  -94.5622    1134.78   -94.5622     
1 1 1 3  8  27 o 0 815.3   26.8  ?      ?    3446.27 162.509      2362     162.508     404.284   162.508      
1 1 1 3  16 27 o 0 728.1   24.7  ?      ?    3133.91 -150.869     2679.74  -150.869    584.913   -150.869     
1 1 1 3  22 27 o 0 373.7   17.5  ?      ?    2723.93 177.572      1392.09  177.572     245.144   -2.42806     
1 1 1 3  24 27 o 0 335.5   20.2  ?      ?    1820.06 82.6846      1555.04  82.6846     514.017   82.6846      
1 1 1 3  26 27 o 0 417.2   21    ?      ?    1674.63 -74.5007     1867.53  -74.5007    950.453   -74.5007     
1 1 1 4  21 27 f 1 481.5   21.1  ?      ?    3030.95 83.464       1677.11  83.464      175.903   -96.536      
1 1 1 4  23 27 o 0 52.4    9.1   ?      ?    937.498 -102.572     53.6908  77.4278     597.233   77.4278      
1 1 1 4  25 27 o 0 221.9   16.3  ?      ?    2021    -162.334     896.738  -162.334    227.612   17.6656      
1 1 1 0  27 5  o 0 176     9.4   ?      ?    2669.24 90           1063.23  90          560.517   -90          
1 1 1 2  27 5  o 0 712.5   21.9  ?      ?    1853    -54.4889     2832.67  -54.4889    1725.55   -54.4889     
1 1 1 4  27 5  o 0 1015.3  31.7  ?      ?    3619.77 129.848      2736.48  129.848     608.633   129.848      
1 1 1 5  16 27 o 0 988.5   34.4  ?      ?    2649.5  74.0088      3730.87  74.0088     1984.83   74.0088      
1 1 1 5  20 27 o 0 616.7   24.6  ?      ?    2243.27 -56.1712     2611.82  -56.1712    1234.41   -56.1712     
1 1 1 5  24 27 o 0 37.3    8.8   ?      ?    2305.6  -23.217      641.729  156.783     1942.65   156.783      
1 1 1 5  26 27 o 0 356.8   20.8  ?      ?    2652.7  82.0813      1263.51  82.0813     221.125   -97.9187     
1 1 1 3  27 6  o 0 798.7   25.4  ?      ?    2582.13 166.689      2723.69  166.689     1196.35   166.689      
1 1 1 6  13 27 o 0 1898.2  66.3  ?      ?    4714.12 -100.319     4779.97  -100.319    1589.91   -100.319     
1 1 1 6  17 27 o 0 601.7   23.1  ?      ?    2593.04 76.9871      2473.47  76.9871     819.543   76.9871      
1 1 1 6  19 27 o 0 1103.3  39    ?      ?    4312.53 166.143      2923.66  166.143     252.472   166.143      
1 1 1 6  23 27 o 0 76.4    13.8  ?      ?    637.304 -12.7769     127.523  -12.7769    236.64    167.223      
1 1 1 6  25 27 o 0 534.6   24.6  ?      ?    3010.56 -51.0061     1725.12  -51.0061    74.2659   -51.0061     
1 1 1 0  27 7  o 0 91.5    6.8   ?      ?    978.983 90           421.927  90          171.419   -90          
1 1 1 7  14 27 o 0 655     24.4  ?      ?    2770.95 160.745      2627.14  160.745     784.044   160.745      
1 1 1 7  16 27 o 0 489.7   19.3  ?      ?    2767.44 23.3798      1962.51  23.3798     186.852   23.3798      
1 1 1 7  22 27 o 0 386.4   19.4  ?      ?    1426.99 167.863      1908.49  167.863     1083.84   167.863      
1 1 1 7  24 27 o 0 1663.9  61.1  ?      ?    5759.55 35.3952      3076.02  35.3952     124.071   -144.605     
1 1 1 7  26 27 o 0 60      12.9  ?      ?    1081    -137.817     62.5283  42.1828     652.515   42.1828      
1 1 1 8  9  27 o 0 623.9   22.1  ?      ?    3862.4  -159.345     1525.84  -159.345    590.165   20.6553      
1 1 1 8  15 27 o 0 918.2   35.1  ?      ?    3441.72 0.90203      3024.43  0.90203     777.315   0.90203      
1 1 1 8  17 27 o 0 1088.5  41.3  ?      ?    2875.27 -121.509     3759.06  -121.509    1952.31   -121.509     
1 1 1 8  19 27 o 0 895.1   37.9  ?      ?    2866.65 -11.838      3131.14  -11.838     1382.76   -11.838      
1 1 1 8  21 27 o 0 237.1   15.6  ?      ?    2107.04 163.848      1013.67  163.848     228.847   -16.1518     
1 1 1 8  23 27 o 0 173.2   16.7  ?      ?    826.384 136.206      758.472  136.206     293.862   136.206      
1 1 1 8  25 27 o 0 715.3   35.6  ?      ?    3120.23 -105.309     2194.16  -105.309    511.132   -105.309     
1 1 1 0  27 9  o 0 190     10.5  ?      ?    2216.57 -90          1095.63  -90         205.474   90           
1 1 1 8  27 9  o 0 1736.3  58.1  ?      ?    4941.91 105.632      3471.53  105.632     761.376   105.632      
1 1 1 9  16 27 o 0 424.6   18.5  ?      ?    2555.52 -156.097     1779.59  -156.097    164.253   -156.097     
1 1 1 9  18 27 o 0 455.5   20.5  ?      ?    2413.13 47.6121      1929.07  47.6121     446.336   47.6121      
1 1 1 9  20 27 o 0 350.3   20.5  ?      ?    1860.07 -106.052     1684.18  -106.052    577.397   -106.052     
1 1 1 9  22 27 o 0 1385.7  54.3  ?      ?    5011.15 38.6997      2978.64  38.6997     131.217   38.6997      
1 1 1 9  24 27 o 0 3458.9  127.6 ?      ?    7000.89 -119.899     5113.2   -119.899    1290.32   -119.899     
1 1 1 9  26 27 o 0 855     37.9  ?      ?    3815.68 24.0114      2238.55  24.0114     192.666   24.0114      
1 1 1 9  27 10 o 0 1886.3  62.8  ?      ?    5110.13 24.1973      3595.59  24.1973     834.141   24.1973      
1 1 1 10 11 27 o 0 770     27.1  ?      ?    3457.02 -111.66      2633.73  -111.66     312.983   -111.66      
1 1 1 10 17 27 o 0 583.7   24.2  ?      ?    2518.24 -8.21055     2373.54  -8.21055    816.023   -8.21055     
1 1 1 10 19 27 o 0 1249.8  50.8  ?      ?    4166.73 -165.028     3266.23  -165.028    767.006   -165.028     
1 1 1 10 21 27 o 0 66.5    14.3  ?      ?    137.503 88.9043      19.6739  88.9043     59.2038   -91.0957     
1 1 1 10 23 27 o 0 113.1   16.4  ?      ?    1343.19 -102.872     389.71   -102.872    351.9     77.1283      
1 1 1 10 25 27 f 1 446.7   28.2  ?      ?    3241.55 6.07945      1283.78  6.07945     486.351   -173.921     
1 1 1 0  27 11 o 0 -5      5.6   ?      ?    1070.92 -90          7.53601  -90         613.084   90           
1 1 1 10 27 11 o 0 902.5   32.9  ?      ?    2836.52 -65.7503     3424.21  -65.7503    1524.86   -65.7503     
1 1 1 11 12 27 o 0 405     17.2  ?      ?    1653.49 108.673      2196.03  108.673     1103.93   108.673      
1 1 1 11 14 27 o 0 1193.8  45.3  ?      ?    4544.75 -131.137     3103.26  -131.137    202.61    -131.137     
1 1 1 11 24 27 o 0 114.6   18.6  ?      ?    1747.6  148.804      311.63   148.804     657.541   -31.1965     
1 1 1 11 26 27 o 0 851.6   41.3  ?      ?    3057.1  -83.7728     2538.85  -83.7728    932.547   -83.7728     
1 1 1 1  27 12 o 0 668.4   23.5  ?      ?    3246.53 -107.827     2048.59  -107.827    199.587   -107.827     
1 1 1 5  27 12 o 0 657.3   23.2  ?      ?    2250.69 136.59       2423.79  136.59      1186.28   136.59       
1 1 1 12 15 27 o 0 2545.2  92.7  ?      ?    7234.6  163.63       4146.68  163.63      376.385   -16.3702     
1 1 1 12 17 27 o 0 1886.9  70.2  ?      ?    5053.84 49.5829      4153.51  49.5829     1081.46   49.5829      
1 1 1 12 19 27 o 0 511     24.7  ?      ?    2849.7  -80.2467     1835.49  -80.2467    157.451   -80.2467     
1 1 1 12 21 27 o 0 20.6    13.8  ?      ?    923.97  -51.2811     327.495  128.719     847.313   128.719      
1 1 1 12 23 27 o 0 49.9    18.8  ?      ?    351.739 179.448      20.5294  -0.552226   210.815   -0.552226    
1 1 1 12 25 27 f 1 404.4   24.8  ?      ?    2052.35 113.968      1609.07  113.968     511.88    113.968      
1 1 1 0  27 13 o 0 27.2    7.3   ?      ?    944.791 90           141.357  90          396.666   -90          
1 1 1 13 14 27 o 0 912.4   35.4  ?      ?    3480.95 73.0757      2926.97  73.0757     741.413   73.0757      
1 1 1 13 16 27 o 0 516     22.6  ?      ?    4089.85 19.5205      1229.23  19.5205     1270.33   -160.479     
1 1 1 13 18 27 o 0 186.9   15    ?      ?    1208.34 14.8956      1012.22  14.8956     295.975   14.8956      
1 1 1 13 20 27 f 1 330.2   18.4  ?      ?    1993.52 140.25       1448.93  140.25      312.186   140.25       
1 1 1 13 22 27 o 0 498.3   25    ?      ?    2648.96 -132.805     1763.65  -132.805    317.466   -132.805     
1 1 1 13 24 27 o 0 98.4    16.4  ?      ?    668.836 -68.7556     188.155  -68.7556    171.138   111.244      
1 1 1 13 26 27 o 0 622.4   33.2  ?      ?    4447.17 -61.6239     1216.33  -61.6239    1067.01   118.376      
1 1 1 5  27 14 f 1 475.2   18.9  ?      ?    2348.59 -95.3381     2212.27  -95.3381    607.857   -95.3381     
1 1 1 9  27 14 o 0 670.8   24    ?      ?    2792.52 -114.374     2634.51  -114.374    802.389   -114.374     
1 1 1 11 27 14 o 0 567     23.1  ?      ?    3581.57 45.1422      1775.48  45.1422     502.771   -134.858     
1 1 1 14 17 27 o 0 602.8   28.1  ?      ?    4582.72 -74.2924     1223.87  -74.2924    1508.01   105.708      
1 1 1 14 21 27 f 1 251.4   17.7  ?      ?    1823.49 -153.901     1105.54  -153.901    96.3066   -153.901     
1 1 1 14 23 27 o 0 80.3    15.6  ?      ?    1577.06 -69.5794     16.8412  -69.5794    838.249   110.421      
1 1 1 14 25 27 f 1 1197.8  51.3  ?      ?    4842.16 -153.532     2447.35  -153.532    79.4453   26.4681      
1 1 1 0  27 15 o 0 17.3    8.4   ?      ?    843.528 -90          82.078   -90         509.604   90           
1 1 1 8  27 15 o 0 644.9   23.6  ?      ?    3261.05 -90.1344     2261     -90.1344    126.931   -90.1344     
1 1 1 10 27 15 o 0 471.9   19.1  ?      ?    2436.98 101.627      2048.39  101.627     501.692   101.627      
1 1 1 14 27 15 o 0 328.7   16.3  ?      ?    2806.19 154.644      1161.04  154.644     546.646   -25.3557     
1 1 1 15 16 27 o 0 191.1   14.6  ?      ?    2158.45 -66.0871     740.042  -66.0871    552.772   113.913      
1 1 1 15 18 27 o 0 414.6   23.8  ?      ?    3019.61 146.545      1350.87  146.545     383.157   -33.4549     
1 1 1 15 20 27 o 0 837.6   37.2  ?      ?    4128.26 -162.723     2085.66  -162.723    202.224   17.2769      
1 1 1 15 22 27 o 0 186.7   18.1  ?      ?    826.626 -154.558     821.283  -154.558    365.032   -154.558     
1 1 1 15 24 27 o 0 712.9   36    ?      ?    3048.32 128.582      2165.22  128.582     568.566   128.582      
1 1 1 15 26 27 o 0 14.7    24.2  ?      ?    1297.33 -80.1558     454.386  99.8442     1114.66   99.8442      
1 1 1 11 27 16 o 0 394.4   17.6  ?      ?    1943.64 -86.666      1920.27  -86.666     714.176   -86.666      
1 1 1 13 27 16 o 0 305.8   15.3  ?      ?    1574.25 68.8648      1620.15  68.8648     663.868   68.8648      
1 1 1 15 27 16 o 0 1103.1  42.7  ?      ?    3843.04 75.7832      3060.6   75.7832     781.708   75.7832      
1 1 1 16 17 27 f 1 459.7   23.4  ?      ?    2428.47 -133.837     1815.98  -133.837    406.809   -133.837     
1 1 1 16 19 27 f 1 539.3   26.6  ?      ?    3645.51 1.11932      1439.87  1.11932     603.876   -178.881     
1 1 1 16 21 27 o 0 919.3   42    ?      ?    3687.86 97.3931      2534.91  97.3931     485.124   97.3931      
1 1 1 16 23 27 o 0 373.7   26.7  ?      ?    2918.01 62.3003      1131.84  62.3003     409.062   -117.7       
1 1 1 16 25 27 f 1 127.9   25.1  ?      ?    980.23  127.096      383.096  127.096     114.49    -52.9043     
1 1 1 0  27 17 o 0 58.5    10.8  ?      ?    764.304 -90          300.461  -90         221.355   90           
1 1 1 10 27 17 o 0 1182.4  42.4  ?      ?    3432.87 123.661      3626.98  123.661     1504.85   123.661      
1 1 1 12 27 17 o 0 1571.2  58.4  ?      ?    4668.37 -93.878      3728.1   -93.878     900.865   -93.878      
1 1 1 14 27 17 o 0 726.2   29.4  ?      ?    3210.77 8.90152      2370.73  8.90152     470.382   8.90152      
1 1 1 16 27 17 f 1 490.1   22.8  ?      ?    2882.46 104.023      1690.46  104.023     35.9977   104.023      
1 1 1 17 18 27 o 0 646.1   31.2  ?      ?    2544.23 -113.816     2346.46  -113.816    921.373   -113.816     
1 1 1 17 20 27 o 0 145.9   16.7  ?      ?    2086.36 -48.7323     407.493  -48.7323    718.754   131.268      
1 1 1 17 22 27 o 0 156.5   19.9  ?      ?    651.251 -28.1673     465.903  -28.1673    119.609   -28.1673     
1 1 1 17 24 27 o 0 515.8   33.7  ?      ?    3220.27 27.2609      1448.98  27.2609     189.679   -152.739     
1 1 1 17 26 27 o 0 243.5   32.9  ?      ?    2815.83 142.365      512.013  142.365     878.596   -37.6352     
1 1 1 1  27 18 f 1 825.7   28.3  ?      ?    1949    81.4762      3664.91  81.4762     2373.35   81.4762      
1 1 1 9  27 18 o 0 286.7   14.7  ?      ?    1827.22 44.9159      1447.9   44.9159     323.886   44.9159      
1 1 1 11 27 18 o 0 410.8   18.5  ?      ?    3202.58 99.1843      1298.19  99.1843     633.144   -80.8157     
1 1 1 17 27 18 o 0 157.5   16    ?      ?    1588.23 -119.339     653.978  -119.339    225.433   60.6607      
1 1 1 18 19 27 o 0 359     22.3  ?      ?    3030.36 155.207      1056.93  155.207     586.443   -24.7934     
1 1 1 18 21 27 o 0 208.4   20.3  ?      ?    2716.55 14.4089      485.281  14.4089     967.422   -165.591     
1 1 1 18 23 27 o 0 440.6   32.3  ?      ?    3639.22 7.13408      1016.22  7.13408     848.194   -172.866     
1 1 1 18 25 27 f 1 36.8    28.6  ?      ?    1118.69 163.005      266.682  -16.9953    826.679   -16.9953     
1 1 1 0  27 19 o 0 26      11.6  ?      ?    811.94  90           111.1    90          419.333   -90          
1 1 1 8  27 19 o 0 760.6   27.8  ?      ?    3183.83 51.7448      2572.08  51.7448     625.404   51.7448      
1 1 1 14 27 19 o 0 636.9   27.5  ?      ?    3654.5  25.9374      1792.7   25.9374     282.171   -154.063     
1 1 1 16 27 19 f 1 133     14.9  ?      ?    1058.82 -178.27      545.789  -178.27     42.7359   1.72967      
1 1 1 18 27 19 o 0 733.8   35.2  ?      ?    3540.35 117.458      2029.41  117.458     132.028   117.458      
1 1 1 19 20 27 o 0 1881.7  72.5  ?      ?    5938.7  -74.803      3319.52  -74.803     129.851   -74.803      
1 1 1 19 22 27 o 0 693     35.5  ?      ?    2594.62 -26.7615     2269.89  -26.7615    933.394   -26.7615     
1 1 1 19 24 27 o 0 342.1   30.1  ?      ?    1147.03 -78.9532     1328.83  -78.9532    754.134   -78.9532     
1 1 1 19 26 27 o 0 1480.5  70.5  ?      ?    5015.57 105.732      2607.67  105.732     214.33    105.732      
1 1 1 9  27 20 o 0 1528.6  52.3  ?      ?    4250.23 -21.9414     3821.29  -21.9414    1289.03   -21.9414     
1 1 1 11 27 20 o 0 254.1   14.5  ?      ?    1147.83 165.947      1311.77  165.947     648.392   165.947      
1 1 1 13 27 20 f 1 186.9   14.6  ?      ?    1760.62 -107.615     799.339  -107.615    201.13    72.3845      
1 1 1 15 27 20 o 0 420.2   21.6  ?      ?    2049.8  -52.0857     1755.48  -52.0857    626.355   -52.0857     
1 1 1 17 27 20 o 0 279.1   20.3  ?      ?    2654.22 3.74501      875.999  3.74501     544.186   -176.255     
1 1 1 19 27 20 o 0 271.7   23.1  ?      ?    2017.6  176.466      1066.71  176.466     4.26768   -3.53356     
1 1 1 20 21 27 o 0 1421.8  58.1  ?      ?    4466.79 -176.712     3090.8   -176.712    780.639   -176.712     
1 1 1 20 23 27 o 0 559.9   34.7  ?      ?    1837.57 -121.371     2017.1   -121.371    1091.7    -121.371     
1 1 1 20 25 27 o 0 1034.5  55.3  ?      ?    4164.57 38.8329      2159.8   38.8329     160.157   38.8329      
1 1 1 0  27 21 o 0 1504    74.3  ?      ?    5414.61 -90          3395.51  -90         14.8537   90           
1 1 1 6  27 21 f 1 610.8   24.3  ?      ?    4013.69 -8.38291     1576.67  -8.38291    851.865   171.617      
1 1 1 8  27 21 o 0 641.8   26.8  ?      ?    3722.31 144.424      1823.82  144.424     376.239   -35.5764     
1 1 1 12 27 21 o 0 478.4   21.4  ?      ?    4118.53 66.6255      1001.1   66.6255     1311.83   -113.375     
1 1 1 14 27 21 f 1 500.8   25.2  ?      ?    3206.22 -70.4748     1505.21  -70.4748    262.269   109.525      
1 1 1 16 27 21 o 0 1415.5  58.2  ?      ?    5064.87 103.992      2935.98  103.992     138.502   103.992      
1 1 1 18 27 21 o 0 106.9   19.8  ?      ?    2811.82 -175.884     190.089  4.11644     1680.64   4.11644      
1 1 1 20 27 21 o 0 932.1   43.3  ?      ?    3632.33 25.5388      2407.08  25.5388     549.65    25.5388      
1 1 1 21 22 27 o 0 46.4    23.7  ?      ?    290.352 -50.3751     50.9473  129.625     197.702   129.625      
1 1 1 21 24 27 o 0 591.8   41.3  ?      ?    2337.59 -71.6005     1865.5   -71.6005    737.771   -71.6005     
1 1 1 21 26 27 o 0 2614.2  111.8 ?      ?    6239.7  -110.51      3577.23  -110.51     718.12    -110.51      
1 1 1 5  27 22 o 0 384.1   17.4  ?      ?    1886.71 -173.184     1824.13  -173.184    700.611   -173.184     
1 1 1 9  27 22 o 0 199.1   13.4  ?      ?    1260.1  -122.41      986.002  -122.41     269.098   -122.41      
1 1 1 11 27 22 o 0 538.5   23.5  ?      ?    2916.63 -15.6412     1812.07  -15.6412    186.445   -15.6412     
1 1 1 13 27 22 o 0 955.5   37    ?      ?    3338.92 -141.014     2749.74  -141.014    931.045   -141.014     
1 1 1 15 27 22 o 0 189.5   18.8  ?      ?    2426.29 44.6016      542.033  44.6016     791.541   -135.398     
1 1 1 17 27 22 o 0 825.6   40.4  ?      ?    3410.47 19.6484      2322.21  19.6484     519.94    19.6484      
1 1 1 19 27 22 o 0 82.3    21.6  ?      ?    2726.89 -148.373     339.883  31.6275     1732.9    31.6275      
1 1 1 21 27 22 o 0 188.5   26    ?      ?    1315.64 -151.815     652.827  -151.815    5.203     28.1849      
1 1 1 22 23 27 o 0 356.2   36.3  ?      ?    2498.96 169.057      1069.54  169.057     139.881   -10.9431     
1 1 1 22 25 27 o 0 627.7   51.6  ?      ?    2456    -106.695     1801.37  -106.695    671.173   -106.695     
1 1 1 0  27 23 o 0 955.9   50.3  ?      ?    3586.7  -90          2599.99  -90         454.148   -90          
1 1 1 6  27 23 o 0 244.1   14.8  ?      ?    2409.65 166.651      876.347  166.651     504.94    -13.3486     
1 1 1 8  27 23 o 0 371.4   19.4  ?      ?    2943.52 68.9866      1191.95  68.9865     465.977   -111.013     
1 1 1 10 27 23 o 0 207.8   14.5  ?      ?    2774.94 -90.8145     490.248  -90.8145    1042.54   89.1855      
1 1 1 12 27 23 o 0 108.3   13.7  ?      ?    1968.36 113.513      188.229  113.513     875.562   -66.4867     
1 1 1 14 27 23 o 0 2318.5  79.7  ?      ?    7095.86 -152.816     3468.57  -152.816    369.195   27.1841      
1 1 1 16 27 23 o 0 1759.8  73.1  ?      ?    4490.13 -0.90468     3762.04  -0.90468    1400.62   -0.90468     
1 1 1 18 27 23 o 0 508.4   31.4  ?      ?    2236.14 -121.486     1835.77  -121.486    696.731   -121.486     
1 1 1 20 27 23 o 0 484.7   33.7  ?      ?    2859.03 115.344      1405.04  115.344     24.052    -64.6557     
1 1 1 22 27 23 o 0 181.2   33.7  ?      ?    1777.82 107.584      531.551  107.584     320.941   -72.4164     
1 1 1 23 24 27 o 0 562.1   47.4  ?      ?    2363.53 20.7262      1662.41  20.7262     571.864   20.7262      
1 1 1 23 26 27 o 0 1431.6  79.6  ?      ?    5687.31 -22.8535     2027.54  -22.8535    465.628   157.146      
1 1 1 1  27 24 o 0 1075.9  40.2  ?      ?    4127.13 -160.922     2819.02  -160.922    418.17    -160.922     
1 1 1 3  27 24 o 0 1373.7  46.7  ?      ?    4784.13 -20.5607     3115.92  -20.5607    368.321   -20.5607     
1 1 1 5  27 24 o 0 212.8   14.7  ?      ?    3049.91 132.238      395.654  132.238     1330.5    -47.7622     
1 1 1 7  27 24 o 0 87.3    13.1  ?      ?    883.308 40.4824      217.697  40.4824     274.07    -139.518     
1 1 1 9  27 24 o 0 323.4   20.2  ?      ?    2626.87 16.1722      1105.28  16.1722     330.516   -163.828     
1 1 1 11 27 24 o 0 435.8   22.6  ?      ?    3040.25 92.0963      1378.58  92.0964     307.253   -87.9036     
1 1 1 13 27 24 o 0 -5.1    14.1  ?      ?    895.69  -57.4961     417.634  122.504     898.193   122.504      
1 1 1 15 27 24 o 0 128.5   19.3  ?      ?    1745.66 -117.525     338.657  -117.525    573.486   62.4749      
1 1 1 17 27 24 o 0 39.9    21.8  ?      ?    942.827 -151.174     190.376  28.8257     668.4     28.8257      
1 1 1 19 27 24 o 0 191.6   33.2  ?      ?    1313.65 31.4069      663.81   31.4069     8.85686   31.4069      
1 1 1 21 27 24 o 0 324.2   37.3  ?      ?    2626.15 -19.1761     894.662  -19.1761    364.413   160.824      
1 1 1 23 27 24 o 0 412.1   44.5  ?      ?    1883.6  -67.1976     1338.57  -67.1976    476.028   -67.1976     
1 1 1 24 25 27 o 0 2003.5  97.7  ?      ?    4711.32 -121.415     3286.22  -121.415    1216.56   -121.415     
1 1 1 0  27 25 o 0 3663.7  172.8 ?      ?    6228.17 90           4853.45  90          1294.62   90           
1 1 1 2  27 25 o 0 450.7   22.7  ?      ?    2817.62 -161.09      1570.39  -161.09     21.9002   18.9095      
1 1 1 4  27 25 o 0 671.4   27.2  ?      ?    3577.61 -101.788     1909.63  -101.788    85.6953   78.2118      
1 1 1 6  27 25 o 0 306.3   18.6  ?      ?    2851.32 43.2181      931.998  43.2181     634.332   -136.782     
1 1 1 8  27 25 o 0 190.5   17    ?      ?    2379.46 -147.91      558.418  -147.91     726.43    32.0898      
1 1 1 10 27 25 f 1 782.2   34.4  ?      ?    2572.52 43.158       2652     43.158      1246.71   43.158       
1 1 1 12 27 25 f 1 628.8   28.9  ?      ?    3643.99 -96.8555     1662.58  -96.8555    284.738   83.1445      
1 1 1 14 27 25 f 1 64.8    17.6  ?      ?    1983.78 39.4035      233.447  -140.596    1267.44   -140.596     
1 1 1 16 27 25 f 1 853.3   41.4  ?      ?    3320.49 -13.2264     2315.18  -13.2264    632.956   -13.2264     
1 1 1 18 27 25 f 1 1024.5  56.2  ?      ?    5205.68 14.2941      1710.98  14.2941     887.57    -165.706     
1 1 1 20 27 25 o 0 274.5   38.5  ?      ?    1826.06 -173.483     949.203  -173.483    75.6304   -173.483     
1 1 1 22 27 25 o 0 416.8   47.7  ?      ?    2282.36 -113.712     1247.34  -113.712    201.837   -113.712     
1 1 1 24 27 25 o 0 872     64.3  ?      ?    3415.28 155.43       1919.36  155.43      427.247   155.43       
1 1 1 25 26 27 f 1 146.4   62.8  ?      ?    2627.19 174.274      40.3786  -5.72573    1157.55   -5.72573     
1 1 1 1  27 26 o 0 1738.1  62    ?      ?    4436.6  51.3431      3916.71  51.3431     1455.43   51.3431      
1 1 1 3  27 26 o 0 700.6   29.3  ?      ?    3546.86 -101.117     1979.39  -101.117    34.1183   -101.117     
1 1 1 5  27 26 o 0 115.6   16    ?      ?    1613.57 92.8604      360.993  92.8604     543.085   -87.1396     
1 1 1 7  27 26 o 0 729.6   32.8  ?      ?    3645.34 177.547      2018.87  177.547     27.8036   177.547      
1 1 1 9  27 26 o 0 49.3    16.4  ?      ?    2015.57 -163.875     422.81   16.1245     1503.94   16.1245      
1 1 1 11 27 26 o 0 80      15.9  ?      ?    1336.98 61.3212      58.4947  61.3212     644.011   -118.679     
1 1 1 13 27 26 o 0 421.7   25.5  ?      ?    2530.78 103.52       1440.22  103.52      141.308   103.52       
1 1 1 15 27 26 o 0 1131.2  52.2  ?      ?    3647.57 -102.572     2736.12  -102.572    881.107   -102.572     
1 1 1 17 27 26 o 0 220.2   31.9  ?      ?    1840.37 -0.054847    730.173  -0.054847   177.634   179.945      
1 1 1 19 27 26 o 0 813.2   57.7  ?      ?    1287.28 36.0772      2646.57  36.0772     2033.29   36.0772      
1 1 1 21 27 26 o 0 278.3   43.5  ?      ?    1330.93 120.838      911.275  120.838     302.677   120.838      
1 1 1 23 27 26 o 0 272.7   55    ?      ?    1399.85 -89.7857     847.079  -89.7857    234.953   -89.7857     
1 1 1 25 27 26 f 1 475.6   68.2  ?      ?    3030.58 27.6231      1015.95  27.6231     268.939   -152.377     
1 1 1 0  27 27 o 0 866.1   52    ?      ?    2581.56 -90          2327.97  -90         889.577   -90          
1 1 1 2  27 27 f 1 452.4   26.8  ?      ?    2084.42 24.0949      1842.13  24.0949     685.189   24.0949      
1 1 1 4  27 27 o 0 629.6   28.9  ?      ?    2669.78 158.167      2179.43  158.167     723.42    158.167      
1 1 1 6  27 27 f 1 1403.9  52.4  ?      ?    4636.45 23.6185      3078.85  23.6185     572.13    23.6185      
1 1 1 8  27 27 f 1 164     18.7  ?      ?    1521.36 108.17       616.517  108.17      192.414   -71.8296     
1 1 1 10 27 27 o 0 26.8    17.9  ?      ?    194.131 -157.772     56.3938  22.2279     157.084   22.2279      
1 1 1 12 27 27 o 0 1656.5  61.5  ?      ?    4607.93 -36.4798     3398.22  -36.4798    1060.22   -36.4798     
1 1 1 14 27 27 o 0 106.5   25    ?      ?    1852.92 -124.599     84.0101  -124.599    849.062   55.4012      
1 1 1 16 27 27 o 0 -27.3   28    ?      ?    1418.7  126.981      574.111  -53.0194    1268.3    -53.0194     
1 1 1 18 27 27 o 0 2568.8  108.1 ?      ?    6343.42 -154.23      3595.93  -154.23     592.049   -154.23      
1 1 1 20 27 27 o 0 389.1   52    ?      ?    2022.43 8.54218      1220.66  8.54218     299.355   8.54218      
1 1 1 22 27 27 o 0 596.4   57    ?      ?    3384.49 71.3914      1303.03  71.3914     175.042   -108.609     
1 1 1 24 27 27 o 0 -46.6   60.1  ?      ?    1404.35 -105.083     400.265  74.9173     993.195   74.9173      
1 1 1 26 27 27 o 0 1163.9  96.5  ?      ?    5424.88 -160.497     1464.5   -160.497    706.993   19.5031      
1 1 1 0  28 0  o 0 43.1    7     ?      ?    1949.48 -180         199.556  180         943.952   1.91177e-13  
1 1 1 0  2  28 o 0 26.6    4.8   ?      ?    1255.44 -8.58418e-14 184.405  0           527.028   180          
1 1 1 0  4  28 o 0 768.2   34.1  ?      ?    3621.4  -8.84396e-15 2166.97  0           109.495   1.66184e-13  
1 1 1 0  6  28 o 0 23.2    5.1   ?      ?    885.502 -180         116.954  180         385.278   1.94537e-14  
1 1 1 0  8  28 o 0 287.4   15.5  ?      ?    2614.91 -180         1312.83  180         161.307   6.84183e-14  
1 1 1 0  10 28 o 0 8.3     4.6   ?      ?    209.527 4.08544e-14  7.55565  0           109.335   -180         
1 1 1 0  12 28 o 0 75.7    7.4   ?      ?    598.983 4.13442e-14  320.003  0           94.6628   -180         
1 1 1 0  14 28 o 0 211.6   11.8  ?      ?    623.704 180          832.339  180         408.774   -180         
1 1 1 0  16 28 o 0 454.5   24.3  ?      ?    2171.38 -1.83038e-14 1941.61  0           518.889   5.01864e-14  
1 1 1 0  18 28 o 0 -1      8.5   ?      ?    239.73  -1.4875e-13  4.22932  0           148.539   180          
1 1 1 0  20 28 o 0 57.3    10.1  ?      ?    784.698 3.91607e-14  268.644  0           215.647   -180         
1 1 1 0  22 28 f 1 11.8    11.6  ?      ?    888.651 3.75067e-14  39.7997  0           486.774   -180         
1 1 1 0  24 28 o 0 797.9   46    ?      ?    1802.8  1.11204e-14  2243.85  0           1223.54   -9.27329e-15 
1 1 1 0  26 28 o 0 486.9   37.9  ?      ?    3190.32 180          1737.69  180         33.9604   2.95515e-13  
1 1 1 1  3  28 o 0 820.2   25.9  ?      ?    4342.27 -122.712     1884.74  -122.712    565.22    57.2882      
1 1 1 1  5  28 o 0 952.5   32.2  ?      ?    3415.76 -103.135     2719.46  -103.135    792.077   -103.135     
1 1 1 1  11 28 o 0 913.2   28.8  ?      ?    5174.85 178.319      1637.27  178.319     1210.5    -1.68059     
1 1 1 1  13 28 o 0 631.5   20.5  ?      ?    2532.43 22.5397      2748.37  22.5397     1022.5    22.5397      
1 1 1 1  15 28 o 0 584.6   20.2  ?      ?    1069.81 -148.7       3133.08  -148.7      2419.25   -148.7       
1 1 1 1  21 28 o 0 317.3   14.6  ?      ?    1857.05 -79.7592     1558.2   -79.7592    437.989   -79.7592     
1 1 1 1  23 28 o 0 645.5   28    ?      ?    3076.43 173.351      2143.76  173.351     374.913   173.351      
1 1 1 1  25 28 o 0 128.4   18.7  ?      ?    3550.45 -86.2151     371.706  93.7849     2329.36   93.7849      
1 1 1 1  27 28 o 0 989.4   42.3  ?      ?    3445.63 -72.204      2775.78  -72.204     914.561   -72.204      
1 1 1 0  28 2  o 0 628.5   29    ?      ?    3685.91 -4.09912e-14 1989.96  0           135.946   180          
1 1 1 2  4  28 o 0 1628.8  51.8  ?      ?    4022.76 170.502      3847.3   170.502     1590.26   170.502      
1 1 1 2  6  28 o 0 1004.2  33.7  ?      ?    3305.81 -59.7019     2881.11  -59.7019    1030.62   -59.7019     
1 1 1 2  14 28 o 0 718.3   23.3  ?      ?    3572.43 -86.5569     2384.28  -86.5569    10.1201   93.4431      
1 1 1 2  20 28 o 0 463.8   18.2  ?      ?    2546.51 165.278      1882.66  165.278     328.827   165.278      
1 1 1 2  22 28 o 0 238.2   14.7  ?      ?    1372.19 162.859      1223.52  162.859     423.544   162.859      
1 1 1 2  24 28 o 0 930.6   36.1  ?      ?    3620.2  71.3954      2621.45  71.3954     592.659   71.3954      
1 1 1 2  26 28 o 0 349     23.6  ?      ?    3785.52 115.617      657.977  115.617     1425.25   -64.3827     
1 1 1 1  28 3  o 0 1691.9  50.2  ?      ?    4825.83 -85.8032     3613.52  -85.8032    848.533   -85.8032     
1 1 1 3  28 3  o 0 1059.8  33    ?      ?    3751.15 34.5459      2804.5   34.5459     689.746   34.5459      
1 1 1 3  13 28 o 0 696.2   23.6  ?      ?    2438.3  -177.711     2997.04  -177.711    1357.46   -177.711     
1 1 1 3  21 28 f 1 588.2   22.5  ?      ?    3792.14 23.2239      1610.75  23.2239     662.547   -156.776     
1 1 1 3  23 28 f 1 109.6   12.2  ?      ?    562.67  114.655      298.846  114.655     22.8522   -65.3455     
1 1 1 3  25 28 o 0 44.3    17.8  ?      ?    1175.16 35.1464      185.533  -144.854    826.629   -144.854     
1 1 1 3  27 28 o 0 399.5   24.2  ?      ?    2530.68 27.4703      1416.84  27.4703     63.4707   27.4703      
1 1 1 0  28 4  o 0 2875    123   ?      ?    7640.89 -180         4255.04  180         164.444   3.33562e-13  
1 1 1 4  10 28 o 0 816.9   26.9  ?      ?    3603.76 169.621      2183.08  169.621     225.725   169.621      
1 1 1 4  14 28 o 0 545.9   18.9  ?      ?    2771.22 68.9574      2207.61  68.9574     374.998   68.9574      
1 1 1 4  20 28 o 0 846.6   29.6  ?      ?    4532.77 -121.76      2030.62  -121.76     699.967   58.2401      
1 1 1 4  24 28 o 0 281.2   17.1  ?      ?    2310.21 -20.2844     1070.88  -20.2844    208.315   159.716      
1 1 1 4  26 28 o 0 796.3   34.3  ?      ?    4252.28 -54.3232     1894.7   -54.3232    418.498   125.677      
1 1 1 1  28 5  o 0 633.9   20.7  ?      ?    2188.2  94.3442      2484.02  94.3442     1229.75   94.3442      
1 1 1 5  19 28 o 0 600.2   22.9  ?      ?    2528.7  24.0061      2386.84  24.0061     849.577   24.0061      
1 1 1 5  21 28 o 0 1468.8  53.5  ?      ?    5414.98 134.825      3006.9   134.825     145.935   -45.1755     
1 1 1 5  23 28 o 0 429     22.1  ?      ?    2099.1  -165.041     1801.6   -165.041    623.817   -165.041     
1 1 1 5  25 28 o 0 584.9   26.4  ?      ?    3551.32 -161.994     1651.69  -161.994    329.075   18.006       
1 1 1 5  27 28 o 0 183.5   20.1  ?      ?    3491.23 -75.7655     4.39832  104.235     1848.1    104.235      
1 1 1 0  28 6  o 0 200.2   11.6  ?      ?    2847.02 3.27255e-15  1120.71  0           523.61    -180         
1 1 1 6  20 28 f 1 289.3   14.7  ?      ?    2121.24 -27.4991     1279.27  -27.4991    12.2015   -27.4991     
1 1 1 6  22 28 o 0 1052.5  40.9  ?      ?    4715.59 30.4133      2377.29  30.4133     299.829   -149.587     
1 1 1 6  24 28 f 1 157.9   18.2  ?      ?    2046.55 161.956      499.007  161.956     624.71    -18.0438     
1 1 1 6  26 28 o 0 263.2   19.9  ?      ?    3033.06 147.792      621.841  147.792     1005.31   -32.2081     
1 1 1 5  28 7  o 0 816.3   27.1  ?      ?    3060.7  101.213      2491.73  101.213     801.852   101.213      
1 1 1 7  9  28 o 0 747.5   25.2  ?      ?    3968.1  153.311      1789.93  153.311     338.697   -26.6892     
1 1 1 7  13 28 o 0 497.5   18.6  ?      ?    2206.29 150.79       2306.43  150.79      862.221   150.79       
1 1 1 7  21 28 o 0 380.5   20.4  ?      ?    1805.29 -129.245     1758.99  -129.245    723.385   -129.245     
1 1 1 7  23 28 o 0 987.1   39.6  ?      ?    2688.65 52.1654      3183.97  52.1654     1697.86   52.1654      
1 1 1 7  25 28 o 0 186.7   21.4  ?      ?    1357.02 -84.8765     790.988  -84.8765    52.5997   -84.8765     
1 1 1 7  27 28 o 0 398.6   25.4  ?      ?    2401.32 -8.0968      1426.74  -8.0968     177.624   -8.0968      
1 1 1 0  28 8  o 0 26.2    6.2   ?      ?    779.797 -180         117.305  180         330.436   2.54272e-14  
1 1 1 8  14 28 o 0 657.4   26.4  ?      ?    3755.84 175.285      1993.68  175.285     393.102   -4.71462     
1 1 1 8  18 28 o 0 916.5   36.1  ?      ?    3582.19 -6.084       2769.25  -6.084      607.118   -6.084       
1 1 1 8  20 28 o 0 508     23.6  ?      ?    2727.75 -129.394     1864.74  -129.394    285.539   -129.394     
1 1 1 8  22 28 o 0 432.5   23.9  ?      ?    2841.02 -28.0115     1472.04  -28.0115    115.542   151.988      
1 1 1 8  24 28 o 0 408.5   26.4  ?      ?    1945.83 -92.3358     1706.47  -92.3358    661.016   -92.3358     
1 1 1 8  26 28 o 0 54.1    23.2  ?      ?    3410.12 116.54       940.522  -63.4605    2740.39   -63.4605     
1 1 1 7  28 9  o 0 707     23.9  ?      ?    2694.88 -163.415     2311.98  -163.415    861.259   -163.415     
1 1 1 9  28 9  o 0 577.4   20.7  ?      ?    2077.25 -24.5059     2735.47  -24.5059    1350.39   -24.5059     
1 1 1 9  11 28 f 1 1558.6  52.4  ?      ?    4280.07 -178.83      4168.58  -178.83     1337.57   -178.83      
1 1 1 9  19 28 o 0 282.1   16    ?      ?    962.978 10.7647      1529.88  10.7647     962.117   10.7647      
1 1 1 9  21 28 o 0 120.4   15.5  ?      ?    1682.32 -158.515     379.44   -158.515    569.815   21.4847      
1 1 1 9  23 28 o 0 403.2   23.8  ?      ?    1847.54 -72.5233     1741.84  -72.5233    737.828   -72.5233     
1 1 1 9  25 28 o 0 20      21.9  ?      ?    984.568 -41.3981     327.574  138.602     854.082   138.602      
1 1 1 9  27 28 o 0 866.5   41.7  ?      ?    4162.11 65.4698      1998.97  65.4698     128.116   -114.53      
1 1 1 0  28 10 o 0 443.3   21.5  ?      ?    1678.69 -180         1633.94  180         680.057   180          
1 1 1 2  28 10 o 0 707.9   23.8  ?      ?    3365.77 -171.713     2063.06  -171.713    184.325   -171.713     
1 1 1 10 28 10 o 0 521.5   19.6  ?      ?    3148.02 128.032      1874.48  128.032     192.505   -51.9684     
1 1 1 10 12 28 o 0 859.7   31.4  ?      ?    3098.95 72.4471      3047.17  72.4471     1065.34   72.4471      
1 1 1 10 18 28 o 0 200     13.4  ?      ?    1184.85 -70.8872     1097.77  -70.8872    394.239   -70.8872     
1 1 1 10 20 28 o 0 2036.3  80.7  ?      ?    6360.99 103.451      3492.23  103.451     127.934   -76.5495     
1 1 1 10 22 28 o 0 73.4    17.8  ?      ?    1909.47 -108.135     86.8085  71.8649     1135.05   71.8649      
1 1 1 10 24 28 o 0 2517.3  95.6  ?      ?    6596.58 113.568      4038.74  113.568     469.442   113.568      
1 1 1 10 26 28 o 0 2220.1  88    ?      ?    5910.06 -73.0366     3762.79  -73.0366    701.618   -73.0366     
1 1 1 1  28 11 o 0 597.3   19.5  ?      ?    2959.13 178.682      1940.93  178.682     285.873   178.682      
1 1 1 3  28 11 f 1 825.1   26.5  ?      ?    4770.51 63.4617      1609.14  63.4617     1027.49   -116.538     
1 1 1 9  28 11 f 1 608.9   22    ?      ?    2675.1  -12.2677     2478.09  -12.2677    709.324   -12.2677     
1 1 1 11 15 28 o 0 354.2   17.1  ?      ?    3073.62 100.609      1143.89  100.609     742.846   -79.3913     
1 1 1 11 19 28 o 0 566.6   27.4  ?      ?    3371.55 131.032      1725.62  131.032     207.713   -48.9685     
1 1 1 11 21 28 o 0 762.2   35.9  ?      ?    4073.14 -50.8839     1904.83  -50.8839    351.405   129.116      
1 1 1 11 23 28 o 0 103.9   21.1  ?      ?    1818.67 20.1453      204.411  20.1453     799.68    -159.855     
1 1 1 11 25 28 o 0 97.9    25.1  ?      ?    683.81  68.403       180.524  68.403      177.956   -111.597     
1 1 1 11 27 28 o 0 2026.9  83    ?      ?    6226.37 -170.43      3123.29  -170.43     49.636    9.57036      
1 1 1 0  28 12 o 0 105.5   9.2   ?      ?    1833.76 -180         896.17   180         396.633   6.99659e-14  
1 1 1 4  28 12 o 0 443.6   16.6  ?      ?    2779.64 -42.1723     1836.15  -42.1723    56.3855   137.828      
1 1 1 12 16 28 o 0 670.8   27.7  ?      ?    4646.45 71.1655      1423.11  71.1655     1367.33   -108.835     
1 1 1 12 18 28 o 0 129.6   13.4  ?      ?    1885.86 66.8274      393.549  66.8273     694.951   -113.173     
1 1 1 12 20 28 o 0 1554.3  63.2  ?      ?    4535.45 -87.2334     3526.97  -87.2334    994.716   -87.2334     
1 1 1 12 22 28 f 1 1202.5  51.4  ?      ?    5657.09 150.11       2091.18  150.11      969.954   -29.8904     
1 1 1 12 24 28 o 0 1538.5  66.9  ?      ?    4876.65 -90.7302     3187.56  -90.7302    603.374   -90.7302     
1 1 1 12 26 28 o 0 864.3   44.6  ?      ?    3371.15 98.2134      2341.29  98.2134     632.504   98.2134      
1 1 1 1  28 13 o 0 512.7   18.1  ?      ?    2220.98 60.4646      2497.32  60.4646     959.337   60.4646      
1 1 1 3  28 13 o 0 480     18    ?      ?    1125.61 -143.548     2759.53  -143.548    1993.43   -143.548     
1 1 1 9  28 13 f 1 837.4   29.7  ?      ?    2264.46 104.26       3425.07  104.26      1972.35   104.26       
1 1 1 13 15 28 f 1 454     21.2  ?      ?    2597.79 50.3371      1786.82  50.3371     211.079   50.3371      
1 1 1 13 17 28 o 0 309.5   16.9  ?      ?    2082.34 -42.1995     1380.99  -42.1995    160.036   -42.1995     
1 1 1 13 19 28 o 0 779.4   33    ?      ?    3531.29 -20.9516     2262.92  -20.9516    277.761   -20.9516     
1 1 1 13 21 28 o 0 165.2   20.5  ?      ?    2488.06 133.15       365.609  133.15      984.134   -46.8499     
1 1 1 13 23 28 f 1 188.1   24.2  ?      ?    2964.07 179.886      256.255  179.886     1338.43   -0.114274    
1 1 1 13 25 28 o 0 867.4   40.7  ?      ?    4990.3  103.291      1607.92  103.291     949.42    -76.709      
1 1 1 13 27 28 o 0 60.6    24.3  ?      ?    812.11  117.8        75.3571  -62.1995    479.579   -62.1995     
1 1 1 0  28 14 o 0 133.5   11.5  ?      ?    2058.55 180          1045.49  180         377.442   4.5581e-15   
1 1 1 12 28 14 f 1 365.7   16.7  ?      ?    2592.3  -138.703     1444.72  -138.703    152.58    41.2969      
1 1 1 14 28 14 o 0 362     18.7  ?      ?    2941.35 28.8633      1220.9   28.8633     540.562   -151.137     
1 1 1 14 18 28 o 0 528.8   27.5  ?      ?    1570.18 -122.26      2369.09  -122.26     1481.24   -122.26      
1 1 1 14 20 28 o 0 123.1   15.3  ?      ?    1124.65 26.3301      473.935  26.3301     140.496   -153.67      
1 1 1 14 22 28 o 0 463.1   26.4  ?      ?    3855.06 59.7726      1047.41  59.7726     1032.25   -120.227     
1 1 1 14 24 28 o 0 1255.8  54    ?      ?    4632.22 80.0071      2677.88  80.0071     280.997   80.0071      
1 1 1 14 26 28 o 0 2664.8  104.2 ?      ?    4335.64 -91.9277     4912.75  -91.9277    2730.77   -91.9277     
1 1 1 9  28 15 o 0 719.4   26    ?      ?    2959.37 -86.0192     2620.22  -86.0192    773.03    -86.0192     
1 1 1 11 28 15 o 0 505.1   21.9  ?      ?    1781.13 -119.757     2410.89  -119.757    1320.89   -119.757     
1 1 1 15 28 15 o 0 960.3   38.4  ?      ?    3024.99 -54.4262     3092.74  -54.4262    1325.85   -54.4262     
1 1 1 15 17 28 o 0 513.1   26.3  ?      ?    2146.37 -157.805     2113.18  -157.805    893.733   -157.805     
1 1 1 15 19 28 o 0 205.7   16.3  ?      ?    2269.59 139.986      699.691  139.986     547.653   -40.0141     
1 1 1 15 21 28 f 1 1180    48.9  ?      ?    3541.41 29.1215      3182.37  29.1215     1247.31   29.1215      
1 1 1 15 23 28 o 0 1881.3  75.7  ?      ?    4918.24 -47.5036     3732.86  -47.5036    1166.47   -47.5036     
1 1 1 15 25 28 o 0 1367.7  60.1  ?      ?    4586.22 149.924      2770.8   149.924     440.179   149.924      
1 1 1 15 27 28 o 0 755     45.1  ?      ?    3826.74 -41.9835     1694.51  -41.9835    159.551   138.016      
1 1 1 0  28 16 o 0 22.3    11.3  ?      ?    515.517 180          59.2698  180         284.218   -5.96193e-14 
1 1 1 6  28 16 o 0 618.7   22.8  ?      ?    3956.32 20.983       1736.29  20.983      770.684   -159.017     
1 1 1 8  28 16 o 0 372.2   15.7  ?      ?    2207.94 -134.626     1702.58  -134.626    328.468   -134.626     
1 1 1 10 28 16 o 0 1059.6  39.1  ?      ?    3191.83 0.226652     3405.1   0.226652    1456.45   0.226652     
1 1 1 12 28 16 o 0 2228.4  81.8  ?      ?    5311.45 148.406      4559.17  148.406     1383.91   148.406      
1 1 1 14 28 16 o 0 708.9   29.5  ?      ?    3891.63 175.502      1918.93  175.502     353.429   -4.49781     
1 1 1 16 28 16 o 0 235.3   16.2  ?      ?    2462.67 42.577       790.248  42.577      595.54    -137.423     
1 1 1 16 18 28 o 0 14.7    16.8  ?      ?    1234.95 22.6965      465.524  -157.304    1147.52   -157.304     
1 1 1 16 20 28 o 0 170.2   18.2  ?      ?    2046.29 14.5171      585.799  14.5171     543.564   -165.483     
1 1 1 16 22 28 o 0 1663.6  69.7  ?      ?    5427.28 -160.971     3119.02  -160.971    266.611   -160.971     
1 1 1 16 24 28 o 0 707.1   42.3  ?      ?    2414.01 -81.9523     2327.8   -81.9523    1112.27   -81.9523     
1 1 1 16 26 28 o 0 1268.3  59.6  ?      ?    4209.21 66.7536      2652.04  66.7536     592.834   66.7536      
1 1 1 7  28 17 o 0 1123.8  39.4  ?      ?    5038.27 -168.587     2548.31  -168.587    574.495   11.4133      
1 1 1 11 28 17 o 0 736.4   28.6  ?      ?    2099.04 21.5476      2987.04  21.5476     1735.72   21.5476      
1 1 1 15 28 17 o 0 284.5   17.6  ?      ?    2510.96 75.7287      1011.96  75.7287     400.539   -104.271     
1 1 1 17 28 17 o 0 453.5   24.1  ?      ?    3001.04 -5.97285     1441.29  -5.97285    198.557   174.027      
1 1 1 17 19 28 o 0 278.5   22    ?      ?    2614.1  17.1825      923.098  17.1825     526.542   -162.817     
1 1 1 17 21 28 o 0 472.6   29.3  ?      ?    4225.08 -81.9614     878.572  -81.9614    1355.19   98.0386      
1 1 1 17 23 28 o 0 1385.7  62.5  ?      ?    3465.4  81.1989      3427.2   81.1989     1669.83   81.1989      
1 1 1 17 25 28 f 1 1568.9  72.4  ?      ?    3359.75 -99.8023     3593.03  -99.8023    1926.31   -99.8023     
1 1 1 17 27 28 o 0 334.1   39.3  ?      ?    1701.74 -153.948     1189.82  -153.948    390.338   -153.948     
1 1 1 0  28 18 o 0 501.6   28.8  ?      ?    3367.32 -180         2017.34  180         161.742   2.06073e-13  
1 1 1 2  28 18 o 0 730.8   25.9  ?      ?    3054.44 -109.194     2659.06  -109.194    712.324   -109.194     
1 1 1 8  28 18 o 0 337.3   14.9  ?      ?    975.7   95.7057      1849.38  95.7057     1258.64   95.7057      
1 1 1 10 28 18 o 0 707     27.8  ?      ?    3150.05 -94.6497     2352.14  -94.6497    481.872   -94.6497     
1 1 1 16 28 18 o 0 209.6   16.1  ?      ?    1996.71 -82.7752     823.903  -82.7752    266.894   97.2248      
1 1 1 18 28 18 o 0 920     42.3  ?      ?    3391.79 -38.387      2650.52  -38.387     790.895   -38.387      
1 1 1 18 20 28 o 0 1441.9  58.2  ?      ?    4808.85 178.389      3042.72  178.389     488.532   178.389      
1 1 1 18 22 28 o 0 608.1   36.4  ?      ?    2614.76 -48.8683     1996.53  -48.8683    662.854   -48.8683     
1 1 1 18 24 28 f 1 459     37.7  ?      ?    2880.94 -138.654     1296.6   -138.654    142.553   41.3462      
1 1 1 18 26 28 o 0 787.5   51.7  ?      ?    4065.68 11.997       1629.86  11.997      295.836   -168.003     
1 1 1 1  28 19 o 0 677.2   24.7  ?      ?    3130.6  157.8        2415.76  157.8       437.02    157.8        
1 1 1 7  28 19 o 0 992.8   35.8  ?      ?    2509    45.1719      3546.97  45.1719     2037.05   45.1719      
1 1 1 9  28 19 o 0 2906    96.7  ?      ?    6022.41 -110.129     5192.99  -110.129    1636.35   -110.129     
1 1 1 11 28 19 o 0 412.3   19.5  ?      ?    2450.69 -4.7885      1615.92  -4.7885     212.528   -4.7885      
1 1 1 13 28 19 o 0 215.8   16    ?      ?    1679.56 73.5712      984.542  73.5712     44.6037   73.5712      
1 1 1 15 28 19 o 0 1179.1  47.1  ?      ?    5144.34 -105.777     2354.09  -105.777    451.023   74.2226      
1 1 1 17 28 19 o 0 275.1   22.6  ?      ?    1982.12 156.007      1162.02  156.007     75.3426   156.007      
1 1 1 19 28 19 f 1 57.6    18.9  ?      ?    1376.24 -112.173     138.732  67.827      865.133   67.827       
1 1 1 19 21 28 o 0 744.3   36.7  ?      ?    3418.57 71.7653      2037     71.7653     285.631   71.7653      
1 1 1 19 23 28 o 0 1808.8  74.4  ?      ?    6121.34 -170.701     2765.67  -170.701    291.934   9.29887      
1 1 1 19 25 28 o 0 607.7   45.2  ?      ?    2710.3  14.9733      1749.59  14.9733     457.224   14.9733      
1 1 1 19 27 28 o 0 153.1   44.2  ?      ?    1676.4  -76.9647     316.222  -76.9647    443.057   103.035      
1 1 1 0  28 20 o 0 836.7   43.6  ?      ?    3909.61 6.26642e-16  2518.28  0           72.6869   -2.10838e-14 
1 1 1 6  28 20 f 1 255     14.2  ?      ?    2132.11 -142.897     1106.71  -142.897    174.052   37.1027      
1 1 1 12 28 20 o 0 184.4   15.2  ?      ?    1221.22 82.2075      880.605  82.2075     200.407   82.2075      
1 1 1 14 28 20 o 0 859     36.5  ?      ?    4054.02 -114.456     2139.87  -114.456    63.153    65.5436      
1 1 1 16 28 20 o 0 239.9   18.9  ?      ?    1803.97 127.91       1051.48  127.91      64.2334   127.91       
1 1 1 18 28 20 o 0 796.3   39.5  ?      ?    2546.35 -24.2303     2616.23  -24.2303    1279.51   -24.2303     
1 1 1 20 28 20 f 1 189.2   24.6  ?      ?    2199.09 -84.8114     550.252  -84.8114    569.011   95.1886      
1 1 1 20 22 28 o 0 435.2   32.2  ?      ?    2607.78 69.3083      1348.44  69.3083     40.4896   69.3083      
1 1 1 20 24 28 o 0 103.4   30.4  ?      ?    2471.37 111.59       124.166  -68.4103    1308.81   -68.4103     
1 1 1 20 26 28 o 0 1920.2  86.2  ?      ?    5266.71 174.198      3053.75  174.198     652.989   174.198      
1 1 1 5  28 21 o 0 369.4   17.4  ?      ?    2779.39 87.263       1314     87.263      314.678   -92.737      
1 1 1 7  28 21 o 0 517.2   22.4  ?      ?    2470.08 -107.884     2012.79  -107.884    590.016   -107.884     
1 1 1 9  28 21 o 0 170.7   13.8  ?      ?    987.441 122.147      792.824  122.147     234.683   122.147      
1 1 1 11 28 21 o 0 2044.4  70.1  ?      ?    3973.94 -19.4974     4694.87  -19.4974    2495.09   -19.4974     
1 1 1 13 28 21 o 0 417.7   22.2  ?      ?    1741.35 101.462      1824.6   101.462     882.982   101.462      
1 1 1 15 28 21 f 1 480     26.7  ?      ?    2326.01 -169.552     1807.45  -169.552    543.968   -169.552     
1 1 1 17 28 21 o 0 790.8   40.2  ?      ?    3980.05 -73.5371     1941     -73.5371    144.961   106.463      
1 1 1 19 28 21 o 0 297.4   26.9  ?      ?    2830.97 91.5806      819.705  91.5806     613.817   -88.4194     
1 1 1 21 28 21 o 0 470.1   33.4  ?      ?    2489.74 86.2166      1491.62  86.2166     257.931   86.2166      
1 1 1 21 23 28 o 0 432.5   36.2  ?      ?    3883.02 52.0829      758.334  52.0829     1109.94   -127.917     
1 1 1 21 25 28 f 1 546.8   47.4  ?      ?    2124.74 7.15637      1676.76  7.15637     697.981   7.15637      
1 1 1 21 27 28 o 0 168.6   54.5  ?      ?    1818.77 -34.8136     350.354  -34.8136    441.248   145.186      
1 1 1 0  28 22 f 1 36.8    19.5  ?      ?    1880.02 180          248.492  180         877.83    -8.98877e-15 
1 1 1 4  28 22 o 0 146.8   13    ?      ?    2108.15 -175.945     434.784  -175.945    787.346   4.05522      
1 1 1 8  28 22 o 0 408.6   20.7  ?      ?    2003.78 16.5261      1758.51  16.5261     635.716   16.5261      
1 1 1 10 28 22 o 0 2867.8  96.6  ?      ?    6471.03 138.636      4626.82  138.636     1072.1    138.636      
1 1 1 12 28 22 f 1 3666.3  123   ?      ?    5770.86 -60.6941     5926.06  -60.6941    2808.09   -60.6941     
1 1 1 14 28 22 o 0 452.3   26.8  ?      ?    1442.83 177.57       1974.12  177.57      1198.7    177.57       
1 1 1 16 28 22 o 0 221.6   22    ?      ?    1983.09 41.972       818.116  41.972      217.74    -138.028     
1 1 1 18 28 22 o 0 495.8   32.4  ?      ?    2363.9  79.577       1733.5   79.577      538.148   79.577       
1 1 1 20 28 22 o 0 1017.8  52.6  ?      ?    4237.98 -120.804     2160.39  -120.804    58.5296   -120.804     
1 1 1 22 28 22 o 0 1928.2  80.4  ?      ?    4780.22 -27.7975     3425.9   -27.7975    1152.79   -27.7975     
1 1 1 22 24 28 o 0 940.6   58    ?      ?    5222.33 14.865       1408.94  14.865      991.166   -165.135     
1 1 1 22 26 28 o 0 656.5   61.8  ?      ?    3887.75 -170.153     1256.78  -170.153    442.899   9.84688      
1 1 1 1  28 23 o 0 22.8    14.3  ?      ?    1088.64 -56.28       380.798  123.72      1012.15   123.72       
1 1 1 3  28 23 f 1 78.7    13.8  ?      ?    3031.82 -22.5037     534.376  157.496     2279.66   157.496      
1 1 1 5  28 23 o 0 678.7   26.6  ?      ?    3583.17 148.993      1950.18  148.993     70.5704   -31.0069     
1 1 1 7  28 23 o 0 47.1    13    ?      ?    846.849 130.526      80.6034  -49.474     550.259   -49.474      
1 1 1 9  28 23 o 0 315.5   19.9  ?      ?    2161.99 38.5409      1267.11  38.5409     90.3375   38.5409      
1 1 1 11 28 23 o 0 405.2   23.1  ?      ?    3090.28 -30.1408     1231.35  -30.1408    474.45    149.859      
1 1 1 13 28 23 f 1 1038.8  41.6  ?      ?    4087.86 157.137      2538.31  157.137     343.589   157.137      
1 1 1 15 28 23 o 0 642.5   33.1  ?      ?    946.202 -11.4804     2485.59  -11.4804    1993.84   -11.4804     
1 1 1 17 28 23 o 0 119.8   25.4  ?      ?    2388.43 142.894      70.1544  142.894     1133.73   -37.1058     
1 1 1 19 28 23 o 0 301.6   29.8  ?      ?    2155.71 -157.645     1004.55  -157.645    63.4391   22.3547      
1 1 1 21 28 23 o 0 218.2   31.3  ?      ?    2533.52 -179.447     486.756  -179.447    719.618   0.553328     
1 1 1 23 28 23 o 0 955.3   60.9  ?      ?    3769.85 -55.1584     2031.84  -55.1584    318.206   -55.1584     
1 1 1 23 25 28 f 1 263.1   52.5  ?      ?    3162.59 105.381      368.586  105.381     1025.8    -74.6185     
1 1 1 23 27 28 o 0 135.4   61.7  ?      ?    930.46  -140.759     161.527  -140.759    231.018   39.2412      
1 1 1 0  28 24 o 0 840.1   48.8  ?      ?    2102.25 -7.53257e-17 2324.11  0           1124.87   8.03065e-17  
1 1 1 2  28 24 o 0 16.5    13    ?      ?    1463.97 -119.807     578.485  60.1926     1404.2    60.1926      
1 1 1 4  28 24 o 0 1550.8  53.3  ?      ?    5328.6  172.645      3094.44  172.645     129.128   172.645      
1 1 1 6  28 24 f 1 1110.8  41    ?      ?    4591.09 22.3792      2487.96  22.3792     41.9537   -157.621     
1 1 1 8  28 24 o 0 129.9   16.3  ?      ?    1478.41 -52.5314     478.08   -52.5314    317.95    127.469      
1 1 1 10 28 24 o 0 619.6   28.2  ?      ?    3786.85 -22.068      1605.69  -22.068     444.742   157.932      
1 1 1 12 28 24 o 0 266.4   19.6  ?      ?    1826.28 178.347      1099.45  178.347     132.462   178.347      
1 1 1 14 28 24 o 0 26.1    17.2  ?      ?    1493.26 -111.538     469.48   68.4622     1240.34   68.4622      
1 1 1 16 28 24 o 0 1528.3  67.1  ?      ?    5236.03 -119.554     2828.85  -119.554    202.759   -119.554     
1 1 1 18 28 24 f 1 205.4   30.5  ?      ?    881.387 91.8695      660.694  91.8695     222.878   91.8695      
1 1 1 20 28 24 o 0 985.3   55.2  ?      ?    4402.13 33.8922      1932.47  33.8922     162.175   -146.108     
1 1 1 22 28 24 o 0 162.7   41.5  ?      ?    2359.68 -155.096     215.478  -155.096    859.114   24.9042      
1 1 1 24 28 24 o 0 402.4   54.7  ?      ?    2496.64 -148.065     1071.14  -148.065    12.7054   31.9345      
1 1 1 24 26 28 o 0 -93.2   65.3  ?      ?    1495.25 -83.3734     458.783  96.6266     1091.05   96.6266      
1 1 1 1  28 25 o 0 453.1   24.8  ?      ?    1327.93 -10.4155     2108.93  -10.4155    1372.62   -10.4155     
1 1 1 3  28 25 o 0 884.6   34.4  ?      ?    3484.61 131.303      2514.18  131.303     604.66    131.303      
1 1 1 5  28 25 o 0 318.9   19.4  ?      ?    1839.65 22.6717      1443.27  22.6717     413.722   22.6717      
1 1 1 7  28 25 o 0 497.6   26.8  ?      ?    1605.9  -94.2168     2136.89  -94.2168    1261.07   -94.2168     
1 1 1 9  28 25 o 0 784     36    ?      ?    3580.59 74.9777      2160.49  74.9777     243.459   74.9777      
1 1 1 11 28 25 o 0 104.7   18    ?      ?    1558.97 16.458       210.461  16.458      606.862   -163.542     
1 1 1 13 28 25 o 0 49.7    18.2  ?      ?    1254.46 -162.945     188.432  17.055      830.593   17.055       
1 1 1 15 28 25 o 0 1292.8  52.3  ?      ?    4419.2  141.91       2699.77  141.91      459.175   141.91       
1 1 1 17 28 25 f 1 358.6   31.9  ?      ?    3188.99 -108.898     812.406  -108.898    764.021   71.1018      
1 1 1 19 28 25 o 0 869.3   57.7  ?      ?    4078.9  -20.3734     1814.67  -20.3734    120.941   159.627      
1 1 1 21 28 25 f 1 503.1   49.7  ?      ?    1783.28 -56.8917     1625.44  -56.8917    809       -56.8917     
1 1 1 23 28 25 f 1 57.5    51.3  ?      ?    669.196 -175.001     63.1295  4.99945     355.972   4.99945      
1 1 1 25 28 25 o 0 158     57.3  ?      ?    623.815 35.3812      195.74   35.3812     65.8485   -144.619     
1 1 1 25 27 28 o 0 1548.1  105   ?      ?    5221.15 141.892      2154.4   141.892     101.696   141.892      
1 1 1 0  28 26 o 0 466.2   36.6  ?      ?    1981.46 -180         1685.62  180         580.572   180          
1 1 1 2  28 26 o 0 308     22    ?      ?    1903.41 -2.91378     1319.52  -2.91378    268.383   -2.91378     
1 1 1 4  28 26 o 0 646.4   29.2  ?      ?    1658.13 136.871      2614.28  136.871     1709.8    136.871      
1 1 1 6  28 26 o 0 719.7   32.2  ?      ?    4265.16 -119.289     1653.01  -119.289    639.698   60.7106      
1 1 1 8  28 26 o 0 374.7   24.6  ?      ?    3867.45 20.9418      694.137  20.9418     1349.66   -159.058     
1 1 1 10 28 26 o 0 763.7   37.8  ?      ?    2724.69 -126.701     2421.87  -126.701    1009.89   -126.701     
1 1 1 12 28 26 o 0 31.5    19    ?      ?    1284.72 -41.3822     345.068  138.618     996.092   138.618      
1 1 1 14 28 26 o 0 600     33.5  ?      ?    3340.8  90.2359      1557.39  90.2359     122.113   -89.7641     
1 1 1 16 28 26 o 0 -34.2   25.3  ?      ?    1443.61 5.90641      608.723  -174.094    1313.62   -174.094     
1 1 1 18 28 26 o 0 56      41.3  ?      ?    2426.56 176.501      467.276  -3.49908    1613.46   -3.49908     
1 1 1 20 28 26 o 0 -34.1   42.7  ?      ?    785.86  -67.8865     265.177  112.113     622.107   112.113      
1 1 1 22 28 26 o 0 622.7   58.1  ?      ?    3512.71 -5.44773     1314.94  -5.44773    213.855   174.552      
1 1 1 24 28 26 o 0 74.7    59.2  ?      ?    1204.26 95.4024      79.3692  -84.5976    585.838   -84.5976     
1 1 1 26 28 26 f 1 3125.6  153.7 ?      ?    5672.67 14.5147      3775.29  14.5147     1546.87   14.5147      
1 1 1 1  28 27 o 0 990     40.7  ?      ?    3714.86 -135.103     2652.05  -135.103    641.368   -135.103     
1 1 1 3  28 27 o 0 305.3   21.7  ?      ?    1853.75 34.4894      1283.2   34.4894     290.23    34.4894      
1 1 1 5  28 27 o 0 5.1     18.2  ?      ?    799.147 -157.716     325.443  22.2844     747.992   22.2844      
1 1 1 7  28 27 o 0 6.8     16.8  ?      ?    961.015 145.709      387.587  -34.2912    887.917   -34.2912     
1 1 1 9  28 27 o 0 1357    54.8  ?      ?    4160.04 -85.4466     3076.86  -85.4466    949.81    -85.4466     
1 1 1 11 28 27 o 0 2294.9  86    ?      ?    6572.58 123.912      3364.06  123.912     14.4148   123.912      
1 1 1 13 28 27 o 0 842.7   41.6  ?      ?    4575.4  -72.6846     1613.59  -72.6846    663.084   107.315      
1 1 1 15 28 27 o 0 640.3   42.2  ?      ?    2966.48 -166.877     1763.81  -166.877    327.575   -166.877     
1 1 1 17 28 27 o 0 877.1   56.8  ?      ?    3477.72 -68.3892     2066.73  -68.3892    434.749   -68.3892     
1 1 1 19 28 27 o 0 192     49    ?      ?    2861.24 125.431      191.299  125.431     1102.59   -54.5689     
1 1 1 21 28 27 o 0 580.7   59.2  ?      ?    2566.5  -12.309      1542.88  -12.309     428.089   -12.309      
1 1 1 23 28 27 o 0 231.8   66.2  ?      ?    1688.71 155.204      583.142  155.204     127.54    -24.7959     
1 1 1 25 28 27 o 0 427.8   80.4  ?      ?    3895.64 -85.8825     552.672  -85.8825    974.429   94.1175      
1 1 1 27 28 27 o 0 172.2   101.4 ?      ?    1611.67 93.2627      227.392  93.2627     377.525   -86.7373     
1 1 1 0  28 28 o 0 1736.1  94.9  ?      ?    3750.84 -8.30019e-15 3129.25  0           1144.68   1.43903e-14  
1 1 1 2  28 28 o 0 270.5   28.7  ?      ?    2591.39 124.763      830.01   124.763     529.813   -55.2374     
1 1 1 4  28 28 o 0 336.4   24    ?      ?    1890.05 106.161      1362.96  106.161     382.087   106.161      
1 1 1 6  28 28 o 0 590.1   32    ?      ?    2091.38 -107.026     2153.5   -107.026    1082.98   -107.026     
1 1 1 8  28 28 o 0 607.9   36    ?      ?    3537.34 -116.812     1521.31  -116.812    291.438   63.1879      
1 1 1 10 28 28 o 0 741.5   41.5  ?      ?    2933.01 -30.2729     2116.73  -30.2729    642.335   -30.2729     
1 1 1 12 28 28 o 0 895.3   44.3  ?      ?    4256.71 79.6147      1862.8   79.6147     229.844   -100.385     
1 1 1 14 28 28 o 0 1886.7  78.6  ?      ?    5270.77 112.58       3166.53  112.58      640.913   112.58       
1 1 1 16 28 28 o 0 1044.6  59.8  ?      ?    2987.13 -29.6386     2575.32  -29.6386    1187.4    -29.6386     
1 1 1 18 28 28 o 0 457.1   50    ?      ?    4378.41 106.576      559.031  106.576     1408.42   -73.4237     
1 1 1 20 28 28 o 0 225     54.9  ?      ?    2043.78 -96.8198     558.763  -96.8198    325.402   83.1802      
1 1 1 22 28 28 o 0 971.4   76.9  ?      ?    4808.1  -117.407     1447.75  -117.407    572.623   62.5925      
1 1 1 24 28 28 o 0 139.3   81.6  ?      ?    1505.83 39.1118      123.952  39.1118     467.046   -140.888     
1 1 1 26 28 28 o 0 2285.7  136.6 ?      ?    6310.52 140.675      2564.64  140.675     186.303   140.675      
1 1 1 28 28 28 o 0 -78.7   206.1 ?      ?    2008.36 161.425      454.215  -18.5751    1163.57   -18.5751     
1 1 1 0  1  29 o 0 227.6   13.8  ?      ?    652.432 -90          737.499  -90         380.039   -90          
1 1 1 0  3  29 o 0 331.9   17.2  ?      ?    2072.62 90           1372.96  90          232.019   90           
1 1 1 0  5  29 o 0 102     8     ?      ?    131.544 -90          79.4062  -90         6.9559    -90          
1 1 1 0  7  29 o 0 216.5   12.9  ?      ?    1769.46 90           1074.33  90          103.437   90           
1 1 1 0  9  29 o 0 182.6   11.3  ?      ?    1093.53 90           830.938  90          235.768   90           
1 1 1 0  11 29 o 0 389.9   19.4  ?      ?    2768.12 90           1839.04  90          34.9706   -90          
1 1 1 0  13 29 o 0 612.5   29.2  ?      ?    3177.95 -90          2266.44  -90         150.823   -90          
1 1 1 0  15 29 f 1 490.3   24.7  ?      ?    283.9   90           884.893  90          701.075   90           
1 1 1 0  17 29 o 0 -0.7    9     ?      ?    472.731 -90          8.89768  -90         287.829   90           
1 1 1 0  19 29 o 0 442.1   26.1  ?      ?    2624.63 90           1782.95  90          183.625   90           
1 1 1 0  21 29 o 0 61.3    14    ?      ?    470.92  90           149.486  90          125.124   -90          
1 1 1 0  23 29 o 0 20.2    15.1  ?      ?    1434.89 90           99.5943  90          705.97    -90          
1 1 1 0  25 29 o 0 138     28.4  ?      ?    587.269 -90          341.204  -90         16.9533   -90          
1 1 1 0  27 29 o 0 216     35.9  ?      ?    2757.97 90           1068.89  90          385.274   -90          
1 1 1 0  29 1  o 0 9       4.8   ?      ?    215.64  90           8.56966  90          112.034   -90          
1 1 1 1  2  29 o 0 644.5   20.7  ?      ?    2210.25 160.186      2390.22  160.186     1182.12   160.186      
1 1 1 1  22 29 o 0 468.9   20.3  ?      ?    2557.35 -156.975     1777.15  -156.975    319.826   -156.975     
1 1 1 1  24 29 o 0 466.4   25.3  ?      ?    3883.45 -18.9819     1054.02  -18.9819    1073.05   161.018      
1 1 1 1  26 29 o 0 2374.4  84.7  ?      ?    7003.94 57.1326      3584.05  57.1326     182.665   -122.867     
1 1 1 1  28 29 o 0 601.4   35.2  ?      ?    3573.29 -42.7271     1564.65  -42.7271    267.56    137.273      
1 1 1 2  11 29 o 0 786.6   26.2  ?      ?    3875.09 114.171      2418.22  114.171     173.255   -65.8292     
1 1 1 2  13 29 o 0 583.8   19.5  ?      ?    3318.73 -3.05827     2016.24  -3.05827    166.568   176.942      
1 1 1 2  17 29 o 0 763.9   26.9  ?      ?    2945.73 -135.461     2754.02  -135.461    925.727   -135.461     
1 1 1 2  23 29 o 0 76.5    13.9  ?      ?    2071.81 113.512      114.494  -66.4881    1266.85   -66.4881     
1 1 1 2  25 29 o 0 -16.2   20    ?      ?    1174.79 -69.9683     546.431  110.032     1189.52   110.032      
1 1 1 2  27 29 o 0 458.2   30.3  ?      ?    2902.96 -115.993     1437.72  -115.993    80.9397   64.0067      
1 1 1 0  29 3  o 0 139.7   9.1   ?      ?    2238.96 90           885.78   90          372.632   -90          
1 1 1 3  16 29 o 0 599.5   21.4  ?      ?    2448.8  34.0486      2493.4   34.0486     963.119   34.0486      
1 1 1 3  20 29 o 0 443.3   18.2  ?      ?    3449.98 145.727      1266.47  145.727     747.822   -34.2727     
1 1 1 3  22 29 o 0 293.7   15.7  ?      ?    1634.17 51.5057      1404.45  51.5057     483.14    51.5057      
1 1 1 3  24 29 o 0 1694.5  60.9  ?      ?    4946.8  -97.6497     3609.21  -97.6497    831.475   -97.6497     
1 1 1 3  26 29 f 1 192.9   23    ?      ?    3678.32 -104.031     52.1292  75.9687     2022.54   75.9687      
1 1 1 3  28 29 f 1 242.1   25.3  ?      ?    800.385 32.5785      823.281  32.5785     406.992   32.5785      
1 1 1 4  13 29 o 0 517     17.6  ?      ?    3104.1  152.987      1863.38  152.987     152.706   -27.0131     
1 1 1 4  15 29 o 0 660.2   23.2  ?      ?    1861.82 6.38461      3007.82  6.38461     1837.91   6.38461      
1 1 1 4  21 29 o 0 195.2   14.1  ?      ?    497.305 31.4796      666.375  31.4796     382.668   31.4796      
1 1 1 4  23 29 f 1 414.9   19.3  ?      ?    2800.15 146.044      1395.93  146.044     152.38    -33.9564     
1 1 1 4  25 29 o 0 82.9    14.9  ?      ?    630.822 -3.84945     104.426  -3.84945    237.08    176.151      
1 1 1 4  27 29 o 0 17.3    18.1  ?      ?    768.112 -138.481     267.627  41.519      665.197   41.519       
1 1 1 0  29 5  o 0 204     11.8  ?      ?    2171.13 90           1088.77  90          132.416   -90          
1 1 1 2  29 5  o 0 898.7   27.7  ?      ?    4226.59 -66.4931     2111.33  -66.493     226.213   113.507      
1 1 1 4  29 5  o 0 1642    50.2  ?      ?    5684.44 82.2857      2886.63  82.2857     206.518   -97.7143     
1 1 1 5  6  29 o 0 669.2   21.6  ?      ?    2714.07 -138.22      2180.8   -138.22     730.303   -138.22      
1 1 1 5  16 29 o 0 607.2   24    ?      ?    3328.04 -165.037     2008.84  -165.037    44.0895   14.9628      
1 1 1 5  18 29 o 0 310.1   14.9  ?      ?    2570.84 -30.6456     1180.96  -30.6456    362.877   149.354      
1 1 1 5  20 29 o 0 219.6   13.9  ?      ?    1859.92 -132.708     976.385  -132.708    95.6795   47.2921      
1 1 1 5  22 29 f 1 144.4   17.2  ?      ?    1139.45 66.4376      627.994  66.4376     9.89236   -113.562     
1 1 1 5  24 29 o 0 641     31.8  ?      ?    3859.08 54.9573      1661.27  54.9573     478.884   -125.043     
1 1 1 5  26 29 f 1 746.3   34    ?      ?    4215.13 -140.558     1704.29  -140.558    526.377   39.4423      
1 1 1 5  28 29 f 1 1096.3  47.6  ?      ?    4801.44 69.9068      2119.15  69.9068     348.674   -110.093     
1 1 1 5  29 6  o 0 1200.2  37.5  ?      ?    4454.7  15.1206      2630.58  15.1206     230.109   15.1206      
1 1 1 6  17 29 o 0 698.2   27.3  ?      ?    2770.1  -159.023     2571.98  -159.023    896.731   -159.023     
1 1 1 6  21 29 o 0 201.7   15.3  ?      ?    2306.03 44.5942      677.716  44.5942     620.039   -135.406     
1 1 1 6  23 29 o 0 241.5   20.8  ?      ?    1841.36 -114.92      1037.01  -114.92     38.2413   -114.92      
1 1 1 6  25 29 o 0 6.9     22.4  ?      ?    996.601 63.4611      382.2    -116.539    914.493   -116.539     
1 1 1 6  27 29 o 0 116     18.4  ?      ?    1319.61 -42.9471     317.171  -42.9471    356.787   137.053      
1 1 1 0  29 7  o 0 206     11.1  ?      ?    2931.5  90           1104.36  90          538.583   -90          
1 1 1 7  12 29 o 0 765.6   26.3  ?      ?    2830.42 -113.437     2887.31  -113.437    1090.26   -113.437     
1 1 1 7  20 29 o 0 234.3   15.3  ?      ?    1069.65 68.622       1177.19  68.622      569.47    68.622       
1 1 1 7  22 29 f 1 302     21.3  ?      ?    700.645 -78.3706     1307.97  -78.3706    921.408   -78.3706     
1 1 1 7  24 29 o 0 16.3    19.9  ?      ?    429.284 138.458      154.008  -41.5421    386.358   -41.5421     
1 1 1 7  26 29 o 0 1049.6  47.4  ?      ?    3468.24 60.7207      2792.51  60.7207     994.033   60.7207      
1 1 1 7  28 29 o 0 1145.7  49.2  ?      ?    5609.63 -95.1041     1818.16  -95.1041    1007.06   84.8959      
1 1 1 5  29 8  o 0 497.9   18.2  ?      ?    2649.5  50.5813      2127.76  50.5813     341.411   50.5813      
1 1 1 8  17 29 o 0 247.6   15.1  ?      ?    3135.48 107.001      563.909  107.001     1304.77   -72.9992     
1 1 1 8  19 29 f 1 1292.8  49.9  ?      ?    3879.77 -57.8307     3400.36  -57.8307    1165.13   -57.8307     
1 1 1 8  21 29 o 0 353.2   21.7  ?      ?    2503.07 150.519      1303.71  150.519     83.4008   -29.4806     
1 1 1 8  23 29 o 0 649     32.3  ?      ?    2373.73 -17.7776     2403.1   -17.7776    1090.4    -17.7776     
1 1 1 8  25 29 o 0 436     29.5  ?      ?    2999.82 -126.798     1322.49  -126.798    254.479   53.2023      
1 1 1 8  27 29 o 0 100.8   30.3  ?      ?    1325.9  146.414      139.718  146.414     538.496   -33.5859     
1 1 1 0  29 9  o 0 60.5    7.7   ?      ?    850.721 90           281.362  90          191.594   -90          
1 1 1 9  12 29 o 0 735.5   26.4  ?      ?    3054.92 -36.1976     2627.55  -36.1976    714.004   -36.1976     
1 1 1 9  18 29 o 0 402.2   19.5  ?      ?    1987.23 170.774      1790.27  170.774     643.619   170.774      
1 1 1 9  20 29 o 0 174.5   15.5  ?      ?    2483.21 10.3997      437.111  10.3997     951.164   -169.6       
1 1 1 9  22 29 o 0 1079.3  45.4  ?      ?    3037.76 -103.486     3162.55  -103.486    1523.37   -103.486     
1 1 1 9  24 29 o 0 394.8   27.6  ?      ?    3085.16 117.629      1146.52  117.629     495.231   -62.3712     
1 1 1 9  26 29 o 0 422.3   32.9  ?      ?    3493.66 -127.492     1013.48  -127.492    767.123   52.5082      
1 1 1 9  28 29 o 0 462.2   34.6  ?      ?    2186.16 94.2465      1572.97  94.2465     491.092   94.2465      
1 1 1 10 11 29 o 0 831.4   29.1  ?      ?    3397.58 120.696      2736.21  120.696     604.168   120.696      
1 1 1 10 17 29 o 0 190.3   13.7  ?      ?    1930.17 76.8501      818.604  76.8501     313.416   -103.15      
1 1 1 10 19 29 o 0 369     20.3  ?      ?    2607.74 -50.8639     1341.96  -50.8639    127.15    129.136      
1 1 1 10 21 29 o 0 162.6   18.5  ?      ?    2548.27 65.2294      325.671  65.2294     1062.14   -114.771     
1 1 1 10 23 29 o 0 128.7   22.3  ?      ?    1694.44 -130.866     360.937  -130.866    550.596   49.1338      
1 1 1 10 25 29 o 0 39.8    25    ?      ?    2274.13 99.4516      596.556  -80.5484    1770.2    -80.5484     
1 1 1 10 27 29 o 0 324.2   39.3  ?      ?    1853.34 -141.447     1195.15  -141.447    264.85    -141.447     
1 1 1 0  29 11 o 0 11.1    7     ?      ?    325.573 -90          18.6502  -90         206.46    90           
1 1 1 4  29 11 o 0 959.2   30.6  ?      ?    3578.21 -5.40167     3138.78  -5.40167    747.629   -5.40167     
1 1 1 10 29 11 o 0 447.5   17.3  ?      ?    2839.16 -21.1707     1705.2   -21.1707    71.4334   158.829      
1 1 1 11 14 29 o 0 345     15.7  ?      ?    2106.16 63.7847      1579.58  63.7847     306.652   63.7847      
1 1 1 11 16 29 o 0 473.5   21.7  ?      ?    2369.82 -94.0987     1941.26  -94.0987    544.202   -94.0987     
1 1 1 11 18 29 o 0 158     14.4  ?      ?    1142.8  -71.5442     729.647  -71.5442    81.5745   -71.5442     
1 1 1 11 20 29 o 0 402.4   24.4  ?      ?    2807.35 96.3403      1348.06  96.3403     193.23    -83.6597     
1 1 1 11 22 29 o 0 502.4   30.6  ?      ?    3730.88 46.9777      1253.19  46.9777     773.181   -133.022     
1 1 1 11 24 29 o 0 1241.2  53.8  ?      ?    3947.86 -110.062     3002.48  -110.062    942.211   -110.062     
1 1 1 11 26 29 o 0 598     40.4  ?      ?    3005.2  80.4736      1713.79  80.4736     185.939   80.4736      
1 1 1 11 28 29 f 1 179.8   40.9  ?      ?    2093.02 -60.9429     443.418  -60.9429    576.992   119.057      
1 1 1 11 29 12 o 0 447.1   18.9  ?      ?    2936.51 -127.792     1618.97  -127.792    184.947   52.2076      
1 1 1 12 15 29 o 0 319.2   17.1  ?      ?    2676.68 -95.8729     1152.24  -95.8729    432.372   84.1271      
1 1 1 12 19 29 o 0 147.4   16.8  ?      ?    2442.47 -68.8968     280.74   -68.8968    1069.57   111.103      
1 1 1 12 21 29 o 0 -5      3.4   ?      ?    1187.68 -159.517     641.595  20.483      1298.41   20.483       
1 1 1 12 23 29 o 0 360.9   29.4  ?      ?    2520.88 32.3446      1248.91  32.3446     79.6851   -147.655     
1 1 1 12 25 29 o 0 18.4    30.9  ?      ?    1445.32 176.42       421.06   -3.57971    1151.3    -3.57971     
1 1 1 12 27 29 o 0 808.7   50.4  ?      ?    4271.45 122.85       1648.12  122.85      449.558   -57.15       
1 1 1 0  29 13 o 0 242.8   14.6  ?      ?    2077.31 90           1438.83  90          27.0612   90           
1 1 1 4  29 13 o 0 378.6   16.1  ?      ?    1730.01 -60.9958     2031.05  -60.9958    894.111   -60.9958     
1 1 1 10 29 13 o 0 379.2   15.7  ?      ?    2149.7  -36.7571     1741.01  -36.7571    419.516   -36.7571     
1 1 1 13 14 29 o 0 1688.8  63.6  ?      ?    4925.9  178.248      3749.37  178.248     823.693   178.248      
1 1 1 13 18 29 o 0 126.9   15.2  ?      ?    1418.87 -18.6169     482.776  -18.6169    306.249   161.383      
1 1 1 13 20 29 o 0 2376.6  95.2  ?      ?    5485.12 -118.568     4316.49  -118.568    1366.37   -118.568     
1 1 1 13 22 29 o 0 822.4   42.8  ?      ?    4288.58 -3.91378     1900.38  -3.91378    379.366   176.086      
1 1 1 13 24 29 o 0 62.5    26.5  ?      ?    464.151 101.69       8.04315  -78.3105    244.916   -78.3105     
1 1 1 13 26 29 o 0 1438.1  65.8  ?      ?    3698.76 157.51       3243.17  157.51      1405.73   157.51       
1 1 1 13 28 29 o 0 3896.9  145.2 ?      ?    6958.23 16.9685      4859.59  16.9685     1565.84   16.9685      
1 1 1 1  29 14 o 0 490.1   18    ?      ?    2332.64 13.9186      2261.08  13.9186     723.775   13.9186      
1 1 1 7  29 14 o 0 1451.9  49.5  ?      ?    3614.57 101.487      4214.29  101.487     1951.38   101.487      
1 1 1 9  29 14 o 0 398     16.7  ?      ?    2165.21 -136.669     1814.48  -136.669    484.053   -136.669     
1 1 1 11 29 14 o 0 318.4   15.9  ?      ?    1891.83 -161.688     1545.04  -161.688    405.882   -161.688     
1 1 1 14 15 29 o 0 1025.4  40.8  ?      ?    4300.79 115.725      2563.88  115.725     91.4819   115.725      
1 1 1 14 17 29 o 0 744.5   32.5  ?      ?    3060.92 151.719      2386.77  151.719     676.453   151.719      
1 1 1 14 19 29 o 0 136.2   18.1  ?      ?    134.667 -23.6807     114.133  -23.6807    41.2632   -23.6807     
1 1 1 14 21 29 f 1 1310.5  54.5  ?      ?    4516.4  -28.4165     2933.19  -28.4165    500.902   -28.4165     
1 1 1 14 23 29 o 0 2180    85.2  ?      ?    3868.31 -114.745     4672.55  -114.745    2681.1    -114.745     
1 1 1 14 25 29 f 1 2946.9  115.8 ?      ?    5766.61 42.0031      4573.87  42.0031     1663.68   42.0031      
1 1 1 14 27 29 o 0 204.6   30.9  ?      ?    1028.11 100.974      675.591  100.974     183.266   100.974      
1 1 1 0  29 15 f 1 -5.5    9.8   ?      ?    1236.2  90           19.9625  90          796.511   -90          
1 1 1 2  29 15 o 0 537.7   19.6  ?      ?    3108.13 -128.22      1973.56  -128.22     35.4248   51.7798      
1 1 1 12 29 15 o 0 744.1   30.9  ?      ?    2727.74 152.118      2664.94  152.118     1058.95   152.118      
1 1 1 14 29 15 o 0 517.6   23.7  ?      ?    4186.14 65.8283      1117.31  65.8283     1264.24   -114.172     
1 1 1 15 16 29 o 0 422.5   24    ?      ?    3355.55 -60.8415     1183.75  -60.8415    698.112   119.158      
1 1 1 15 18 29 o 0 1868.2  72.2  ?      ?    5508.03 154.208      3512.56  154.208     517.417   154.208      
1 1 1 15 20 29 o 0 364.7   23.6  ?      ?    2772.77 -96.9787     1185     -96.9787    309.073   83.0213      
1 1 1 15 22 29 o 0 75.9    19.9  ?      ?    1538.27 -14.303      13.8212  165.697     811.669   165.697      
1 1 1 15 24 29 o 0 486.9   35.5  ?      ?    3275.55 -100.105     1251.09  -100.105    407.168   79.8947      
1 1 1 15 26 29 o 0 3359.3  131.9 ?      ?    7592.16 34.1303      4064.54  34.1303     391.85    34.1303      
1 1 1 15 28 29 o 0 74.9    34    ?      ?    1605.8  -28.4333     156.057  151.567     894.493   151.567      
1 1 1 13 29 16 o 0 197.4   14.3  ?      ?    983.847 -142.523     956.47   -142.523    396.869   -142.523     
1 1 1 15 29 16 o 0 146.4   15.2  ?      ?    1192.05 18.961       638.142  18.961      22.478    -161.039     
1 1 1 16 17 29 o 0 234.3   17.2  ?      ?    2785.1  -124.641     617.372  -124.641    902.778   55.3593      
1 1 1 16 19 29 o 0 2008.6  85.8  ?      ?    4501.69 8.09084      4305.31  8.09084     1867.59   8.09084      
1 1 1 16 21 29 o 0 2586.5  104.2 ?      ?    7314.15 -152.539     3628.6   -152.539    188.542   27.4613      
1 1 1 16 23 29 f 1 1814.1  74.1  ?      ?    5159.89 4.85121      3347.14  4.85121     746.659   4.85121      
1 1 1 16 25 29 o 0 866.6   49.6  ?      ?    3577.29 158.936      2083.34  158.936     337.615   158.936      
1 1 1 16 27 29 f 1 775.5   51.7  ?      ?    4398.35 -101.279     1404.38  -101.279    650.29    78.7209      
1 1 1 0  29 17 o 0 57.4    12.4  ?      ?    889.866 90           306.125  90          262.948   -90          
1 1 1 2  29 17 o 0 356.9   15.4  ?      ?    1725.13 -39.3641     1873.31  -39.3641    786.612   -39.3641     
1 1 1 10 29 17 o 0 255.6   14.4  ?      ?    2788.77 7.04577      776.717  7.04577     858.617   -172.954     
1 1 1 14 29 17 o 0 661.5   29.3  ?      ?    3472.15 -167.276     1918.23  -167.276    5.37764   12.7243      
1 1 1 16 29 17 o 0 1670.4  64.4  ?      ?    4857.68 32.2432      3461.28  32.2432     844.477   32.2432      
1 1 1 17 18 29 o 0 994.1   41.9  ?      ?    3679.46 -156.013     2690.19  -156.013    690.331   -156.013     
1 1 1 17 20 29 o 0 560.6   36.7  ?      ?    2361.89 4.97936      2008.48  4.97936     769.782   4.97936      
1 1 1 17 22 29 o 0 398.7   32.1  ?      ?    3149.6  -159.518     1071.87  -159.518    516.245   20.4816      
1 1 1 17 24 29 o 0 266.3   32.4  ?      ?    2361.23 -78.012      780.463  -78.012     380.345   101.988      
1 1 1 17 26 29 o 0 463.6   44.6  ?      ?    2748.26 -158.879     1295.17  -158.879    5.52343   -158.879     
1 1 1 17 28 29 o 0 727.5   55.8  ?      ?    2168.14 124.024      2073.71  124.024     1107.5    124.024      
1 1 1 1  29 18 o 0 583.3   22.2  ?      ?    2901.62 92.0144      2192.83  92.0144     377.999   92.0144      
1 1 1 7  29 18 o 0 421.1   17.7  ?      ?    2009.78 41.7927      1924.52  41.7927     727.991   41.7927      
1 1 1 9  29 18 o 0 560.4   22.9  ?      ?    3957    -159.121     1410.32  -159.121    877.483   20.8786      
1 1 1 11 29 18 o 0 203.2   14.4  ?      ?    1837.46 114.833      874.441  114.833     165.795   -65.1674     
1 1 1 13 29 18 o 0 95.2    14.2  ?      ?    1849.76 22.8158      126.554  22.8158     896.347   -157.184     
1 1 1 15 29 18 o 0 114.8   16.1  ?      ?    622.737 -154.468     329.304  -154.468    6.05011   25.5317      
1 1 1 17 29 18 o 0 234.4   20.4  ?      ?    1958.64 97.7603      914.081  97.7603     135.582   -82.2397     
1 1 1 18 19 29 f 1 374.1   29.1  ?      ?    4995.01 132.247      119.523  132.247     2524.33   -47.7527     
1 1 1 18 21 29 o 0 115     21.7  ?      ?    1043.79 178.294      312.414  178.294     216.408   -1.70582     
1 1 1 18 23 29 o 0 1095    55.3  ?      ?    5652.84 -174.805     1658.45  -174.805    1137.22   5.1951       
1 1 1 18 25 29 o 0 264.5   44.9  ?      ?    2289.74 -3.9699      762.947  -3.9699     319.315   176.03       
1 1 1 18 27 29 o 0 1889.5  92.6  ?      ?    6156    78.4073      2583.05  78.4073     183.668   -101.593     
1 1 1 0  29 19 o 0 169.5   18.4  ?      ?    229.388 -90          248.205  -90         106.038   -90          
1 1 1 6  29 19 o 0 206.3   13.3  ?      ?    763.269 -105.267     1050.54  -105.267    598.927   -105.267     
1 1 1 8  29 19 f 1 586.9   23    ?      ?    1930.66 30.1348      2482.41  30.1348     1365.87   30.1348      
1 1 1 10 29 19 o 0 1597.8  57.8  ?      ?    5606.95 149.996      3067.45  149.996     92.7193   -30.0036     
1 1 1 12 29 19 o 0 489.9   23.5  ?      ?    2743.85 8.99109      1707     8.99109     194.712   8.99109      
1 1 1 14 29 19 o 0 547.6   27.4  ?      ?    3597.02 -80.5249     1449.51  -80.5249    483.784   99.4751      
1 1 1 16 29 19 o 0 9.8     15.1  ?      ?    1582.83 120.668      659.484  -59.332     1507.53   -59.332      
1 1 1 18 29 19 f 1 1285.4  56.8  ?      ?    3007.16 -92.3286     3503.23  -92.3286    1934.83   -92.3286     
1 1 1 19 20 29 o 0 4209    156.4 ?      ?    7071.94 73.3566      5671.93  73.3566     2076.97   73.3566      
1 1 1 19 22 29 o 0 139     27.2  ?      ?    1674.81 -66.2393     331.773  -66.2393    500.294   113.761      
1 1 1 19 24 29 o 0 84.6    34.1  ?      ?    652.443 -71.3227     43.1968  -71.3227    266.964   108.677      
1 1 1 19 26 29 f 1 1011.1  63.5  ?      ?    4728.44 -0.968186    1727.28  -0.968186   424.834   179.032      
1 1 1 19 28 29 o 0 39.4    51.2  ?      ?    713.435 170.221      122.267  -9.77929    433.297   -9.77929     
1 1 1 1  29 20 o 0 367.5   17.1  ?      ?    2055.64 -120.288     1705.85  -120.288    462.008   -120.288     
1 1 1 3  29 20 o 0 210     13.5  ?      ?    1660.86 -93.444      1010.96  -93.444     30.2758   -93.444      
1 1 1 9  29 20 o 0 735.4   28.7  ?      ?    2877.47 76.9634      2458.21  76.9634     845.926   76.9634      
1 1 1 11 29 20 o 0 2005.8  71.7  ?      ?    5864.37 -85.2527     3595.92  -85.2527    379.215   -85.2527     
1 1 1 13 29 20 o 0 525.2   25.9  ?      ?    3080.82 -54.0677     1620.65  -54.0677    29.3994   125.932      
1 1 1 15 29 20 o 0 1657.5  64.6  ?      ?    6076.57 131.628      2829.86  131.628     419.484   -48.372      
1 1 1 17 29 20 o 0 182.8   22.2  ?      ?    3045.51 -3.45567     191.78   -3.45567    1387.54   176.544      
1 1 1 19 29 20 o 0 107.5   25    ?      ?    2559.54 153.339      78.4035  -26.6611    1360.08   -26.6611     
1 1 1 20 21 29 o 0 1233    55.8  ?      ?    3344.73 -69.8248     3020.78  -69.8248    1353.96   -69.8248     
1 1 1 20 23 29 o 0 604.8   41.5  ?      ?    3295.63 -141.508     1509.83  -141.508    63.5607   38.4921      
1 1 1 20 25 29 o 0 1616.6  76.4  ?      ?    5274.5  -79.959      2586.25  -79.959     186       -79.959      
1 1 1 20 27 29 o 0 20.5    51.9  ?      ?    1060.82 -170.312     218.959  9.6883      678.166   9.6883       
1 1 1 0  29 21 o 0 -21.2   18.3  ?      ?    1517.19 -90          27.1606  -90         870.676   90           
1 1 1 2  29 21 o 0 240.1   14.9  ?      ?    2419.79 39.4927      866.938  39.4927     546.732   -140.507     
1 1 1 6  29 21 o 0 239.2   15.4  ?      ?    1704.94 -135.841     1116.41  -135.841    150.778   -135.841     
1 1 1 8  29 21 o 0 159.4   15.1  ?      ?    1915.54 44.7229      570.942  44.7229     494.46    -135.277     
1 1 1 10 29 21 o 0 1188    43.5  ?      ?    3628.74 57.5139      3153.29  57.5139     1175.36   57.5139      
1 1 1 12 29 21 o 0 1771    65    ?      ?    4715.39 -172.234     3810.84  -172.234    1208.48   -172.234     
1 1 1 14 29 21 f 1 712.1   34.8  ?      ?    2585.53 -41.9291     2400.3   -41.9291    1014.93   -41.9291     
1 1 1 16 29 21 o 0 180.8   22.3  ?      ?    1176.33 62.9437      719.334  62.9437     110.464   62.9437      
1 1 1 18 29 21 o 0 234.3   27.9  ?      ?    2616.96 14.9007      618.281  14.9007     692.323   -165.099     
1 1 1 20 29 21 o 0 167.6   30.6  ?      ?    1812.63 141.047      463.103  141.047     426.754   -38.9528     
1 1 1 21 22 29 o 0 288     36.2  ?      ?    3153.74 -165.254     547.039  -165.254    962.712   14.7458      
1 1 1 21 24 29 o 0 88.2    39.8  ?      ?    1719.85 123.474      94.2802  -56.5259    879.994   -56.5259     
1 1 1 21 26 29 o 0 133.2   47.9  ?      ?    1773.84 14.6714      154.855  14.6714     616.943   -165.329     
1 1 1 21 28 29 o 0 91.6    63.6  ?      ?    1900.1  135.363      119.692  -44.637     915.194   -44.637      
1 1 1 1  29 22 o 0 825.1   33    ?      ?    3630.16 122.591      2402.23  122.591     308.378   122.591      
1 1 1 3  29 22 o 0 480.4   21.9  ?      ?    3407.97 -74.5895     1395.45  -74.5895    544.416   105.41       
1 1 1 5  29 22 f 1 293.7   16.9  ?      ?    1421.54 53.9127      1445.8   53.9127     644.286   53.9127      
1 1 1 7  29 22 f 1 277.3   17.3  ?      ?    3492.72 -76.9698     479.938  -76.9698    1456.16   103.03       
1 1 1 9  29 22 o 0 722.3   30    ?      ?    1745.62 -7.31586     2811.17  -7.31586    1867.12   -7.31586     
1 1 1 11 29 22 o 0 0       14    ?      ?    667.449 -160.269     306.21   19.7308     668.615   19.7308      
1 1 1 13 29 22 o 0 215.5   20    ?      ?    2879.31 119.343      447.781  119.343     1078.34   -60.6565     
1 1 1 15 29 22 o 0 312.4   25.6  ?      ?    2109.26 -59.3833     1182.88  -59.3833    95.0668   -59.3833     
1 1 1 17 29 22 o 0 101.7   24.7  ?      ?    1411.87 -73.5776     200.634  -73.5776    505.223   106.422      
1 1 1 19 29 22 o 0 1538.8  69.7  ?      ?    5419.33 -30.1052     2596.95  -30.1052    64.6549   149.895      
1 1 1 21 29 22 o 0 1437.6  67.1  ?      ?    4875.38 42.6624      2567.3   42.6624     267.152   42.6624      
1 1 1 22 23 29 o 0 1817.3  82.2  ?      ?    5405.18 178.435      2855.81  178.435     380.744   178.435      
1 1 1 22 25 29 o 0 234.7   48.8  ?      ?    2878.14 -44.6901     361.769  -44.6901    894.907   135.31       
1 1 1 22 27 29 o 0 709.7   73.9  ?      ?    3557.48 -95.5588     1397.43  -95.5588    99.0034   84.4412      
1 1 1 0  29 23 o 0 154.1   24.5  ?      ?    2837.35 90           964.952  90          647.066   -90          
1 1 1 2  29 23 o 0 377     19.5  ?      ?    2337.34 115.648      1496.05  115.648     183.352   115.648      
1 1 1 4  29 23 f 1 740.7   29.5  ?      ?    5218.71 -137.296     1228.31  -137.296    1679.09   42.7041      
1 1 1 6  29 23 o 0 190.2   16.9  ?      ?    1137.21 9.00546      895.625  9.00546     275.467   9.00546      
1 1 1 8  29 23 o 0 9.7     15.7  ?      ?    563.122 64.5159      227.661  -115.484    540.081   -115.484     
1 1 1 10 29 23 o 0 875.7   36.4  ?      ?    4948.42 -102.309     1733.52  -102.309    931.279   77.6915      
1 1 1 12 29 23 o 0 299     22    ?      ?    1779    74.0709      1254.28  74.0709     317.816   74.0709      
1 1 1 14 29 23 o 0 240.6   23.5  ?      ?    1017.06 -23.6233     995.835  -23.6233    474.088   -23.6233     
1 1 1 16 29 23 f 1 1606.9  67.3  ?      ?    4408.66 -172.899     3329.18  -172.899    1120.5    -172.899     
1 1 1 18 29 23 o 0 54.9    27.9  ?      ?    1471.59 150.42       236.3    -29.5798    957.949   -29.5798     
1 1 1 20 29 23 o 0 121.7   34.6  ?      ?    1389.67 92.626       249.957  92.626      406.185   -87.374      
1 1 1 22 29 23 o 0 491.3   43.5  ?      ?    1578.68 -126.508     1612.97  -126.508    899.956   -126.508     
1 1 1 23 24 29 o 0 121.9   53.2  ?      ?    2329.03 155.895      40.5903  -24.1052    1059.38   -24.1052     
1 1 1 23 26 29 o 0 59.9    59.4  ?      ?    768.43  108.615      69.3164  -71.3853    393.538   -71.3853     
1 1 1 23 28 29 o 0 123.5   78.4  ?      ?    530.685 177.637      62.5669  177.637     145.495   -2.3635      
1 1 1 1  29 24 o 0 1425.7  52.2  ?      ?    5149.62 -31.032      2917.25  -31.032     70.1896   -31.032      
1 1 1 3  29 24 o 0 327     20.9  ?      ?    2408.18 75.2551      1260.97  75.2551     101.424   -104.745     
1 1 1 5  29 24 o 0 1044.5  39.8  ?      ?    4057.67 114.52       2668.23  114.52      405.21    114.52       
1 1 1 7  29 24 o 0 110.5   17.2  ?      ?    1212.29 -124.2       305.218  -124.2      353.447   55.8004      
1 1 1 9  29 24 o 0 15.7    16.5  ?      ?    445.746 143.04       166.051  -36.9603    403.722   -36.9603     
1 1 1 11 29 24 o 0 880.4   37.5  ?      ?    4133.89 -52.0962     2090.56  -52.0962    67.0124   127.904      
1 1 1 13 29 24 o 0 473.2   27.9  ?      ?    3801.9  6.92381      1047.68  6.92381     889.013   -173.076     
1 1 1 15 29 24 o 0 602.8   35.1  ?      ?    3404.86 -152.903     1541.71  -152.903    175.422   27.0973      
1 1 1 17 29 24 o 0 928.3   50.7  ?      ?    4799.09 84.8273      1677.52  84.8273     667.88    -95.1727     
1 1 1 19 29 24 o 0 463.7   48.1  ?      ?    2240.82 -77.9372     1482.54  -77.9372    425.83    -77.9372     
1 1 1 21 29 24 o 0 568.9   48.3  ?      ?    3237.99 155.11       1336.27  155.11      127.909   -24.8897     
1 1 1 23 29 24 o 0 570.3   56.5  ?      ?    2406.96 25.6997      1560.41  25.6997     520.629   25.6997      
1 1 1 24 25 29 o 0 129.9   60    ?      ?    1730.85 70.912       93.9177  70.912      637.339   -109.088     
1 1 1 24 27 29 o 0 275.4   78.4  ?      ?    1248.31 43.9619      662.828  43.9619     172.166   43.9619      
1 1 1 0  29 25 o 0 78      28.7  ?      ?    961.703 -90          276.214  -90         259.325   90           
1 1 1 2  29 25 o 0 1420.8  51    ?      ?    4513.95 -92.2776     3269.84  -92.2776    781.511   -92.2776     
1 1 1 4  29 25 o 0 1524.8  54.2  ?      ?    5290.31 69.5248      3037.63  69.5248     157.9     69.5248      
1 1 1 6  29 25 o 0 4.4     16.5  ?      ?    463.017 8.26219      196.292  -171.738    444.582   -171.738     
1 1 1 8  29 25 o 0 820.8   38.2  ?      ?    3771.66 172.948      2132.4   172.948     144.732   172.948      
1 1 1 10 29 25 o 0 58.3    19.9  ?      ?    1438.48 130.401      158.829  -49.599     901.938   -49.599      
1 1 1 12 29 25 o 0 2067.4  74.2  ?      ?    5302.75 -86.89       3732.33  -86.89      1054.65   -86.89       
1 1 1 14 29 25 f 1 101.9   22.1  ?      ?    3057.3  57.4019      370.156  -122.598    1909.74   -122.598     
1 1 1 16 29 25 o 0 222.5   31.7  ?      ?    820.799 171.231      699.074  171.231     300.042   171.231      
1 1 1 18 29 25 o 0 251.7   36.5  ?      ?    2087.3  -163.122     770.497  -163.122    210.671   16.8777      
1 1 1 20 29 25 o 0 1287.6  71    ?      ?    3173.84 -95.2629     2882.39  -95.2629    1448.51   -95.2629     
1 1 1 22 29 25 o 0 65.8    52.7  ?      ?    982.92  135.485      73.6977  -44.5149    499.005   -44.5149     
1 1 1 24 29 25 o 0 476.3   67.3  ?      ?    2740.81 54.6921      1111.47  54.6921     33.9742   -125.308     
1 1 1 25 26 29 o 0 1943.9  116.3 ?      ?    4151.69 -104.191     3065.86  -104.191    1432.75   -104.191     
1 1 1 25 28 29 o 0 295.4   104.3 ?      ?    2092.37 14.4699      599.02   14.4699     190.955   -165.53      
1 1 1 1  29 26 o 0 1128.6  46.4  ?      ?    4155.58 145.315      2759.11  145.315     510.723   145.315      
1 1 1 3  29 26 f 1 380.2   24.6  ?      ?    3220.43 24.4156      1026.13  24.4156     707.413   -155.584     
1 1 1 5  29 26 f 1 2051.4  70.5  ?      ?    6339.12 -67.9367     3330.82  -67.9367    36.371    112.063      
1 1 1 7  29 26 o 0 1073.4  46    ?      ?    5037.66 84.3115      2097.15  84.3115     521.901   -95.6885     
1 1 1 9  29 26 o 0 67.9    21.1  ?      ?    1252.45 -29.8452     26.1434  150.155     665.391   150.155      
1 1 1 11 29 26 o 0 1766.7  66.6  ?      ?    4196.45 113.947      3675.07  113.947     1541.02   113.947      
1 1 1 13 29 26 o 0 1947.7  73.1  ?      ?    4479.79 -150.789     3746.42  -150.789    1523.04   -150.789     
1 1 1 15 29 26 o 0 2086.3  79    ?      ?    5046.76 -2.20554     3595.23  -2.20554    1159.12   -2.20554     
1 1 1 17 29 26 o 0 1373.8  70.9  ?      ?    4990.66 169.217      2381.1   169.217     47.1717   169.217      
1 1 1 19 29 26 f 1 218.3   49.1  ?      ?    2925.73 66.0175      280.806  66.0175     1044.55   -113.982     
1 1 1 21 29 26 o 0 -14.4   47.4  ?      ?    1093.44 -120.677     309.956  59.3226     782.842   59.3226      
1 1 1 23 29 26 o 0 264.6   62    ?      ?    1804.65 54.1574      694.331  54.1574     61.4794   -125.843     
1 1 1 25 29 26 o 0 1174.2  99.7  ?      ?    3136.13 -101.723     2300.79  -101.723    1077.93   -101.723     
1 1 1 26 27 29 o 0 360.1   98.4  ?      ?    1697.05 -62.4223     892.073  -62.4223    251.235   -62.4223     
1 1 1 0  29 27 o 0 -15.7   33.7  ?      ?    310.287 90           11.5131  90          152.837   -90          
1 1 1 2  29 27 o 0 57.7    25    ?      ?    806.707 155.935      59.4799  -24.0649    483.094   -24.0649     
1 1 1 4  29 27 o 0 108.4   21    ?      ?    2042.16 -125.493     111.497  -125.493    948.67    54.5066      
1 1 1 6  29 27 o 0 191.9   23.5  ?      ?    524.745 122.283      519.39   122.283     250.798   122.283      
1 1 1 8  29 27 o 0 186.4   25.1  ?      ?    1371.7  -0.781404    656.243  -0.781404   46.4058   179.219      
1 1 1 10 29 27 o 0 64.2    24.8  ?      ?    904.461 133.614      68.1104  -46.3863    522.407   -46.3863     
1 1 1 12 29 27 o 0 1154.6  52    ?      ?    3687.84 -28.7104     2672.33  -28.7104    861.533   -28.7104     
1 1 1 14 29 27 o 0 308     33.5  ?      ?    1638.45 131.538      1124.44  131.538     340.602   131.538      
1 1 1 16 29 27 f 1 320.9   35.9  ?      ?    2524.21 -62.6862     853.844  -62.6862    323.2     117.314      
1 1 1 18 29 27 o 0 876.9   65.5  ?      ?    2386.71 56.9692      2348.92  56.9692     1279.11   56.9692      
1 1 1 20 29 27 o 0 202.6   59    ?      ?    2095.18 -149.243     445.556  -149.243    458.187   30.7574      
1 1 1 22 29 27 o 0 71.3    62.2  ?      ?    1189.2  -128.378     82.4906  51.6223     580.498   51.6223      
1 1 1 24 29 27 o 0 207.5   79.9  ?      ?    772.122 -59.7994     309.562  -59.7994    7.6921    -59.7994     
1 1 1 26 29 27 o 0 223.1   103.6 ?      ?    621.174 24.7764      273.029  24.7764     39.9283   24.7764      
1 1 1 27 28 29 o 0 -106.1  120.8 ?      ?    935.516 -30.9129     149.067  149.087     481.064   149.087      
1 1 1 1  29 28 o 0 217.2   28.6  ?      ?    2550.62 -158.97      576.345  -158.97     734.307   21.0301      
1 1 1 3  29 28 f 1 101.9   23.6  ?      ?    2359.36 -168.86      107.582  11.1404     1336.86   11.1404      
1 1 1 5  29 28 f 1 806.9   40.5  ?      ?    3878.53 40.4164      1889.42  40.4164     106.756   -139.584     
1 1 1 7  29 28 o 0 918.2   45.2  ?      ?    3714.57 -86.6528     2212.63  -86.6528    340.032   -86.6528     
1 1 1 9  29 28 o 0 950.3   48.2  ?      ?    3327.85 69.7803      2416.03  69.7803     768.239   69.7803      
1 1 1 11 29 28 f 1 3725.9  137   ?      ?    7524.01 -112.366     4503.64  -112.366    834.872   -112.366     
1 1 1 13 29 28 o 0 384.4   34    ?      ?    3605.04 -102.01      706.496  -102.01     999.568   77.99        
1 1 1 15 29 28 o 0 2105.2  87.3  ?      ?    5232.75 103.511      3359.52  103.511     954.817   103.511      
1 1 1 17 29 28 o 0 256     47.2  ?      ?    1228.17 -47.8836     790.664  -47.8836    243.944   -47.8836     
1 1 1 19 29 28 o 0 132.5   63.4  ?      ?    2012    93.9766      54.7764  93.9766     821.038   -86.0234     
1 1 1 21 29 28 o 0 41.5    73.1  ?      ?    1027.96 176.156      113.882  -3.84356    543.402   -3.84356     
1 1 1 23 29 28 o 0 598.9   83    ?      ?    2790.48 -142.394     1330.53  -142.394    239.15    -142.394     
1 1 1 25 29 28 o 0 39.5    98.3  ?      ?    2190.44 -152.292     260.261  27.7078     1084.88   27.7078      
1 1 1 27 29 28 o 0 48.9    119.4 ?      ?    978.99  57.3133      17.2179  -122.687    363.483   -122.687     
1 1 1 0  29 29 o 0 333.8   49.5  ?      ?    99.9374 90           123.594  90          72.587    90           
1 1 1 2  29 29 o 0 511     37.1  ?      ?    2990.27 65.17        1452.21  65.17       63.2051   -114.83      
1 1 1 4  29 29 o 0 78      24.5  ?      ?    572.077 19.6063      31.8281  19.6063     255.148   -160.394     
1 1 1 6  29 29 o 0 106.6   26    ?      ?    2068.99 123.468      25.6086  123.468     998.684   -56.5315     
1 1 1 8  29 29 o 0 378.9   35    ?      ?    2257.66 -170.726     1244.18  -170.726    144.402   -170.726     
1 1 1 10 29 29 o 0 174.4   30.9  ?      ?    1691.45 -6.03708     512.406  -6.03708    295.868   173.963      
1 1 1 12 29 29 o 0 908.5   55.5  ?      ?    3792.85 138.035      1977.13  138.035     207.609   138.035      
1 1 1 14 29 29 o 0 175.5   40.2  ?      ?    1552.41 -145.627     449.161  -145.627    256.52    34.3732      
1 1 1 16 29 29 o 0 201.1   46.7  ?      ?    2000.37 -101.651     481.61   -101.651    400.983   78.3486      
1 1 1 18 29 29 o 0 1654    91.9  ?      ?    5893.67 -16.7417     2180.75  -16.7417    367.552   163.258      
1 1 1 20 29 29 o 0 684     80.9  ?      ?    3812.11 105.26       1227.43  105.26      358.454   -74.7402     
1 1 1 22 29 29 o 0 96      80.1  ?      ?    597.833 47.703       20.7619  47.703      212.627   -132.297     
1 1 1 24 29 29 o 0 509.2   101.7 ?      ?    1911.39 39.816       1265.44  39.816      545.237   39.816       
1 1 1 26 29 29 o 0 438.1   128.2 ?      ?    2225.01 45.7684      931.942  45.7684     141.983   45.7684      
1 1 1 28 29 29 o 0 2078.5  185.9 ?      ?    5762.02 111.144      2265.22  111.144     370.726   111.144      
1 1 1 0  30 0  o 0 473.3   31.2  ?      ?    4028.87 1.50864e-13  1614.76  0           565.797   -180         
1 1 1 0  2  30 o 0 180.7   10.9  ?      ?    1525.93 180          909.015  180         96.8809   -180         
1 1 1 0  4  30 o 0 13.2    5.4   ?      ?    597.053 3.27935e-13  36.9469  0           281.672   -180         
1 1 1 0  6  30 o 0 745.9   36.7  ?      ?    2654.09 4.50708e-14  2520.7   0           739.567   -1.08546e-13 
1 1 1 0  8  30 o 0 450.3   23.3  ?      ?    2835.03 180          1947.57  180         56.0167   -180         
1 1 1 0  10 30 o 0 53.5    7.3   ?      ?    876.041 2.19795e-14  305.223  0           273.392   -180         
1 1 1 0  12 30 o 0 -2.4    6.9   ?      ?    262.188 180          3.30559  180         165.3     -1.9929e-14  
1 1 1 0  14 30 o 0 162.6   10.9  ?      ?    1558.79 180          1015.72  180         31.9291   180          
1 1 1 0  16 30 o 0 5.5     9.8   ?      ?    1206.11 2.29733e-14  37.1977  0           706.683   -180         
1 1 1 0  18 30 o 0 2.3     11.1  ?      ?    685.851 180          18.296   180         393.331   -2.00561e-13 
1 1 1 0  20 30 o 0 17      13.2  ?      ?    180.529 180          11.1881  180         92.743    -1.44873e-13 
1 1 1 0  22 30 o 0 603.4   35    ?      ?    3044.47 -180         1919.95  180         228.58    180          
1 1 1 0  24 30 o 0 162     21    ?      ?    1243.03 -3.5828e-14  715.157  0           34.4326   7.08312e-13  
1 1 1 0  26 30 o 0 1018.3  66.1  ?      ?    3033.69 -9.64933e-15 2373.9   0           783.761   1.95771e-14  
1 1 1 0  28 30 o 0 -29     45.5  ?      ?    542.632 -180         21.0462  180         254.905   1.90033e-13  
1 1 1 1  30 1  o 0 594.2   19.6  ?      ?    2259.98 -66.1827     2186.31  -66.1827    967.649   -66.1827     
1 1 1 1  3  30 o 0 995.1   31.3  ?      ?    3063.36 154.382      2828.9   154.382     1203.28   154.382      
1 1 1 1  5  30 o 0 829.7   27.3  ?      ?    3297.82 -68.7965     2315.76  -68.7965    565.255   -68.7965     
1 1 1 1  21 30 o 0 232.8   14.4  ?      ?    2052.53 56.6763      954.705  56.6763     201.767   -123.324     
1 1 1 1  23 30 f 1 1099.7  40.8  ?      ?    2903.05 69.9093      3404.16  69.9093     1762.99   69.9093      
1 1 1 1  25 30 o 0 147.1   22.6  ?      ?    550.863 129.321      374.621  129.321     80.3679   129.321      
1 1 1 1  27 30 o 0 485.5   37.3  ?      ?    3003.35 -49.1625     1399.48  -49.1625    160.735   130.837      
1 1 1 1  29 30 o 0 861.6   48.7  ?      ?    3493.03 -124.418     2136.43  -124.418    409.401   -124.418     
1 1 1 0  30 2  o 0 808.7   36.9  ?      ?    2249.23 180          2132.4   180         906.448   180          
1 1 1 2  10 30 o 0 543     18.9  ?      ?    1968.55 -95.9917     2603.36  -95.9917    1317.39   -95.9917     
1 1 1 2  16 30 o 0 510.5   19.2  ?      ?    4453.64 -1.41952     998.615  -1.41952    1719.86   178.58       
1 1 1 2  18 30 o 0 266.9   13.7  ?      ?    3009.06 140.666      730.487  140.666     1057.66   -39.3338     
1 1 1 2  20 30 o 0 252.4   14.3  ?      ?    2803.44 140.717      729.841  140.717     869.095   -39.2829     
1 1 1 2  24 30 o 0 992     39.3  ?      ?    2999.68 140.235      3011.34  140.235     1381.79   140.235      
1 1 1 2  26 30 o 0 1480.5  57.4  ?      ?    5377.47 -67.6411     2775.11  -67.6411    22.8898   112.359      
1 1 1 2  28 30 o 0 697.6   41.4  ?      ?    3500.18 146.301      1763.81  146.301     4.3722    -33.6988     
1 1 1 1  30 3  o 0 1026.3  31.2  ?      ?    4500.37 66.0411      2234.06  66.0411     204.125   -113.959     
1 1 1 3  30 3  o 0 1546.2  48.2  ?      ?    6323.57 -79.9258     2321.53  -79.9258    1050.58   100.074      
1 1 1 3  9  30 o 0 528.3   18.3  ?      ?    2136.61 161.331      2461.44  161.331     1065.67   161.331      
1 1 1 3  23 30 o 0 510.4   24.4  ?      ?    2384.21 -3.08304     1962.61  -3.08304    635.161   -3.08304     
1 1 1 3  25 30 o 0 -13.2   16    ?      ?    2598.35 -154.645     1219.91  25.3553     2595.31   25.3553      
1 1 1 3  27 30 f 1 637.9   39.5  ?      ?    2673.23 115.187      1987.21  115.187     602.497   115.187      
1 1 1 3  29 30 f 1 800.8   44    ?      ?    1584.89 -28.0568     2663.8   -28.0568    1882.01   -28.0568     
1 1 1 0  30 4  o 0 1664.8  73.6  ?      ?    4962.22 -2.80152e-14 3064.76  0           352.251   2.15731e-13  
1 1 1 4  30 4  o 0 1224.5  38.4  ?      ?    3827.85 132.376      3713.17  132.376     1161.25   132.376      
1 1 1 4  10 30 o 0 1330.6  43.4  ?      ?    3866.29 101.37       3832.01  101.37      1335.19   101.37       
1 1 1 4  16 30 o 0 378     15.8  ?      ?    3321.45 154.318      1095.36  154.318     908.423   -25.6815     
1 1 1 4  18 30 o 0 483.9   19.5  ?      ?    2767.59 -94.2202     1776.17  -94.2202    150.403   -94.2202     
1 1 1 4  20 30 o 0 112.9   10.3  ?      ?    2147.14 -50.472      165.358  -50.472     1045.5    129.528      
1 1 1 4  22 30 o 0 132.4   11.8  ?      ?    1554.69 111.448      486.57   111.448     360.294   -68.5521     
1 1 1 4  24 30 o 0 70.3    9.9   ?      ?    748.372 61.1068      39.6278  61.1068     362.627   -118.893     
1 1 1 4  26 30 o 0 1268.5  50.6  ?      ?    4791.37 144.293      2616.24  144.293     148.517   144.293      
1 1 1 4  28 30 o 0 1080.8  50.3  ?      ?    3711.72 -76.6629     2557.06  -76.6629    700.263   -76.6629     
1 1 1 1  30 5  o 0 913.8   29.1  ?      ?    4251.96 -93.2919     2093.63  -93.2919    211.308   86.7081      
1 1 1 3  30 5  o 0 1184.8  36    ?      ?    4111.65 30.0548      3456.9   30.0548     695.043   30.0548      
1 1 1 5  30 5  o 0 801.3   25.8  ?      ?    2317.06 69.9314      3362.99  69.9314     1831.59   69.9314      
1 1 1 5  13 30 o 0 993.7   32.2  ?      ?    2950.98 174.49       3415.63  174.49      1588.01   174.49       
1 1 1 5  15 30 o 0 2009.4  67.6  ?      ?    4272.62 -58.012      4835.7   -58.012     2243.79   -58.012      
1 1 1 5  17 30 o 0 226.6   13.5  ?      ?    1827.54 115.414      1079.17  115.414     2.44755   -64.5855     
1 1 1 5  19 30 f 1 373.4   18.8  ?      ?    2579.01 121.014      1381.89  121.014     94.6683   -58.9864     
1 1 1 5  21 30 o 0 308.5   18.4  ?      ?    2700.41 155.583      1015.3   155.583     472.713   -24.4171     
1 1 1 5  23 30 o 0 258     23.5  ?      ?    2532.4  28.4486      828.28   28.4486     551.53    -151.551     
1 1 1 5  25 30 o 0 297.1   27    ?      ?    1486.29 -20.0757     1298.07  -20.0757    520.483   -20.0757     
1 1 1 5  27 30 o 0 1012.7  45.7  ?      ?    3867.56 114.196      2381.76  114.196     412.289   114.196      
1 1 1 5  29 30 o 0 233.8   30.6  ?      ?    2770.76 -79.2283     478.842  -79.2283    865.192   100.772      
1 1 1 0  30 6  o 0 372.1   18.6  ?      ?    2762.42 -8.03502e-15 1824.55  0           74.6794   180          
1 1 1 2  30 6  o 0 1494.2  46.3  ?      ?    3781.72 -175.881     4474.01  -175.881    1916.54   -175.881     
1 1 1 4  30 6  o 0 1878    57.9  ?      ?    4417.07 -35.8213     4851.27  -35.8213    1912.78   -35.8213     
1 1 1 6  16 30 o 0 742.5   28.8  ?      ?    3862.98 -2.37599     2077.38  -2.37599    223.206   177.624      
1 1 1 6  18 30 o 0 116.5   12.4  ?      ?    1646.92 105.983      367.381  105.983     577.871   -74.0174     
1 1 1 6  20 30 o 0 8.2     11.6  ?      ?    491.928 -12.0785     215.864  167.922     489.666   167.922      
1 1 1 6  22 30 o 0 424.4   24    ?      ?    1977.46 -35.0735     1756.17  -35.0735    693.051   -35.0735     
1 1 1 6  24 30 o 0 437.7   28.3  ?      ?    3242.91 -108.198     1229.78  -108.198    490.726   71.8023      
1 1 1 6  26 30 o 0 632.4   38.7  ?      ?    3348.93 -6.47907     1742.92  -6.47907    40.26     -6.47907     
1 1 1 6  28 30 o 0 135.1   24.3  ?      ?    2850.95 -113.301     59.0301  66.699      1467.13   66.699       
1 1 1 5  30 7  o 0 579.3   20.3  ?      ?    2720.44 -98.2364     2353.54  -98.2364    563.337   -98.2364     
1 1 1 7  30 7  o 0 667.6   23.3  ?      ?    4282.8  -158.499     1696.92  -158.499    1074.15   21.5014      
1 1 1 7  19 30 o 0 69.6    12.3  ?      ?    1287.23 -175.458     43.96    -175.458    678.74    4.54245      
1 1 1 7  21 30 o 0 130.5   15.9  ?      ?    1125.03 124.294      521.604  124.294     89.6396   -55.7056     
1 1 1 7  23 30 o 0 649.7   33    ?      ?    3144.56 -81.746      1991     -81.746     301.825   -81.746      
1 1 1 7  25 30 o 0 54      25.4  ?      ?    490.734 173.034      41.9804  -6.96556    295.083   -6.96556     
1 1 1 7  27 30 o 0 759.9   44.1  ?      ?    2740.26 -50.0005     2240.18  -50.0005    864.526   -50.0005     
1 1 1 7  29 30 o 0 868.9   50.6  ?      ?    4878.73 112.083      1473.68  112.083     859.436   -67.9174     
1 1 1 0  30 8  o 0 445.7   22.1  ?      ?    2802.85 180          1985.47  180         69.5025   -180         
1 1 1 2  30 8  o 0 1215.8  38.6  ?      ?    2454.75 -25.3568     4553.56  -25.3568    2903.2    -25.3568     
1 1 1 8  12 30 o 0 538.2   20.5  ?      ?    2625.34 -100.386     2133.53  -100.386    524.474   -100.386     
1 1 1 8  14 30 o 0 395.5   17.4  ?      ?    2525.89 -85.4051     1587.23  -85.4051    69.0732   -85.4051     
1 1 1 8  16 30 o 0 751.3   31.2  ?      ?    2797.96 -163.51      2643.16  -163.51     1000.32   -163.51      
1 1 1 8  18 30 o 0 416.9   21.3  ?      ?    1551.03 81.8163      1961.47  81.8163     1084.17   81.8163      
1 1 1 8  20 30 o 0 538.6   26.5  ?      ?    2615.48 8.40902      1923.44  8.40902     489.324   8.40902      
1 1 1 8  22 30 o 0 824.6   38.1  ?      ?    2672.41 106.242      2728.67  106.242     1277.3    106.242      
1 1 1 8  24 30 o 0 29.8    24.1  ?      ?    1429.4  -49.8122     399.627  130.188     1146.35   130.188      
1 1 1 8  26 30 o 0 1179.2  56.5  ?      ?    5632.03 -128.361     1896.22  -128.361    972.826   51.6392      
1 1 1 8  28 30 o 0 180.9   39.1  ?      ?    2933.03 88.0283      158.23   88.0283     1267.78   -91.9717     
1 1 1 3  30 9  o 0 584.5   21.3  ?      ?    3164.73 -93.6726     2129.44  -93.6726    29.0174   -93.6726     
1 1 1 5  30 9  f 1 823.4   28.7  ?      ?    2910.68 4.53157      3043.53  4.53157     1133.35   4.53157      
1 1 1 9  15 30 o 0 521.3   23.4  ?      ?    1887.86 -150.552     2339.59  -150.552    1225.91   -150.552     
1 1 1 9  17 30 o 0 1169.1  45.6  ?      ?    4832.56 -2.94612     2597.86  -2.94612    152.792   177.054      
1 1 1 9  19 30 o 0 1492.8  59    ?      ?    4426.22 -177.152     3429.65  -177.152    983.364   -177.152     
1 1 1 9  21 30 o 0 729.4   34.9  ?      ?    3733.01 -22.584      1917.74  -22.584     77.9095   157.416      
1 1 1 9  23 30 f 1 33.5    23.6  ?      ?    1833.83 156.665      517.429  -23.3347    1491.81   -23.3347     
1 1 1 9  25 30 o 0 36.4    29.2  ?      ?    1148.55 81.1128      246.122  -98.8872    828.588   -98.8872     
1 1 1 9  27 30 o 0 4168.4  160.6 ?      ?    8282.53 129.864      4714.54  129.864     627.284   129.864      
1 1 1 9  29 30 o 0 2375.1  95    ?      ?    5668.26 -63.3243     3611.06  -63.3243    951.015   -63.3243     
1 1 1 0  30 10 o 0 376.3   19.6  ?      ?    2654.4  5.78315e-15  1804.88  0           8.86154   -1.1721e-12  
1 1 1 10 30 10 o 0 447.6   17.7  ?      ?    2489.28 -98.4731     1853.37  -98.4731    329.201   -98.4731     
1 1 1 10 12 30 o 0 655.8   24.4  ?      ?    2774.66 15.7086      2430.77  15.7086     754.094   15.7086      
1 1 1 10 16 30 o 0 385.5   19.7  ?      ?    2471.15 119.052      1496.01  119.052     82.1007   119.052      
1 1 1 10 18 30 o 0 1292.1  50.4  ?      ?    3933.12 67.488       3289.01  67.488      1100.51   67.488       
1 1 1 10 20 30 o 0 34.1    15.7  ?      ?    671.287 87.4126      146.178  -92.5874    508.049   -92.5874     
1 1 1 10 22 30 o 0 1974.7  80.5  ?      ?    4712.04 -90.3464     4081.78  -90.3464    1567.24   -90.3464     
1 1 1 10 24 30 f 1 352     31.2  ?      ?    2031.34 162.038      1358.84  162.038     310.751   162.038      
1 1 1 10 26 30 o 0 631.3   42.2  ?      ?    3083.23 32.5517      1746.46  32.5517     204.527   32.5517      
1 1 1 10 28 30 o 0 368.8   46.9  ?      ?    2120.45 38.5953      1223.82  38.5953     212.091   38.5953      
1 1 1 1  30 11 o 0 487.2   17.1  ?      ?    1853.22 92.6594      2486.86  92.6594     1251.54   92.6594      
1 1 1 11 17 30 f 1 1783.1  67.6  ?      ?    5184.45 -31.7692     3609.14  -31.7692    691.656   -31.7692     
1 1 1 11 19 30 f 1 229.4   18.9  ?      ?    2973.52 -176.299     492.96   -176.299    1130.59   3.70131      
1 1 1 11 21 30 o 0 13.4    21.9  ?      ?    1247.32 35.8452      458.996  -144.155    1130.42   -144.155     
1 1 1 11 23 30 o 0 444.4   33.1  ?      ?    1826.91 129.952      1787.72  129.952     840.744   129.952      
1 1 1 11 25 30 o 0 100.4   31.7  ?      ?    999.028 32.6018      152.171  32.6018     353.409   -147.398     
1 1 1 11 27 30 o 0 180.1   39.4  ?      ?    1634.27 -38.2961     554.678  -38.2962    235.688   141.704      
1 1 1 11 29 30 o 0 164.8   50.9  ?      ?    1450.24 92.7309      402.009  92.7309     264.676   -87.2691     
1 1 1 0  30 12 o 0 8       8.4   ?      ?    911.228 -180         34.8672  180         565.212   4.81104e-15  
1 1 1 8  30 12 o 0 861.2   28.2  ?      ?    4125.32 -35.1834     2353.25  -35.1834    183.329   144.817      
1 1 1 12 30 12 o 0 442.5   19.3  ?      ?    3026.02 -174.159     1490.46  -174.159    295.097   5.8415       
1 1 1 12 14 30 o 0 1069.8  42.3  ?      ?    3536.35 73.9727      3089.6   73.9727     1030.45   73.9727      
1 1 1 12 16 30 o 0 1400    53.9  ?      ?    4672.19 -143.369     3159.59  -143.369    533.162   -143.369     
1 1 1 12 18 30 o 0 863.4   38    ?      ?    2328.23 -96.5849     2994.73  -96.5849    1723.07   -96.5849     
1 1 1 12 20 30 o 0 336.5   23.4  ?      ?    1674.27 135.297      1485.37  135.297     577.392   135.297      
1 1 1 12 22 30 o 0 26.2    22.7  ?      ?    760.989 46.3964      218.584  -133.604    616.58    -133.604     
1 1 1 12 24 30 o 0 -42.7   30.4  ?      ?    758.667 -123.169     311.604  56.8305     692.816   56.8305      
1 1 1 12 26 30 o 0 22.1    37.9  ?      ?    1632.94 94.0342      440.76   -85.9658    1240.04   -85.9658     
1 1 1 12 28 30 o 0 9.7     45.2  ?      ?    1258.21 100.884      341.604  -79.1158    927.953   -79.1158     
1 1 1 7  30 13 o 0 416.9   16.4  ?      ?    2467.52 -9.93734     1746.42  -9.93734    228.598   -9.93734     
1 1 1 11 30 13 o 0 942.3   33.8  ?      ?    3241.17 148.076      2969.12  148.076     1053.15   148.076      
1 1 1 13 30 13 o 0 384.4   19.1  ?      ?    3018.29 -88.3322     1231.95  -88.3322    511.538   91.6678      
1 1 1 13 15 30 o 0 378.5   20.4  ?      ?    2004.08 61.4893      1647.13  61.4893     516.591   61.4893      
1 1 1 13 17 30 f 1 1403.9  55.3  ?      ?    5260.4  77.2814      2774.55  77.2813     128.979   -102.719     
1 1 1 13 19 30 o 0 222.6   20.1  ?      ?    2976.75 -53.887      471.268  -53.887     1168.94   126.113      
1 1 1 13 21 30 o 0 204.8   27.1  ?      ?    842.816 152.759      783.284  152.759     339.104   152.759      
1 1 1 13 23 30 o 0 2325    97.2  ?      ?    5192.44 -155.97      4190.62  -155.97     1557.67   -155.97      
1 1 1 13 25 30 o 0 138.9   38    ?      ?    1626.29 -73.2582     332.978  -73.2582    471.523   106.742      
1 1 1 13 27 30 o 0 171.2   42.4  ?      ?    2672.6  -12.7484     200.521  -12.7484    1062.04   167.252      
1 1 1 13 29 30 o 0 207     41.9  ?      ?    1281.73 81.4945      597.295  81.4945     22.1018   81.4945      
1 1 1 0  30 14 o 0 373.4   20.9  ?      ?    2562.55 180          1736.25  180         81.176    -180         
1 1 1 2  30 14 o 0 439.1   18.1  ?      ?    3014.23 22.4041      1598.42  22.4041     318.139   -157.596     
1 1 1 8  30 14 o 0 381     16.9  ?      ?    2035.11 -81.1863     1769.21  -81.1863    541.295   -81.1863     
1 1 1 12 30 14 o 0 1070.1  40.4  ?      ?    3124.37 55.9226      3289.52  55.9226     1482.01   55.9226      
1 1 1 14 30 14 o 0 140.3   14.5  ?      ?    1068.75 -124.065     599.665  -124.065    2.59545   -124.065     
1 1 1 14 16 30 o 0 129.6   16    ?      ?    1739.3  146.662      422.271  146.662     535.937   -33.3382     
1 1 1 14 18 30 o 0 1794.3  69.4  ?      ?    5976.12 27.1084      3083.41  27.1084     112.225   -152.892     
1 1 1 14 20 30 o 0 2010.3  77.3  ?      ?    6140.89 138.467      3393.35  138.467     136.175   138.467      
1 1 1 14 22 30 o 0 1277.7  60.7  ?      ?    4207.01 -46.5051     2891.21  -46.5051    741.267   -46.5051     
1 1 1 14 24 30 o 0 2373.2  100.6 ?      ?    5306.08 172.081      4011.42  172.081     1362.3    172.081      
1 1 1 14 26 30 o 0 1662.3  82.4  ?      ?    4126.05 -71.9989     3310.14  -71.9989    1340.06   -71.9989     
1 1 1 14 28 30 o 0 641.6   48.3  ?      ?    3248.08 -61.6769     1527.47  -61.6769    52.028    -61.6769     
1 1 1 5  30 15 o 0 361.6   16.7  ?      ?    1551.95 -150.13      1908.32  -150.13     956.43    -150.13      
1 1 1 9  30 15 o 0 272.1   14    ?      ?    2696.33 171.805      914.438  171.805     678.952   -8.19467     
1 1 1 11 30 15 o 0 421.7   20    ?      ?    3001.08 55.25        1386.68  55.25       332.163   -124.75      
1 1 1 13 30 15 o 0 478.7   24.6  ?      ?    3161.42 -141.768     1486.05  -141.768    282.46    38.2319      
1 1 1 15 30 15 o 0 2015.3  76.3  ?      ?    4832.1  18.9795      4125.6   18.9795     1493.58   18.9795      
1 1 1 15 17 30 f 1 1409.5  56.6  ?      ?    3506.06 -143.349     3618.33  -143.349    1725.62   -143.349     
1 1 1 15 19 30 o 0 761.3   37.6  ?      ?    3836.03 -15.8271     1965.23  -15.8271    79.9834   164.173      
1 1 1 15 21 30 o 0 1359.7  58.8  ?      ?    5832.09 128.371      2282.68  128.371     717.157   -51.6287     
1 1 1 15 23 30 o 0 25.5    23.6  ?      ?    1389.77 -129.273     430.117  50.7271     1129.44   50.7271      
1 1 1 15 25 30 o 0 921.1   51.4  ?      ?    3591.82 119.858      2174.1   119.858     443.198   119.858      
1 1 1 15 27 30 o 0 1037.7  60.1  ?      ?    3633.76 -134.281     2276.21  -134.281    607.884   -134.281     
1 1 1 15 29 30 o 0 878.7   61.3  ?      ?    4064.39 19.0325      1678.11  19.0325     95.761    -160.967     
1 1 1 0  30 16 o 0 196.5   16    ?      ?    1079.76 -6.21178e-14 1003.36  0           322.575   1.31098e-13  
1 1 1 10 30 16 o 0 1602    55.2  ?      ?    4245.67 29.3341      3865.95  29.3341     1437.34   29.3341      
1 1 1 12 30 16 o 0 105.1   12.7  ?      ?    1955.67 160.484      172.702  160.484     921.127   -19.5158     
1 1 1 14 30 16 o 0 0.7     13.6  ?      ?    578.375 -98.0595     259.964  81.9405     575.39    81.9405      
1 1 1 16 30 16 o 0 921.6   39.1  ?      ?    3381.11 -47.7121     2571.86  -47.7121    780.032   -47.7121     
1 1 1 16 18 30 o 0 957     45.4  ?      ?    3359.54 112.276      2711.12  112.276     912.925   112.276      
1 1 1 16 20 30 o 0 2007    84.2  ?      ?    5688.7  -87.7093     3525.55  -87.7093    584.231   -87.7093     
1 1 1 16 22 30 f 1 2062.1  84    ?      ?    7427.33 103.334      2547.6   103.334     1235.38   -76.6657     
1 1 1 16 24 30 o 0 3.6     28.6  ?      ?    400.419 55.0553      136.097  -124.945    330.574   -124.945     
1 1 1 16 26 30 o 0 125.7   36.3  ?      ?    1098.63 -5.06784     216.475  -5.06784    292.58    174.932      
1 1 1 16 28 30 o 0 167.4   45    ?      ?    3800.03 -152.272     272.624  27.7276     1948.77   27.7276      
1 1 1 5  30 17 o 0 470.8   19.7  ?      ?    2779.39 -92.8665     1752.27  -92.8664    89.5436   -92.8664     
1 1 1 11 30 17 f 1 415.4   21.2  ?      ?    2122.12 -95.0421     1725.14  -95.0421    533.444   -95.0421     
1 1 1 13 30 17 f 1 334.9   19.1  ?      ?    1753.02 16.1605      1500.33  16.1605     539.227   16.1605      
1 1 1 15 30 17 f 1 279.3   20.9  ?      ?    2790.24 155.487      801.438  155.487     687.43    -24.5128     
1 1 1 17 30 17 o 0 237.3   20.1  ?      ?    1797.64 -46.2984     961.891  -46.2984    13.2605   -46.2984     
1 1 1 17 19 30 o 0 -8.2    20.6  ?      ?    490.197 -139.531     206.498  40.4687     460.935   40.4687      
1 1 1 17 21 30 o 0 466.2   33.4  ?      ?    1887.6  59.3826      1726.4   59.3826     765.463   59.3826      
1 1 1 17 23 30 o 0 863.6   49    ?      ?    3889.75 -31.2253     1942.32  -31.2253    40.9698   -31.2253     
1 1 1 17 25 30 o 0 117.3   33.7  ?      ?    1066.86 165.714      175.941  165.714     322.228   -14.2859     
1 1 1 17 27 30 f 1 298.1   46.5  ?      ?    318.709 -131.23      401.153  -131.23     258.492   -131.23      
1 1 1 17 29 30 o 0 2278.4  110.5 ?      ?    4759.11 -141.762     3453.5   -141.762    1413.69   -141.762     
1 1 1 0  30 18 o 0 1232.3  61.7  ?      ?    4777.44 4.27849e-15  2991.25  0           64.5781   -1.93901e-13 
1 1 1 4  30 18 o 0 381     17.2  ?      ?    1655.57 92.5636      1899.85  92.5636     915.134   92.5636      
1 1 1 6  30 18 o 0 187.7   13.5  ?      ?    828.602 -124.645     867.702  -124.645    388.054   -124.645     
1 1 1 12 30 18 o 0 41.3    13.7  ?      ?    1606.69 -2.55526     331.441  177.445     1205.72   177.445      
1 1 1 14 30 18 o 0 203.6   19.4  ?      ?    1261.75 -156.161     943.164  -156.161    273.976   -156.161     
1 1 1 16 30 18 o 0 7.3     17.9  ?      ?    366.712 -18.0066     146.389  161.993     340.157   161.993      
1 1 1 18 30 18 o 0 2838.9  107.9 ?      ?    7042.26 174.187      4042.42  174.187     442.675   174.187      
1 1 1 18 20 30 o 0 3848.7  154.8 ?      ?    7619.34 -2.81661     4927.18  -2.81661    1101.71   -2.81661     
1 1 1 18 22 30 o 0 300.6   33.2  ?      ?    1692.58 -96.4513     1114.15  -96.4513    282.654   -96.4513     
1 1 1 18 24 30 o 0 648     48.4  ?      ?    4167.84 122.392      1231.62  122.392     729.702   -57.6079     
1 1 1 18 26 30 o 0 188.2   44.3  ?      ?    1138.67 -141.227     500.409  -141.227    10.2698   38.7734      
1 1 1 18 28 30 o 0 -93.2   59.4  ?      ?    1018.82 71.507       332.624  -108.493    773.206   -108.493     
1 1 1 1  30 19 o 0 648.9   25.2  ?      ?    2865.89 -82.7479     2330.89  -82.7479    631.929   -82.7479     
1 1 1 7  30 19 o 0 49.5    12.6  ?      ?    1280.18 -62.4799     147.65   117.52      871.051   117.52       
1 1 1 9  30 19 o 0 243.8   16.3  ?      ?    1592.76 -5.65596     1147.89  -5.65596    265.213   -5.65596     
1 1 1 11 30 19 f 1 43      13.4  ?      ?    439.851 87.5644      48.722   -92.4356    288.601   -92.4356     
1 1 1 13 30 19 o 0 100.9   16.7  ?      ?    1192.71 11.2021      311.137  11.2021     342.648   -168.798     
1 1 1 15 30 19 o 0 430.2   25.3  ?      ?    3403.97 64.8872      1123.01  64.8872     674.82    -115.113     
1 1 1 17 30 19 o 0 251.4   24.5  ?      ?    1525.01 -54.8956     1057.06  -54.8956    276.4     -54.8956     
1 1 1 19 30 19 f 1 537     38.5  ?      ?    4209.58 103.917      1017.54  103.917     1073.78   -76.083      
1 1 1 19 21 30 o 0 523.3   35.7  ?      ?    1030.5  -90.7089     1904.16  -90.7089    1396.13   -90.7089     
1 1 1 19 23 30 o 0 4206.6  159.7 ?      ?    7823.56 73.2842      4773.23  73.2842     1073.94   73.2842      
1 1 1 19 25 30 o 0 877.6   59.8  ?      ?    4019.54 -177.392     1752.53  -177.392    61.1043   2.60768      
1 1 1 19 27 30 o 0 124.7   52.2  ?      ?    453.131 87.0884      82.5206  87.0884     114.875   -92.9116     
1 1 1 19 29 30 f 1 1282    95.2  ?      ?    3531.9  -30.0764     2418.09  -30.0764    950.011   -30.0764     
1 1 1 0  30 20 o 0 -6.2    18.8  ?      ?    1282.34 5.24697e-14  35.6783  0           716.343   -180         
1 1 1 2  30 20 o 0 621.6   24.6  ?      ?    2695.07 80.3155      2272.9   80.3155     712.665   80.3155      
1 1 1 4  30 20 o 0 50      12.8  ?      ?    980.144 150.891      81.7128  -29.1089    640.816   -29.1089     
1 1 1 6  30 20 o 0 1333.2  48    ?      ?    5119.15 -152.161     2778.95  -152.161    93.2406   27.8385      
1 1 1 8  30 20 o 0 1185.1  41.6  ?      ?    4993.28 20.9175      2473.37  20.9175     277.074   -159.082     
1 1 1 10 30 20 o 0 101.7   15.4  ?      ?    2412.07 -16.8659     32.7657  163.134     1334.4    163.134      
1 1 1 12 30 20 o 0 16.4    15.2  ?      ?    871.414 -77.3654     333.437  102.635     804.786   102.635      
1 1 1 14 30 20 o 0 1462.9  59.4  ?      ?    4650.26 -117.207     3139.05  -117.207    688.255   -117.207     
1 1 1 16 30 20 o 0 341.1   27    ?      ?    2799.07 4.52023      1021.15  4.52023     411.165   -175.48      
1 1 1 18 30 20 o 0 200     26.5  ?      ?    1967    -129.518     671.15   -129.518    302.196   50.4825      
1 1 1 20 30 20 o 0 339.2   36.4  ?      ?    3541.18 -88.2307     587.553  -88.2307    1129.15   91.7693      
1 1 1 20 22 30 f 1 426.2   40.3  ?      ?    4419.42 16.1622      481.854  16.1622     1626.49   -163.838     
1 1 1 20 24 30 o 0 765.9   51.3  ?      ?    4064.11 40.1254      1496.5   40.1254     345.521   -139.875     
1 1 1 20 26 30 o 0 429.4   56.7  ?      ?    2715.27 -143.061     1043.43  -143.061    146.246   36.939       
1 1 1 20 28 30 o 0 1202.2  87.4  ?      ?    2627.64 -119.553     2625.26  -119.553    1531.5    -119.553     
1 1 1 1  30 21 o 0 366.6   18.4  ?      ?    2249.83 -14.4148     1519.73  -14.4148    232.133   -14.4148     
1 1 1 3  30 21 o 0 313.2   17.4  ?      ?    2455.02 -108.806     1176.3   -108.806    210.089   71.1943      
1 1 1 5  30 21 o 0 433.2   20.9  ?      ?    2587.98 -7.9114      1588.37  -7.9114     149.108   -7.9114      
1 1 1 7  30 21 o 0 169.4   16.3  ?      ?    1515.32 -146.579     736.724  -146.579    91.5733   33.4211      
1 1 1 9  30 21 o 0 263.7   18.8  ?      ?    2405.21 -150.674     915.736  -150.674    373.768   29.326       
1 1 1 11 30 21 o 0 281.8   20.4  ?      ?    2960.91 -136.407     743.41   -136.407    849.765   43.5933      
1 1 1 13 30 21 o 0 378.8   25    ?      ?    1199.1  92.5406      1660.73  92.5406     1031.18   92.5406      
1 1 1 15 30 21 o 0 495.2   31.5  ?      ?    2539.73 -84.1831     1678.69  -84.1831    381.891   -84.1831     
1 1 1 17 30 21 o 0 668.1   37.7  ?      ?    3847.86 138.391      1522.35  138.391     415.047   -41.6094     
1 1 1 19 30 21 o 0 112.2   31.7  ?      ?    1661.79 102.392      157.568  102.392     649.617   -77.6077     
1 1 1 21 30 21 o 0 2007.1  83.3  ?      ?    5301.35 -110.505     3245.56  -110.505    773.33    -110.505     
1 1 1 21 23 30 o 0 330.4   42.7  ?      ?    2559.75 87.8705      861.24   87.8705     302.338   -92.1295     
1 1 1 21 25 30 f 1 922.9   67.8  ?      ?    4239.67 -79.362      1677.21  -79.362     172.96    100.638      
1 1 1 21 27 30 o 0 1579    93.8  ?      ?    4421.63 125.667      2580.19  125.667     729.655   125.667      
1 1 1 21 29 30 o 0 653.1   94.4  ?      ?    3263.19 139.663      1296.13  139.663     27.3269   139.663      
1 1 1 0  30 22 o 0 3338.7  160.4 ?      ?    7157.59 180          4578.91  180         538.605   180          
1 1 1 2  30 22 o 0 347.7   20.2  ?      ?    2542.41 35.4435      1272.15  35.4435     146.297   -144.557     
1 1 1 4  30 22 o 0 10.1    14.3  ?      ?    1172.81 -86.3776     482.953  93.6224     1128.26   93.6224      
1 1 1 6  30 22 o 0 225.4   18.2  ?      ?    1013.51 36.2427      1067.69  36.2427     518.877   36.2427      
1 1 1 8  30 22 o 0 410.7   23.8  ?      ?    1729.79 -131.982     1783.96  -131.982    840.467   -131.982     
1 1 1 10 30 22 o 0 186.3   18.5  ?      ?    2319.08 -161.244     526.102  -161.244    713.164   18.7562      
1 1 1 12 30 22 o 0 242.2   22.1  ?      ?    1668.5  25.9852      1006.81  25.9852     135.605   25.9852      
1 1 1 14 30 22 o 0 547.3   31.8  ?      ?    2507.16 20.1523      1851.56  20.1523     576.364   20.1523      
1 1 1 16 30 22 f 1 548.3   34.8  ?      ?    2011.51 47.5587      1922.86  47.5587     906.467   47.5587      
1 1 1 18 30 22 o 0 795.3   45.3  ?      ?    2757.39 31.6295      2247.62  31.6295     908.299   31.6295      
1 1 1 20 30 22 f 1 517.7   44.2  ?      ?    2790.08 110.919      1429.47  110.919     117.986   110.919      
1 1 1 22 30 22 o 0 357.2   43.6  ?      ?    3428.94 -84.789      624.697  -84.789     907.59    95.211       
1 1 1 22 24 30 o 0 50.6    46.3  ?      ?    1418.47 73.508       221.672  -106.492    838.768   -106.492     
1 1 1 22 26 30 o 0 533.4   60.7  ?      ?    2352.2  -145.92      1388.71  -145.92     400.552   -145.92      
1 1 1 22 28 30 o 0 1711.6  111   ?      ?    4813.52 82.9297      2513.52  82.9297     632.449   82.9297      
1 1 1 1  30 23 f 1 70.5    19.9  ?      ?    1525.69 -39.5831     3.94453  140.417     877.843   140.417      
1 1 1 3  30 23 o 0 83.9    16.9  ?      ?    1885.27 -95.7048     18.1221  -95.7048    1042.6    84.2952      
1 1 1 5  30 23 o 0 690.2   29.5  ?      ?    2681.26 81.7882      2374.51  81.7882     901.986   81.7882      
1 1 1 7  30 23 o 0 689.3   30.8  ?      ?    3524.07 -88.3007     1939.2   -88.3007    36.0001   -88.3007     
1 1 1 9  30 23 f 1 286.8   23.6  ?      ?    2429.14 -49.6688     975.268  -49.6688    318.998   130.331      
1 1 1 11 30 23 o 0 1669    61.5  ?      ?    4526.65 110.418      3532.95  110.418     1186.27   110.418      
1 1 1 13 30 23 o 0 849.6   40    ?      ?    3125.62 -178.897     2410.15  -178.897    829.321   -178.897     
1 1 1 15 30 23 o 0 989.1   49.2  ?      ?    4455.54 -86.1993     2016.62  -86.1993    213.335   93.8007      
1 1 1 17 30 23 o 0 15.7    29.3  ?      ?    804.272 -94.8876     244.471  85.1124     634.36    85.1124      
1 1 1 19 30 23 o 0 133.1   39.2  ?      ?    598.573 -160.798     234.382  -160.798    45.468    19.2025      
1 1 1 21 30 23 o 0 567.7   47.1  ?      ?    3906.71 -0.233326    1059.22  -0.233326   691.283   179.767      
1 1 1 23 30 23 o 0 273.2   50.1  ?      ?    2734.5  -107.077     548.407  -107.077    621.506   72.9232      
1 1 1 23 25 30 f 1 525.8   66.7  ?      ?    2047.4  150.031      1446.72  150.031     579.947   150.031      
1 1 1 23 27 30 o 0 230.4   75.9  ?      ?    1099.76 65.3498      463.689  65.3498     32.4796   65.3498      
1 1 1 23 29 30 o 0 551.5   109.7 ?      ?    3735.61 -38.2356     865.773  -38.2356    539.821   141.764      
1 1 1 0  30 24 o 0 778.2   49.4  ?      ?    2982.85 -1.51087e-14 2196.87  0           542.276   4.60998e-14  
1 1 1 2  30 24 o 0 1102    42.1  ?      ?    3895.31 155.26       2870.35  155.26      731.907   155.26       
1 1 1 4  30 24 o 0 1166.5  44.1  ?      ?    2272.82 -55.4891     3733.65  -55.4891    2501.89   -55.4891     
1 1 1 6  30 24 o 0 595.6   28.4  ?      ?    2785.12 -153.755     1977.58  -153.755    491.071   -153.755     
1 1 1 8  30 24 o 0 130.1   21    ?      ?    966.394 -175.572     409.608  -175.572    97.1302   4.42847      
1 1 1 10 30 24 f 1 422     26.6  ?      ?    3005.59 76.6185      1234.16  76.6185     318.893   -103.381     
1 1 1 12 30 24 o 0 402.3   27.8  ?      ?    1584.57 31.0337      1644.22  31.0337     848.688   31.0337      
1 1 1 14 30 24 o 0 1003.1  48.4  ?      ?    3425.51 177.734      2502.8   177.734     798.118   177.734      
1 1 1 16 30 24 o 0 827.4   48.4  ?      ?    4644.24 109.367      1498.18  109.367     744.601   -70.6329     
1 1 1 18 30 24 o 0 341.7   41.3  ?      ?    2209.92 -69.875      1075.64  -69.875     44.2532   -69.875      
1 1 1 20 30 24 o 0 -0.7    42.5  ?      ?    1240.75 -81.6618     360.025  98.3382     916.295   98.3382      
1 1 1 22 30 24 o 0 1322.5  74.9  ?      ?    3819.81 121.151      2551.43  121.151     912.057   121.151      
1 1 1 24 30 24 o 0 658.8   69.4  ?      ?    4252.34 -75.8064     1009.22  -75.8064    752.56    104.194      
1 1 1 24 26 30 o 0 157.8   83.2  ?      ?    2660.66 55.4291      15.2117  -124.571    1060.11   -124.571     
1 1 1 24 28 30 o 0 -40.9   96.8  ?      ?    2028.1  -56.1532     382.899  123.847     1148.2    123.847      
1 1 1 1  30 25 o 0 692.5   34    ?      ?    2998.16 121.736      2195.05  121.736     577.333   121.736      
1 1 1 3  30 25 o 0 538     28.4  ?      ?    2514.83 -48.6125     1909.57  -48.6125    567.53    -48.6125     
1 1 1 5  30 25 o 0 73.5    19.5  ?      ?    1536.62 -115.058     33.8744  64.9424     842.793   64.9424      
1 1 1 7  30 25 o 0 163.3   22.4  ?      ?    1694.16 66.2244      567.732  66.2244     309.818   -113.776     
1 1 1 9  30 25 o 0 2.8     21.3  ?      ?    1285.62 -110.83      494.847  69.17       1148.38   69.17        
1 1 1 11 30 25 o 0 610.3   34.5  ?      ?    3758.84 -32.8446     1409.91  -32.8446    493.168   147.155      
1 1 1 13 30 25 o 0 585.6   35.7  ?      ?    2528.09 160.009      1822.13  160.009     573.46    160.009      
1 1 1 15 30 25 o 0 117.3   30.6  ?      ?    1247.82 16.4355      239.384  16.4355     359.783   -163.565     
1 1 1 17 30 25 o 0 357.8   39.1  ?      ?    2691.3  21.8317      933.565  21.8317     315.979   -158.168     
1 1 1 19 30 25 o 0 161.9   43.5  ?      ?    2542.34 -116.031     150.952  -116.031    987.165   63.9692      
1 1 1 21 30 25 f 1 35.7    51.6  ?      ?    1796.98 158.196      350.983  -21.8041    1127.3    -21.8041     
1 1 1 23 30 25 f 1 221.4   64.8  ?      ?    813.645 -116.026     463.087  -116.026    122.856   -116.026     
1 1 1 25 30 25 o 0 333.6   78.4  ?      ?    516.588 44.1225      504.757  44.1225     304.871   44.1225      
1 1 1 25 27 30 o 0 165.2   97.9  ?      ?    1191.16 -91.2016     218.689  -91.2016    231.268   88.7984      
1 1 1 25 29 30 o 0 42.3    127.9 ?      ?    2102.26 16.7258      147.629  -163.274    895.059   -163.274     
1 1 1 0  30 26 o 0 -8.1    35.4  ?      ?    1886.63 -2.6244e-14  80.8564  0           917.115   180          
1 1 1 2  30 26 o 0 -26.1   21.4  ?      ?    332.18  126.448      149.888  -53.5516    324.035   -53.5516     
1 1 1 4  30 26 o 0 369.9   26.6  ?      ?    2257    -27.4064     1367.67  -27.4064    198.279   -27.4064     
1 1 1 6  30 26 o 0 293.5   24.7  ?      ?    1751.24 145.172      1199.97  145.172     305.667   145.172      
1 1 1 8  30 26 o 0 306.1   28.5  ?      ?    1644.67 -157.547     1192.34  -157.547    352.116   -157.547     
1 1 1 10 30 26 o 0 367.5   32.9  ?      ?    2171.18 -45.4536     1266.29  -45.4536    179.071   -45.4536     
1 1 1 12 30 26 o 0 272.5   29.5  ?      ?    1833.97 -96.0106     963.234  -96.0106    65.8288   -96.0106     
1 1 1 14 30 26 o 0 1159.7  53.8  ?      ?    5157.17 49.1908      1953.65  49.1908     503.984   -130.809     
1 1 1 16 30 26 o 0 3863.9  136.7 ?      ?    7272.31 -114.073     4566.57  -114.073    1209.08   -114.073     
1 1 1 18 30 26 o 0 1488.7  81.9  ?      ?    4266.85 93.0168      2749.63  93.0168     846.199   93.0168      
1 1 1 20 30 26 o 0 324.2   55    ?      ?    2035.46 66.4644      898.005  66.4644     12.4923   66.4644      
1 1 1 22 30 26 o 0 190.5   67.4  ?      ?    1190.04 174.021      394.457  174.021     101.049   -5.97886     
1 1 1 24 30 26 o 0 1060.2  93.7  ?      ?    3235.57 58.9186      2074.88  58.9186     817.752   58.9186      
1 1 1 26 30 26 o 0 249.2   103.8 ?      ?    1390.69 -136.083     494.504  -136.083    23.8711   43.9169      
1 1 1 26 28 30 o 0 92.8    122.5 ?      ?    1939.73 171.11       29.2971  -8.89014    719.29    -8.89014     
1 1 1 1  30 27 o 0 156.7   28    ?      ?    2448.32 -60.8712     229.368  -60.8712    1050.76   119.129      
1 1 1 3  30 27 f 1 345.6   29.1  ?      ?    1264.02 -123.352     1402.24  -123.352    744.041   -123.352     
1 1 1 5  30 27 o 0 560.4   33.6  ?      ?    2542.88 -173.905     1805.07  -173.905    504.894   -173.905     
1 1 1 7  30 27 o 0 321.4   31.4  ?      ?    2287.78 152.053      1055.78  152.053     96.0338   -27.9472     
1 1 1 9  30 27 o 0 121.1   28.4  ?      ?    757.333 31.6757      237.468  31.6757     136.893   -148.324     
1 1 1 11 30 27 o 0 1646.6  70.1  ?      ?    4641.81 135.064      3099.45  135.064     853.486   135.064      
1 1 1 13 30 27 o 0 1596.6  68.4  ?      ?    4580.96 -55.8417     2969.28  -55.8417    806.798   -55.8417     
1 1 1 15 30 27 o 0 1786.8  77.3  ?      ?    3656.13 59.3815      3552.73  59.3815     1877.49   59.3815      
1 1 1 17 30 27 f 1 295.9   41.5  ?      ?    1584.7  -129.528     945.807  -129.528    238.786   -129.528     
1 1 1 19 30 27 o 0 620.8   66.1  ?      ?    3963.29 -29.9416     1080.38  -29.9416    638.21    150.058      
1 1 1 21 30 27 o 0 198.9   70.6  ?      ?    1945.43 66.4835      368.937  66.4835     440.442   -113.516     
1 1 1 23 30 27 o 0 1685.8  107.8 ?      ?    4484.68 111.429      2586.25  111.429     840.613   111.429      
1 1 1 25 30 27 o 0 -81.9   95.3  ?      ?    741.665 -131.758     147.848  48.2415     425.593   48.2415      
1 1 1 27 30 27 o 0 275.5   120.2 ?      ?    1435.03 -59.9963     513.873  -59.9963    9.2039    -59.9963     
1 1 1 27 29 30 o 0 1065.9  166.9 ?      ?    3863.24 2.30393      1607.3   2.30393     331.542   2.30393      
1 1 1 0  30 28 o 0 -8.2    41.1  ?      ?    1088.64 180          48.7444  180         507.573   -4.37773e-14 
1 1 1 2  30 28 o 0 340.8   32.5  ?      ?    2031.94 -103.387     1225.52  -103.387    194.892   -103.387     
1 1 1 4  30 28 o 0 450     32.8  ?      ?    2432.43 70.8219      1466.58  70.8219     245.817   70.8219      
1 1 1 6  30 28 o 0 1300.4  56.9  ?      ?    4974.32 -15.7808     2392.68  -15.7808    70.1227   164.219      
1 1 1 8  30 28 o 0 1300.2  60    ?      ?    4013.74 111.002      2788.53  111.002     833.927   111.002      
1 1 1 10 30 28 o 0 1234.6  62.2  ?      ?    3326.62 -28.3706     2905.25  -28.3706    1316.74   -28.3706     
1 1 1 12 30 28 o 0 2549.1  97.3  ?      ?    5599.32 -143.746     3845.17  -143.746    1235.81   -143.746     
1 1 1 14 30 28 o 0 790.1   50.3  ?      ?    4355.37 -140.535     1433.57  -140.535    543.184   39.4649      
1 1 1 16 30 28 o 0 836.4   56.1  ?      ?    3687.36 95.4945      1755.71  95.4945     132.025   95.4945      
1 1 1 18 30 28 o 0 383.3   59.8  ?      ?    2093.13 -114.137     1067.81  -114.137    164.981   -114.137     
1 1 1 20 30 28 o 0 981.5   87.1  ?      ?    2058.24 4.67859      2392.16  4.67859     1538.38   4.67859      
1 1 1 22 30 28 o 0 183.3   76.6  ?      ?    2143.24 38.8168      220.876  38.8168     613.03    -141.183     
1 1 1 24 30 28 o 0 393.7   108.7 ?      ?    2509.15 44.3035      830.193  44.3035     111.64    -135.697     
1 1 1 26 30 28 o 0 1298.9  142.3 ?      ?    4281.01 -142.538     1897.28  -142.538    383.864   -142.538     
1 1 1 28 30 28 o 0 364.2   157.8 ?      ?    4134.99 -49.9538     166.382  -49.9538    1186.74   130.046      
1 1 1 1  30 29 o 0 1550    67.2  ?      ?    3863.83 148.543      3363.63  148.543     1448.88   148.543      
1 1 1 3  30 29 f 1 825.4   43.1  ?      ?    4447.15 168.759      1600.23  168.759     597.566   -11.2413     
1 1 1 5  30 29 o 0 879.5   48.2  ?      ?    3306.41 -72.6892     2220.6   -72.6892    614.373   -72.6892     
1 1 1 7  30 29 o 0 207     30.7  ?      ?    2938.72 -23.4156     284.928  -23.4156    1121.93   156.584      
1 1 1 9  30 29 o 0 312.6   38.8  ?      ?    2089.53 29.9916      970.576  29.9916     10.6579   -150.008     
1 1 1 11 30 29 o 0 556.1   48.4  ?      ?    4037.78 -172.763     1000.69  -172.763    855.954   7.23721      
1 1 1 13 30 29 o 0 103.8   36.1  ?      ?    1804.08 -100.342     4.51976  79.658      813.982   79.658       
1 1 1 15 30 29 o 0 274.7   51.3  ?      ?    1564.01 53.037       845.197  53.037      163.011   53.037       
1 1 1 17 30 29 o 0 1512.1  87.3  ?      ?    6072.33 93.6717      1875.96  93.6717     724.006   -86.3283     
1 1 1 19 30 29 f 1 20.6    66.5  ?      ?    2610.14 -110.078     569.467  69.9216     1652.79   69.9216      
1 1 1 21 30 29 o 0 49.3    93.4  ?      ?    2068.79 -53.6298     225.16   126.37      1028      126.37       
1 1 1 23 30 29 o 0 39.8    96.4  ?      ?    1439.78 -21.8895     122.677  158.11      663.128   158.11       
1 1 1 25 30 29 o 0 281.3   127.6 ?      ?    1745.23 83.8096      520.792  83.8096     97.9346   -96.1904     
1 1 1 27 30 29 o 0 2540.4  207.6 ?      ?    6021.74 -133.009     2635.11  -133.009    653.105   -133.009     
1 1 1 29 30 29 o 0 653.5   206.8 ?      ?    3367.87 23.22        832.807  23.22       207.283   -156.78      
1 1 1 0  30 30 o 0 553.5   64    ?      ?    2052.16 -2.92608e-14 1558.63  0           567.751   5.10682e-14  
1 1 1 2  30 30 f 1 235.3   43.2  ?      ?    2798.14 39.6334      459.155  39.6334     891.486   -140.367     
1 1 1 4  30 30 o 0 614.4   42.3  ?      ?    3788.06 121.264      1303.2   121.264     495.42    -58.7358     
1 1 1 6  30 30 o 0 166.5   34.9  ?      ?    608.84  -161.887     302.632  -161.887    17.1633   -161.887     
1 1 1 8  30 30 o 0 250.6   36.7  ?      ?    2654.53 68.419       535.405  68.419      689.698   -111.581     
1 1 1 10 30 30 f 1 305.9   42.1  ?      ?    1283.56 164.286      1006.41  164.286     421.965   164.286      
1 1 1 12 30 30 o 0 121.1   59.9  ?      ?    3061.89 73.4941      282.269  -106.506    1637.65   -106.506     
1 1 1 14 30 30 o 0 300     52    ?      ?    392.292 66.4372      435.228  66.4372     263.727   66.4372      
1 1 1 16 30 30 o 0 1276.6  80.5  ?      ?    5341.21 -23.7971     1785.06  -23.7971    480.446   156.203      
1 1 1 18 30 30 o 0 373.5   71.1  ?      ?    2140.25 66.9157      966.204  66.9157     89.2046   66.9157      
1 1 1 20 30 30 o 0 644.8   95.1  ?      ?    3896.72 -82.6513     1072.75  -82.6513    452.491   97.3487      
1 1 1 22 30 30 o 0 250.4   104.3 ?      ?    2179.62 155.931      422.21   155.931     394.141   -24.0694     
1 1 1 24 30 30 f 1 879.4   139.1 ?      ?    739.03  -52.8449     1641.77  -52.8449    1378.15   -52.8449     
1 1 1 26 30 30 o 0 799.8   170.2 ?      ?    865.146 111.23       1473.56  111.23      1187.84   111.23       
1 1 1 28 30 30 o 0 -248.5  219.2 ?      ?    1029.52 -174.232     69.3234  5.76817     389.309   5.76817      
1 1 1 0  1  31 o 0 1216.9  54    ?      ?    4806.3  -90          3100.85  -90         7.37736   90           
1 1 1 0  3  31 o 0 6.2     6.7   ?      ?    609.895 -90          18.5486  -90         377.771   90           
1 1 1 0  5  31 o 0 59      8.3   ?      ?    543.845 90           214.752  90          138.88    -90          
1 1 1 0  7  31 o 0 131.8   10.6  ?      ?    1648.59 -90          922.245  -90         145.934   90           
1 1 1 0  9  31 o 0 25.3    7.9   ?      ?    560.869 -90          84.7     -90         271.471   90           
1 1 1 0  11 31 o 0 135.8   11.1  ?      ?    674.793 90           542.892  90          119.531   90           
1 1 1 0  13 31 o 0 217.1   15    ?      ?    725.957 90           847.859  90          399.802   90           
1 1 1 0  15 31 o 0 37.7    10.2  ?      ?    1201.58 -90          246.234  -90         480.205   90           
1 1 1 0  17 31 o 0 272.8   20.8  ?      ?    3200.32 90           1352.58  90          515.582   -90          
1 1 1 0  19 31 o 0 61.5    15.5  ?      ?    834.083 -90          245.178  -90         227.738   90           
1 1 1 0  21 31 o 0 124.4   18.2  ?      ?    749.759 -90          433.221  -90         22.034    -90          
1 1 1 0  23 31 o 0 149.7   22.3  ?      ?    959.211 90           553.466  90          33.7064   90           
1 1 1 0  25 31 o 0 31.1    23.3  ?      ?    1813.5  -90          151.979  -90         790.731   90           
1 1 1 0  27 31 o 0 481.2   53.4  ?      ?    2500.61 90           1531.54  90          267.507   90           
1 1 1 0  29 31 o 0 997.9   79.3  ?      ?    4450.47 90           2116.95  90          23.8691   -90          
1 1 1 0  31 1  o 0 555.9   26.5  ?      ?    2475.28 -90          2154.78  -90         510.307   -90          
1 1 1 1  14 31 o 0 985.5   32.2  ?      ?    3271.22 135.13       3157.71  135.13      1167.59   135.13       
1 1 1 1  16 31 o 0 594.6   22.3  ?      ?    3429.11 -54.9768     1841.02  -54.9768    198.538   125.023      
1 1 1 1  18 31 o 0 479.4   20.8  ?      ?    1896.73 147.205      2113.69  147.205     1026.46   147.205      
1 1 1 1  20 31 o 0 322.6   17.9  ?      ?    2383.34 106.451      1231.01  106.451     93.5598   -73.5491     
1 1 1 1  22 31 f 1 193.5   15.5  ?      ?    3115.94 -20.7976     226.326  -20.7976    1498.43   159.202      
1 1 1 1  24 31 o 0 745.1   32.9  ?      ?    1934.36 -97.3243     2736.86  -97.3243    1713.01   -97.3243     
1 1 1 1  26 31 o 0 473.8   34.6  ?      ?    2265.31 12.6762      1650.28  12.6762     481.564   12.6762      
1 1 1 1  28 31 o 0 927.5   50.1  ?      ?    4755.84 15.9976      1708.17  15.9976     632.289   -164.002     
1 1 1 1  30 31 o 0 436.2   50.4  ?      ?    1957.72 -146.122     1423.07  -146.122    509.117   -146.122     
1 1 1 2  9  31 o 0 911.8   30.6  ?      ?    3678.63 20.8772      2817.23  20.8772     503.765   20.8772      
1 1 1 2  19 31 o 0 917.7   32.8  ?      ?    4812.74 -37.5075     1966.84  -37.5075    738.571   142.493      
1 1 1 2  21 31 o 0 498.1   22.8  ?      ?    3555.05 -123.509     1322.99  -123.509    611.054   56.4908      
1 1 1 2  23 31 o 0 558.4   26.2  ?      ?    1843.43 156.512      2247.11  156.512     1255.65   156.512      
1 1 1 2  25 31 o 0 399.2   27.4  ?      ?    2494.6  104.091      1380.88  104.091     92.9341   104.091      
1 1 1 2  27 31 o 0 940.8   48.1  ?      ?    3469.3  -130.558     2366.67  -130.558    623.78    -130.558     
1 1 1 2  29 31 o 0 349.5   42.6  ?      ?    1744.28 30.8698      1258.98  30.8698     424.542   30.8698      
1 1 1 0  31 3  o 0 768.9   35.2  ?      ?    3047.57 90           2546.72  90          511.851   90           
1 1 1 3  6  31 o 0 1181.4  37.1  ?      ?    3088.66 -73.975      3892.15  -73.975     1914.42   -73.975      
1 1 1 3  10 31 o 0 429.1   15.9  ?      ?    2369.45 54.5673      1868.82  54.5673     394.705   54.5673      
1 1 1 3  16 31 o 0 320.1   14.5  ?      ?    2375.27 9.04391      1300.74  9.04391     97.8071   -170.956     
1 1 1 3  18 31 o 0 199.8   12.5  ?      ?    1695.74 -38.2836     903.568  -38.2836    58.9441   141.716      
1 1 1 3  20 31 o 0 372.8   18.1  ?      ?    2155    155.181      1526.91  155.181     340.52    155.181      
1 1 1 3  22 31 o 0 143.8   14.9  ?      ?    2319.7  -176.725     273.856  -176.725    991.472   3.27459      
1 1 1 3  24 31 o 0 709.7   34.3  ?      ?    2648.01 53.0198      2337.27  53.0198     947.622   53.0198      
1 1 1 3  26 31 o 0 1069.3  47.5  ?      ?    3844.76 164.736      2529.77  164.736     562.055   164.736      
1 1 1 3  28 31 o 0 11.4    37.2  ?      ?    2227.27 -26.9934     696.33   153.007     1784.24   153.007      
1 1 1 3  30 31 o 0 574     45.2  ?      ?    3454.48 -36.4574     1298.83  -36.4574    302.711   143.543      
1 1 1 3  31 4  o 0 1432.5  44.9  ?      ?    4343.5  -138.89      3824.63  -138.89     989.733   -138.89      
1 1 1 4  5  31 o 0 555.2   18.8  ?      ?    1855.83 54.6081      2642.89  54.6081     1458.33   54.6081      
1 1 1 4  11 31 o 0 769.9   26.3  ?      ?    3684.56 -63.1584     2332.53  -63.1584    67.9095   -63.1584     
1 1 1 4  13 31 o 0 831.3   28.3  ?      ?    3146.49 64.6964      2775.35  64.6964     872.956   64.6964      
1 1 1 4  15 31 o 0 680.9   25    ?      ?    2611.04 -123.361     2548.01  -123.361    1001.28   -123.361     
1 1 1 4  19 31 o 0 227.8   14.2  ?      ?    1783.01 100.794      1012.92  100.794     21.2503   100.794      
1 1 1 4  21 31 f 1 1188.6  42.2  ?      ?    2774.93 -9.13215     3519.81  -9.13215    2017.35   -9.13215     
1 1 1 4  23 31 o 0 36.8    17.8  ?      ?    1157.84 -162.872     283.056  17.1284     899.542   17.1284      
1 1 1 4  25 31 f 1 232.5   18.4  ?      ?    2322.36 0.0872346    735.032  0.0872346   459.106   -179.913     
1 1 1 4  27 31 o 0 1843.1  73.1  ?      ?    4948.71 29.9973      3371.03  29.9973     907.965   29.9973      
1 1 1 4  29 31 o 0 236.5   35.2  ?      ?    2362.66 -156.645     586.313  -156.645    532.27    23.3548      
1 1 1 0  31 5  o 0 402.2   22.2  ?      ?    2683.79 90           1842.64  90          49.1936   90           
1 1 1 2  31 5  f 1 658     22.1  ?      ?    2935.01 139.262      2504.39  139.262     563.075   139.262      
1 1 1 5  20 31 o 0 693     29.4  ?      ?    3977.12 -130.757     1725.58  -130.757    438.743   49.2434      
1 1 1 5  22 31 o 0 412.5   24.5  ?      ?    2426.85 127.984      1522.11  127.984     213.361   127.984      
1 1 1 5  24 31 f 1 431     31.1  ?      ?    2633.95 68.2417      1438.95  68.2417     64.3655   68.2417      
1 1 1 5  26 31 o 0 395.4   36.1  ?      ?    3262.02 -146.844     946.056  -146.844    705.211   33.156       
1 1 1 5  28 31 o 0 405.3   35.1  ?      ?    2563.73 14.3059      1216.49  14.3059     22.4488   -165.694     
1 1 1 5  30 31 o 0 295.8   40    ?      ?    2078.15 -168.57      886.425  -168.57     67.0751   11.4305      
1 1 1 1  31 6  f 1 1791.5  53.6  ?      ?    4053.93 28.5844      4859.85  28.5844     2160.31   28.5844      
1 1 1 3  31 6  o 0 508     16.9  ?      ?    3365.27 -22.2302     1678.71  -22.2302    513.928   157.77       
1 1 1 5  31 6  o 0 485.5   16.8  ?      ?    1957.12 174.378      2335.4   174.378     1081.16   174.378      
1 1 1 6  15 31 o 0 251.8   13.7  ?      ?    2782.05 163.681      759.198  163.681     868.706   -16.3187     
1 1 1 6  17 31 o 0 447.1   21.1  ?      ?    3332.09 -55.8841     1299.31  -55.8841    583.8     124.116      
1 1 1 6  19 31 f 1 44.7    13    ?      ?    141.657 154.357      12.3129  -25.6435    90.5548   -25.6435     
1 1 1 6  21 31 o 0 1146.8  43.5  ?      ?    4774.1  77.0744      2500.86  77.0744     127.869   -102.926     
1 1 1 6  23 31 o 0 1327.4  52.4  ?      ?    4373.75 -59.463      2998.43  -59.463     698.703   -59.463      
1 1 1 6  25 31 f 1 1391.5  59.7  ?      ?    4049.06 107.535      3145.91  107.535     1089.7    107.535      
1 1 1 6  27 31 o 0 2622.2  101.8 ?      ?    4870.32 -152.745     4499.05  -152.745    2104.69   -152.745     
1 1 1 6  29 31 o 0 114.1   28.3  ?      ?    1496.43 140.557      135.918  140.557     563.99    -39.4431     
1 1 1 0  31 7  o 0 1884.3  77.3  ?      ?    4826.95 -90          3969.97  -90         755.594   -90          
1 1 1 4  31 7  f 1 589.8   20.9  ?      ?    2133.96 74.017       2654.62  74.017      1271.25   74.017       
1 1 1 7  8  31 o 0 395     16    ?      ?    2330.43 177.496      1722.11  177.496     288.896   177.496      
1 1 1 7  10 31 o 0 1312.7  43.2  ?      ?    4559.43 -179.232     3237.65  -179.232    465.182   -179.232     
1 1 1 7  14 31 o 0 280.9   14    ?      ?    3110.3  112.876      738.723  112.876     1089.07   -67.1238     
1 1 1 7  16 31 o 0 136     13.2  ?      ?    1743.63 -123.573     480.275  -123.573    511.095   56.4272      
1 1 1 7  18 31 o 0 110.6   14.3  ?      ?    1065.55 170.259      390.606  170.259     199.235   -9.74072     
1 1 1 7  20 31 o 0 541.5   25.4  ?      ?    3176.42 -64.8303     1632.66  -64.8303    72.5647   115.17       
1 1 1 7  22 31 o 0 72.5    18.8  ?      ?    2283.48 -85.0752     266.956  94.9248     1481.58   94.9248      
1 1 1 7  24 31 o 0 215.5   27.2  ?      ?    2109.5  -143.699     728.619  -143.699    351.072   36.3013      
1 1 1 7  26 31 o 0 88.1    34    ?      ?    1442.3  -9.61746     7.827    -9.61746    712.254   170.383      
1 1 1 7  28 31 o 0 907     56.9  ?      ?    4759.13 174.772      1606.16  174.772     662.181   -5.22812     
1 1 1 7  30 31 o 0 1161.2  65.3  ?      ?    4335.21 -13.4159     2193.51  -13.4159    231.574   -13.4159     
1 1 1 3  31 8  o 0 600.8   22    ?      ?    3513.32 152.542      1952.3   152.542     295.678   -27.4585     
1 1 1 5  31 8  o 0 690     25    ?      ?    3865.3  -82.2375     2021.18  -82.2375    410.764   97.7625      
1 1 1 8  11 31 o 0 1040.3  36.8  ?      ?    2884.4  46.7094      3463.29  46.7094     1732.95   46.7094      
1 1 1 8  17 31 o 0 476.7   22.4  ?      ?    2789.65 140.671      1655.7   140.671     101.292   140.671      
1 1 1 8  19 31 o 0 98.8    15.2  ?      ?    980.001 156.333      296.305  156.333     234.191   -23.6674     
1 1 1 8  21 31 o 0 128.5   18    ?      ?    833.635 148.939      387.513  148.939     60.4149   -31.0608     
1 1 1 8  23 31 o 0 133.3   26.3  ?      ?    2359.66 74.3132      172.946  74.3132     1049.27   -105.687     
1 1 1 8  25 31 o 0 754.6   45.4  ?      ?    2740.88 -171.217     2244.52  -171.217    857.134   -171.217     
1 1 1 8  27 31 o 0 2092.9  91.5  ?      ?    4886.91 8.33127      3685.52  8.33127     1319.54   8.33127      
1 1 1 8  29 31 o 0 612.9   60.7  ?      ?    1266.93 -59.651      1987.96  -59.651     1404.45   -59.651      
1 1 1 0  31 9  o 0 934.5   42.5  ?      ?    3430.71 -90          2777     -90         538.079   -90          
1 1 1 6  31 9  o 0 470.8   18.4  ?      ?    3298.75 -157.624     1530.28  -157.624    517.784   22.3765      
1 1 1 9  16 31 o 0 368     20.1  ?      ?    2864.87 128.061      1208.39  128.061     396.574   -51.9392     
1 1 1 9  18 31 o 0 924.8   39.9  ?      ?    3891.27 -74.21       2397.62  -74.21      276.296   -74.21       
1 1 1 9  20 31 o 0 24.7    18.2  ?      ?    300.692 16.7045      87.0238  -163.296    251.591   -163.296     
1 1 1 9  22 31 o 0 162.5   22    ?      ?    1027.81 57.2151      607.102  57.2151     69.1408   57.2151      
1 1 1 9  24 31 o 0 1085    51.2  ?      ?    3968.06 68.7244      2560.4   68.7244     562.607   68.7244      
1 1 1 9  26 31 o 0 163.9   39.4  ?      ?    2562.08 136.049      210.366  136.049     1047.56   -43.9514     
1 1 1 9  28 31 o 0 73.9    45.1  ?      ?    1990.91 -20.5991     250.185  159.401     1181.78   159.401      
1 1 1 9  30 31 o 0 424.2   43.4  ?      ?    2002.66 -179.475     1311.14  -179.475    420.197   -179.475     
1 1 1 5  31 10 o 0 627.5   22.4  ?      ?    2518.22 -111.864     2546.65  -111.864    978.27    -111.864     
1 1 1 10 13 31 o 0 402.9   18.9  ?      ?    3185.55 -60.8826     1227.74  -60.8826    623       119.117      
1 1 1 10 15 31 o 0 851.4   33.6  ?      ?    2754.91 157.65       2851.52  157.65      1301.51   157.65       
1 1 1 10 17 31 o 0 279     19.3  ?      ?    2542.31 -156.227     947.866  -156.227    446.199   23.7727      
1 1 1 10 19 31 o 0 1078.4  45.6  ?      ?    2733.34 76.9104      3259.18  76.9104     1803.96   76.9104      
1 1 1 10 21 31 o 0 21.1    19.3  ?      ?    1396.48 -109.416     475.429  70.5838     1213.02   70.5838      
1 1 1 10 23 31 o 0 253.7   30.1  ?      ?    2719.34 -5.27548     676.569  -5.27548    707.336   174.725      
1 1 1 10 25 31 o 0 156.3   33    ?      ?    3120.13 -57.8076     48.022   122.192     1599.14   122.192      
1 1 1 10 27 31 o 0 818     53.9  ?      ?    4034.58 62.3679      1720.37  62.3679     197.359   -117.632     
1 1 1 10 29 31 o 0 1491.1  83.3  ?      ?    4549.23 -140.928     2672.28  -140.928    615.848   -140.928     
1 1 1 0  31 11 o 0 301.5   17.8  ?      ?    1643.09 -90          1517.94  -90         458.861   -90          
1 1 1 2  31 11 o 0 718.1   25.4  ?      ?    2616.31 28.0904      2849.95  28.0904     1189.96   28.0904      
1 1 1 10 31 11 o 0 564.6   22    ?      ?    2487.08 100.029      2216.11  100.029     748.635   100.029      
1 1 1 11 12 31 f 1 404.9   17.5  ?      ?    2506.16 -99.051      1578.37  -99.051     111.528   -99.051      
1 1 1 11 14 31 o 0 213.5   14.2  ?      ?    1003.94 8.11144      1044.93  8.11144     478.258   8.11144      
1 1 1 11 16 31 o 0 870.3   34.4  ?      ?    3225.17 102.355      2617.98  102.355     841.136   102.355      
1 1 1 11 18 31 f 1 154.9   18.2  ?      ?    2225.13 110.148      402.578  110.148     796.198   -69.8517     
1 1 1 11 20 31 o 0 83.4    20.6  ?      ?    1381.69 -115.204     77.3159  -115.204    658.153   64.7963      
1 1 1 11 22 31 o 0 244.7   29.8  ?      ?    3468.83 -48.0669     311.612  -48.0669    1470.31   131.933      
1 1 1 11 24 31 o 0 19.1    31.7  ?      ?    586.453 118.073      170.906  -61.927     465.67    -61.927      
1 1 1 11 26 31 o 0 639.6   49    ?      ?    3170.66 -84.4998     1666.55  -84.4998    140.298   -84.4998     
1 1 1 11 28 31 o 0 477.6   54.4  ?      ?    2578.06 -110.622     1337.04  -110.622    154.835   -110.622     
1 1 1 11 30 31 o 0 1462.2  90    ?      ?    6089.93 11.9702      1848.41  11.9702     842.517   -168.03      
1 1 1 12 13 31 o 0 946     36.8  ?      ?    3336.62 -144.129     2827.55  -144.129    940.104   -144.129     
1 1 1 12 15 31 o 0 673.5   28.3  ?      ?    3718.94 35.7338      1826.46  35.7338     229.785   -144.266     
1 1 1 12 17 31 o 0 99.6    15.9  ?      ?    1811.14 11.6997      170.265  11.6997     804.891   -168.3       
1 1 1 12 19 31 o 0 782     37    ?      ?    3311.83 103.98       2284.69  103.98      510.307   103.98       
1 1 1 12 21 31 o 0 749     38.6  ?      ?    3022.78 -108.735     2249.99  -108.735    684.711   -108.735     
1 1 1 12 23 31 o 0 784.7   45.9  ?      ?    4290.71 155.63       1634.13  155.63      543.173   -24.3705     
1 1 1 12 25 31 o 0 610.7   44.7  ?      ?    4284.07 35.2494      1120.93  35.2494     964.382   -144.751     
1 1 1 12 27 31 o 0 370.6   50.6  ?      ?    1291.09 172.496      1267.06  172.496     667.417   172.496      
1 1 1 12 29 31 o 0 782.6   69.7  ?      ?    3016.11 110.944      1894.35  110.944     560.833   110.944      
1 1 1 0  31 13 o 0 598.7   31    ?      ?    2797.76 90           2158.74  90          385.743   90           
1 1 1 6  31 13 o 0 324     14.4  ?      ?    2875.78 129.237      1093.44  129.237     641.511   -50.7626     
1 1 1 10 31 13 o 0 470.8   19.3  ?      ?    2951.11 107.616      1611.74  107.616     100.306   -72.3839     
1 1 1 13 14 31 o 0 62.4    13.7  ?      ?    1445.28 -28.7882     57.05    151.212     858.143   151.212      
1 1 1 13 16 31 o 0 30.5    14.5  ?      ?    1109.06 81.3432      293.237  -98.6568    892.689   -98.6568     
1 1 1 13 18 31 o 0 882.7   39.6  ?      ?    2220.63 -60.3804     3048.62  -60.3804    1852.57   -60.3804     
1 1 1 13 20 31 o 0 739.8   37.7  ?      ?    3563.9  121.544      1991.77  121.544     133.843   121.544      
1 1 1 13 22 31 o 0 1112.3  56.5  ?      ?    3673.36 -100.128     2749.31  -100.128    902.716   -100.128     
1 1 1 13 24 31 o 0 1282    64    ?      ?    4157.41 38.3865      2712.73  38.3865     669.364   38.3865      
1 1 1 13 26 31 o 0 168.1   50.5  ?      ?    1765.53 163.667      447.587  163.667     382.913   -16.3329     
1 1 1 13 28 31 o 0 195.6   56.8  ?      ?    2569.34 1.88983      300.954  1.88983     849.676   -178.11      
1 1 1 13 30 31 o 0 766.9   83.4  ?      ?    1914.32 83.6253      2085.03  83.6253     1259.42   83.6253      
1 1 1 1  31 14 o 0 834.1   29.9  ?      ?    3291.7  -84.6483     2784.03  -84.6483    734.375   -84.6483     
1 1 1 5  31 14 o 0 339.4   16.9  ?      ?    3295.6  -29.9998     936.118  -29.9998    1050.38   150          
1 1 1 9  31 14 f 1 418.8   17.9  ?      ?    1799.05 82.0486      1950.65  82.0486     900.451   82.0486      
1 1 1 11 31 14 o 0 628.2   25.3  ?      ?    3705.48 -2.55702     1722.76  -2.55702    360.929   177.443      
1 1 1 13 31 14 o 0 492.3   24    ?      ?    3232.02 167.463      1473.33  167.463     300.765   -12.537      
1 1 1 14 15 31 o 0 221.8   18.3  ?      ?    3842.14 -73.8107     37.891   -73.8107    2044.41   106.189      
1 1 1 14 17 31 o 0 458.9   27.3  ?      ?    3332.89 119.985      1288.35  119.985     514.07    -60.0146     
1 1 1 14 19 31 o 0 376.6   26.7  ?      ?    1957.92 -24.4782     1515.45  -24.4782    489.186   -24.4782     
1 1 1 14 21 31 o 0 683.9   42.3  ?      ?    2843.28 64.5882      2100.18  64.5882     661.046   64.5882      
1 1 1 14 23 31 o 0 1703.7  78.8  ?      ?    5874.96 -121.569     2685.83  -121.569    225.729   58.4311      
1 1 1 14 25 31 o 0 635.9   53.1  ?      ?    3532.53 26.4043      1483.43  26.4043     194.549   -153.596     
1 1 1 14 27 31 o 0 1110.5  72    ?      ?    4401.68 126.738      2068.21  126.738     74.6741   126.738      
1 1 1 14 29 31 o 0 3665.1  145   ?      ?    7678.94 -82.7754     3838.11  -82.7754    483.661   -82.7754     
1 1 1 0  31 15 o 0 538.6   28.9  ?      ?    3296.02 -90          2004.24  -90         39.8833   90           
1 1 1 6  31 15 o 0 289.6   15    ?      ?    1587.5  -64.9938     1493.83  -64.9939    555.539   -64.9939     
1 1 1 8  31 15 o 0 1471.7  51.2  ?      ?    5218.61 142.685      3081.47  142.685     85.1558   142.685      
1 1 1 10 31 15 o 0 1605.1  56    ?      ?    5246.55 -61.1743     3271.52  -61.1743    320.778   -61.1743     
1 1 1 12 31 15 o 0 53.9    12.8  ?      ?    1518.93 8.04998      158.898  -171.95     993.767   -171.95      
1 1 1 14 31 15 o 0 889.2   36.7  ?      ?    3759.55 153.604      2332.96  153.604     319.265   153.604      
1 1 1 15 16 31 o 0 162     19.4  ?      ?    1342.32 -10.8801     719.722  -10.8801    15.3207   169.12       
1 1 1 15 18 31 o 0 12.8    19.2  ?      ?    1047.68 12.3945      390.611  -167.606    942.056   -167.606     
1 1 1 15 20 31 o 0 21.1    24.4  ?      ?    1295.84 43.5815      397.512  -136.419    1057.04   -136.419     
1 1 1 15 22 31 o 0 887.5   47.5  ?      ?    2347.29 100.533      2690.59  100.533     1519.24   100.533      
1 1 1 15 24 31 o 0 11.4    28.1  ?      ?    1483.34 39.5944      482.987  -140.406    1193.47   -140.406     
1 1 1 15 26 31 o 0 657.5   50    ?      ?    4438.05 -58.4526     1092.79  -58.4526    936.926   121.547      
1 1 1 15 28 31 o 0 1420.1  79.2  ?      ?    5701.72 124.935      1988.04  124.935     496.301   -55.0646     
1 1 1 15 30 31 o 0 771.2   71.2  ?      ?    3899.81 -159.02      1397.86  -159.02     237.377   20.98        
1 1 1 1  31 16 o 0 945     33.5  ?      ?    3874.94 115.24       2706.25  115.24      349.531   115.24       
1 1 1 3  31 16 o 0 454.3   19    ?      ?    3066.77 -32.3805     1538.37  -32.3805    298.913   147.619      
1 1 1 5  31 16 o 0 1030.2  39.4  ?      ?    3683.39 -159.8       2947.54  -159.8      776.997   -159.8       
1 1 1 7  31 16 o 0 334.5   17    ?      ?    2424.4  53.0492      1302.24  53.0492     86.7169   -126.951     
1 1 1 11 31 16 o 0 281.8   17.2  ?      ?    1376.65 -159.839     1369.7   -159.839    613.172   -159.839     
1 1 1 13 31 16 o 0 193.8   18.2  ?      ?    2583.95 24.6077      484.576  24.6077     901.054   -155.392     
1 1 1 15 31 16 o 0 55.5    16.4  ?      ?    957.58  22.9174      29.376   -157.083    546.656   -157.083     
1 1 1 16 17 31 o 0 544.7   31    ?      ?    2739.39 174.025      1814.11  174.025     368.103   174.025      
1 1 1 16 19 31 o 0 468.1   32.6  ?      ?    1844.71 20.2904      1839.83  20.2904     897.016   20.2904      
1 1 1 16 21 31 o 0 98.9    24.3  ?      ?    780.799 -179.019     137.072  -179.019    254.719   0.981486     
1 1 1 16 23 31 o 0 64.5    29.6  ?      ?    1206.11 -17.739      109.953  162.261     691.636   162.261      
1 1 1 16 25 31 o 0 390.3   40.2  ?      ?    517.275 43.496       870.551  43.496      632.014   43.496       
1 1 1 16 27 31 f 1 69.2    41.2  ?      ?    1908.41 -150.568     252.002  29.4318     1096.37   29.4318      
1 1 1 16 29 31 o 0 1879    103.3 ?      ?    4753.15 64.1049      2906.07  64.1049     890.691   64.1049      
1 1 1 0  31 17 o 0 214.3   19.7  ?      ?    2290.54 90           1201.72  90          168.022   -90          
1 1 1 2  31 17 o 0 573.3   23.4  ?      ?    3338.44 -81.0507     1818.03  -81.0508    150.827   98.9492      
1 1 1 4  31 17 o 0 697.9   26.6  ?      ?    2919.94 84.4735      2410.28  84.4735     714.759   84.4735      
1 1 1 6  31 17 o 0 28      12.4  ?      ?    1385.94 3.07562      432.903  -176.924    1224.02   -176.924     
1 1 1 10 31 17 o 0 466     21.9  ?      ?    2050.09 -115.948     1917.75  -115.948    793.016   -115.948     
1 1 1 12 31 17 o 0 780.6   33.1  ?      ?    3606.11 28.6772      2126.85  28.6772     193.923   28.6772      
1 1 1 14 31 17 o 0 -2.3    16.7  ?      ?    1706.18 167.951      762.677  -12.0493    1676.47   -12.0493     
1 1 1 16 31 17 o 0 1304    54.7  ?      ?    5361.38 -92.7013     2430     -92.7013    357.382   87.2987      
1 1 1 17 18 31 o 0 2378.9  92.2  ?      ?    5500.57 28.424       4166.41  28.424      1347.19   28.424       
1 1 1 17 20 31 o 0 1799.3  78.8  ?      ?    4619.96 -133.51      3493.18  -133.51     1165.38   -133.51      
1 1 1 17 22 31 f 1 198.2   32.9  ?      ?    4501.31 74.1909      438.072  -105.809    2633.15   -105.809     
1 1 1 17 24 31 o 0 473.1   44    ?      ?    2508.8  -137.276     1368.32  -137.276    203.529   -137.276     
1 1 1 17 26 31 o 0 1329    75.5  ?      ?    3841.75 13.2129      2642.96  13.2129     938.906   13.2129      
1 1 1 17 28 31 o 0 45.2    54.8  ?      ?    1006.88 120.592      151.69   -59.4077    582.719   -59.4077     
1 1 1 17 30 31 o 0 476.3   74.5  ?      ?    2396.42 -100.639     1165.86  -100.639    212.263   -100.639     
1 1 1 3  31 18 o 0 247.7   14.3  ?      ?    1554.24 -137.408     1225.63  -137.408    328.782   -137.408     
1 1 1 5  31 18 o 0 679.4   26.3  ?      ?    3166.35 -39.5304     2178.17  -39.5304    380.201   -39.5304     
1 1 1 7  31 18 o 0 398.6   20.7  ?      ?    1260.2  -42.2599     1917.2   -42.2599    1214.25   -42.2599     
1 1 1 9  31 18 o 0 713.5   29.2  ?      ?    2836.29 157.363      2357.01  157.363     805.892   157.363      
1 1 1 11 31 18 f 1 55.9    15.7  ?      ?    1336.27 70.3711      93.0912  -109.629    811.961   -109.629     
1 1 1 13 31 18 o 0 723.8   34.1  ?      ?    2352.17 -22.8174     2549.07  -22.8174    1290.05   -22.8174     
1 1 1 15 31 18 o 0 1531    61.4  ?      ?    4376.34 -175.16      3363.76  -175.16     1086.06   -175.16      
1 1 1 17 31 18 o 0 1186.3  52.2  ?      ?    5341.74 -79.4903     2127.22  -79.4903    565.78    100.51       
1 1 1 18 19 31 o 0 2311    91.4  ?      ?    6062.66 77.3157      3605.62  77.3157     542.639   77.3157      
1 1 1 18 21 31 o 0 374.3   31.9  ?      ?    2829.56 44.3304      1015.36  44.3304     362.218   -135.67      
1 1 1 18 23 31 o 0 804.1   53.9  ?      ?    3761.67 -50.3997     1757.45  -50.3997    1.69395   -50.3997     
1 1 1 18 25 31 o 0 -24.4   58.8  ?      ?    692.104 -172.327     181.134  7.67265     490.168   7.67265      
1 1 1 18 27 31 o 0 477.6   58.6  ?      ?    1784.13 -66.9205     1411.9   -66.9205    642.02    -66.9205     
1 1 1 18 29 31 f 1 1163.7  92.3  ?      ?    3082.95 143.868      2363.45  143.868     1092.91   143.868      
1 1 1 0  31 19 o 0 33.7    19.2  ?      ?    825.247 90           105.359  90          373.109   -90          
1 1 1 2  31 19 o 0 294.1   17.3  ?      ?    3204.74 167.639      736.584  167.639     1097.64   -12.361      
1 1 1 4  31 19 o 0 331.1   18.2  ?      ?    2516.19 -32.0695     1226.03  -32.0695    192.873   147.93       
1 1 1 6  31 19 f 1 359.1   20    ?      ?    1550.87 -161.028     1689.77  -161.028    824.869   -161.028     
1 1 1 8  31 19 o 0 741.4   30.5  ?      ?    2117.12 -91.1365     2743.86  -91.1365    1591.52   -91.1365     
1 1 1 10 31 19 o 0 1804.3  66    ?      ?    4975.93 162.353      3606.98  162.353     954.592   162.353      
1 1 1 12 31 19 o 0 795.1   35.8  ?      ?    3686.37 -90.7595     2134.24  -90.7595    165.469   -90.7595     
1 1 1 14 31 19 o 0 121.2   20.8  ?      ?    579.343 51.5812      266.354  51.5812     34.9662   -128.419     
1 1 1 16 31 19 o 0 656.1   36.7  ?      ?    3736.26 98.409       1622.08  98.409      263.68    -81.591      
1 1 1 18 31 19 o 0 559.5   36.7  ?      ?    2267.12 139.695      1851.13  139.695     725.627   139.695      
1 1 1 19 20 31 o 0 2955.1  123.5 ?      ?    6398.5  -62.5865     4176.96  -62.5865    1054      -62.5865     
1 1 1 19 22 31 o 0 183.2   34.6  ?      ?    2357.24 -134.455     371.868  -134.455    734.204   45.5455      
1 1 1 19 24 31 o 0 464     50.4  ?      ?    2364.1  73.6324      1339.63  73.6324     278.642   73.6324      
1 1 1 19 26 31 o 0 1201.4  83.5  ?      ?    4567.11 171.025      2011.97  171.025     28.5251   171.025      
1 1 1 19 28 31 o 0 1608.6  101.2 ?      ?    5171.8  32.3052      2296.29  32.3052     160.375   32.3052      
1 1 1 19 30 31 o 0 393.9   86.4  ?      ?    1831.5  -174.776     1019.55  -174.776    307.625   -174.776     
1 1 1 1  31 20 o 0 47.7    15.5  ?      ?    1381    -153.679     192.565  26.3207     974.943   26.3207      
1 1 1 3  31 20 o 0 150.6   16.4  ?      ?    1886.89 -69.6927     525.963  -69.6927    528.742   110.307      
1 1 1 5  31 20 o 0 90.1    15.4  ?      ?    944.613 83.3809      237.007  83.3809     282.894   -96.6191     
1 1 1 7  31 20 o 0 1419.7  51.7  ?      ?    5779.08 -169.793     2513.42  -169.793    612.122   10.2072      
1 1 1 9  31 20 o 0 884.5   36.3  ?      ?    2562.76 -35.6703     2963.35  -35.6703    1555.87   -35.6703     
1 1 1 11 31 20 o 0 106.9   18.6  ?      ?    1609.7  100.671      219.752  100.671     636.625   -79.3292     
1 1 1 13 31 20 o 0 190.7   21.4  ?      ?    1295.91 168.561      778.97   168.561     106.56    168.561      
1 1 1 15 31 20 o 0 447.6   30.7  ?      ?    1944.52 92.7046      1716.4   92.7046     735.635   92.7046      
1 1 1 17 31 20 o 0 508.9   34.6  ?      ?    3278.66 -92.486      1296.2   -92.486     333.56    87.514       
1 1 1 19 31 20 o 0 198.9   32    ?      ?    1476.61 -45.1623     667.644  -45.1623    40.0424   134.838      
1 1 1 20 21 31 o 0 1841.4  80.7  ?      ?    5404.39 153.949      2978.03  153.949     436.478   153.949      
1 1 1 20 23 31 o 0 1632.8  80.9  ?      ?    5941.36 16.9363      2297.34  16.9363     378.512   -163.064     
1 1 1 20 25 31 o 0 735.7   62.2  ?      ?    3016.86 16.5667      1712.88  16.5667     396.368   16.5667      
1 1 1 20 27 31 o 0 1549.5  96.7  ?      ?    5141.86 -1.38799     2238.01  -1.38799    101.395   -1.38799     
1 1 1 20 29 31 o 0 -82.5   84.3  ?      ?    1345.15 5.28858      322.874  -174.711    849.671   -174.711     
1 1 1 0  31 21 o 0 663.1   41.7  ?      ?    2159.36 90           2023.96  90          815.785   90           
1 1 1 2  31 21 o 0 698.5   28.4  ?      ?    3656.09 5.1504       1934.3   5.1504      87.3029   -174.85      
1 1 1 4  31 21 f 1 346.4   20    ?      ?    3334.38 -133.766     855.063  -133.766    973.216   46.2343      
1 1 1 6  31 21 o 0 546.2   25.6  ?      ?    2968.07 -172.615     1807.84  -172.615    158.772   -172.615     
1 1 1 8  31 21 o 0 65.9    16.8  ?      ?    693.047 -178.172     14.0958  -178.172    360.301   1.82828      
1 1 1 10 31 21 o 0 114.7   19.1  ?      ?    992.373 -22.0731     321.431  -22.0731    203.614   157.927      
1 1 1 12 31 21 o 0 168.7   22.1  ?      ?    1215.66 69.3976      651.391  69.3976     23.1898   69.3976      
1 1 1 14 31 21 o 0 533     32.3  ?      ?    3161.65 -152.039     1512.88  -152.039    77.8601   27.9609      
1 1 1 16 31 21 o 0 255.7   29.5  ?      ?    1652.08 125.101      941.244  125.101     120.528   125.101      
1 1 1 18 31 21 o 0 1164.9  57    ?      ?    3714.29 -124.891     2620.08  -124.891    837.302   -124.891     
1 1 1 20 31 21 o 0 1892.1  89.7  ?      ?    5426.63 35.2057      2986.85  35.2057     481.767   35.2057      
1 1 1 21 22 31 f 1 1185.8  63.3  ?      ?    5097.7  -133.472     1899.55  -133.472    413.733   46.5281      
1 1 1 21 24 31 o 0 2280.3  104.9 ?      ?    5941.17 -35.9363     3043.25  -35.9363    442.309   -35.9363     
1 1 1 21 26 31 o 0 565.8   62.8  ?      ?    2315.99 68.1339      1469.16  68.1339     502.455   68.1339      
1 1 1 21 28 31 o 0 1799    120.1 ?      ?    4938.41 -108.264     2568.07  -108.264    648.619   -108.264     
1 1 1 21 30 31 o 0 1257.8  125.1 ?      ?    3012.28 28.5506      2337.72  28.5506     1220.19   28.5506      
1 1 1 1  31 22 f 1 1313.5  47.1  ?      ?    3263.78 -101.608     3720.92  -101.608    1883.52   -101.608     
1 1 1 3  31 22 o 0 965.6   37.7  ?      ?    3769.87 120.936      2620.71  120.936     536.358   120.936      
1 1 1 5  31 22 o 0 471.3   24.1  ?      ?    2117.72 -179.525     1879.95  -179.525    726.202   -179.525     
1 1 1 7  31 22 o 0 157.9   19.1  ?      ?    1309.04 -56.5098     609.503  -56.5098    91.6153   123.49       
1 1 1 9  31 22 o 0 812     35.7  ?      ?    3292.19 103.488      2329.09  103.488     599.807   103.488      
1 1 1 11 31 22 o 0 45.7    20.5  ?      ?    859.498 -85.0697     138.667  94.9303     580.252   94.9303      
1 1 1 13 31 22 o 0 1027.9  46.7  ?      ?    4319.58 66.1108      2260.43  66.1108     96.2456   66.1108      
1 1 1 15 31 22 o 0 2724.5  105   ?      ?    5815.03 -101.905     4222.83  -101.905    1341.15   -101.905     
1 1 1 17 31 22 f 1 1077.9  56    ?      ?    2934.01 78.0981      2764.58  78.0981     1349.03   78.0981      
1 1 1 19 31 22 o 0 243.3   38.5  ?      ?    2278.36 -93.4725     664.122  -93.4725    389.48    86.5275      
1 1 1 21 31 22 f 1 -48.4   45.4  ?      ?    696.184 172.99       234.052  -7.0101     544.171   -7.0101      
1 1 1 22 23 31 o 0 173     49    ?      ?    1133.74 175.048      411.753  175.048     78.5292   -4.95196     
1 1 1 22 25 31 o 0 661.4   69.6  ?      ?    1499.98 145.169      1856.38  145.169     1228.52   145.169      
1 1 1 22 27 31 o 0 100.9   76.1  ?      ?    1332.72 -110.963     2.32755  -110.963    517.805   69.0366      
1 1 1 22 29 31 f 1 109.2   96.2  ?      ?    2521.76 166.94       150.984  -13.0601    1101.75   -13.0601     
1 1 1 0  31 23 o 0 619.5   43.9  ?      ?    2737.74 -90          1945.99  -90         436.872   -90          
1 1 1 2  31 23 o 0 235.7   20.8  ?      ?    2303.4  173.856      812.145  173.856     444.216   -6.14382     
1 1 1 4  31 23 o 0 721.6   31.5  ?      ?    4258.27 114.973      1664.52  114.973     627.853   -65.0273     
1 1 1 6  31 23 o 0 1059.2  42.9  ?      ?    4403.52 38.3296      2422.91  38.3296     88.9286   38.3296      
1 1 1 8  31 23 o 0 548.5   30.3  ?      ?    2168.31 177.716      2031.71  177.716     902.978   177.716      
1 1 1 10 31 23 o 0 -14.9   19.9  ?      ?    728.385 -162.005     313.58   17.9949     684.989   17.9949      
1 1 1 12 31 23 o 0 1287.1  52.4  ?      ?    5565.9  -109.501     2138.39  -109.501    682.753   70.4991      
1 1 1 14 31 23 o 0 724.5   40.9  ?      ?    5022.77 41.1021      1100.42  41.1021     1377.99   -138.898     
1 1 1 16 31 23 o 0 17.7    31.5  ?      ?    813.005 16.2445      231.395  -163.755    620.503   -163.755     
1 1 1 18 31 23 o 0 115.3   34.9  ?      ?    426.027 36.3922      95.0937  36.3922     101.569   -143.608     
1 1 1 20 31 23 o 0 1028.2  66.1  ?      ?    4731.62 141.571      1736.16  141.571     364.072   -38.429      
1 1 1 22 31 23 o 0 1640.2  84    ?      ?    5550.05 6.76066      2333.64  6.76066     23.3576   -173.239     
1 1 1 23 24 31 o 0 1271.5  82.9  ?      ?    3635.39 144.117      2410.08  144.117     886.703   144.117      
1 1 1 23 26 31 o 0 1912.1  106.5 ?      ?    4822.24 -116.317     2775.92  -116.317    889.399   -116.317     
1 1 1 23 28 31 o 0 691.4   104.4 ?      ?    3576.42 88.2667      1225.17  88.2667     120.612   -91.7333     
1 1 1 23 30 31 o 0 -63.9   129   ?      ?    909.259 -53.7216     98.7346  126.278     420.673   126.278      
1 1 1 1  31 24 o 0 30.8    22.4  ?      ?    916.062 -97.0312     249.26   82.9688     741.019   82.9688      
1 1 1 3  31 24 o 0 61.8    20.2  ?      ?    2023.36 -114.235     278.994  65.7645     1352.99   65.7645      
1 1 1 5  31 24 f 1 847     35.9  ?      ?    3060.95 -6.38042     2509.95  -6.38042    898.569   -6.38042     
1 1 1 7  31 24 o 0 174.3   23.6  ?      ?    778.262 -154.704     590.881  -154.704    190.14    -154.704     
1 1 1 9  31 24 o 0 66.5    22.3  ?      ?    1692.82 4.9641       146.485  -175.036    1001.62   -175.036     
1 1 1 11 31 24 o 0 335.4   27.9  ?      ?    2966.83 173.83       846.092  173.83      646.004   -6.16957     
1 1 1 13 31 24 o 0 923.4   45.4  ?      ?    4158.5  152.486      1966.42  152.486     73.0191   -27.5144     
1 1 1 15 31 24 o 0 780.2   46.1  ?      ?    3828.33 -36.1125     1726.8   -36.1125    97.623    143.887      
1 1 1 17 31 24 o 0 458     42.6  ?      ?    2398.18 3.48099      1348.65  3.48099     244.101   3.48099      
1 1 1 19 31 24 o 0 811.7   61.5  ?      ?    2814.55 109.792      2042.76  109.792     793.487   109.792      
1 1 1 21 31 24 o 0 438.2   59.2  ?      ?    1949.61 -112.082     1267.57  -112.082    426.059   -112.082     
1 1 1 23 31 24 o 0 -80     59.7  ?      ?    437.626 -175.016     131.211  4.98444     311.446   4.98444      
1 1 1 24 25 31 o 0 879.4   82.3  ?      ?    1735.64 47.4493      2158.8   47.4493     1479.37   47.4493      
1 1 1 24 27 31 o 0 13.8    100.4 ?      ?    1268.04 -135.584     133.431  44.4164     611.501   44.4164      
1 1 1 24 29 31 o 0 717.8   136.3 ?      ?    3461.65 -126.311     1221.39  -126.311    8.22675   53.6888      
1 1 1 0  31 25 o 0 646.6   53.4  ?      ?    2889.02 -90          1899.38  -90         376.842   -90          
1 1 1 2  31 25 o 0 296.3   25.6  ?      ?    3212.26 90.7403      671.576  90.7403     1005.76   -89.2597     
1 1 1 4  31 25 f 1 159.4   24.1  ?      ?    1047.28 -108.09      584.393  -108.09     41.0435   -108.09      
1 1 1 6  31 25 f 1 189.1   23.7  ?      ?    1349.1  -51.1144     752.021  -51.1144    62.359    -51.1144     
1 1 1 8  31 25 o 0 1033.6  49.6  ?      ?    5300.1  -121.372     1743.32  -121.372    951.04    58.6276      
1 1 1 10 31 25 o 0 329.6   31.5  ?      ?    2793.12 40.6908      885.465  40.6908     505.777   -139.309     
1 1 1 12 31 25 o 0 607.3   37.8  ?      ?    3177.59 64.148       1595.95  64.148      49.9437   64.148       
1 1 1 14 31 25 o 0 14.2    30.3  ?      ?    1176.79 134.24       354.696  -45.7601    912.051   -45.7601     
1 1 1 16 31 25 o 0 1391.8  67.9  ?      ?    3995.73 -175.817     2779.95  -175.817    947.35    -175.817     
1 1 1 18 31 25 o 0 197.6   45.6  ?      ?    1751.96 -60.9899     515.836  -60.9899    260.187   119.01       
1 1 1 20 31 25 o 0 584.6   62.1  ?      ?    2974.86 -51.7539     1355.23  -51.7539    70.8189   -51.7539     
1 1 1 22 31 25 o 0 57.9    55    ?      ?    2598.79 88.921       469.069  -91.079     1542.43   -91.079      
1 1 1 24 31 25 o 0 177.3   81.4  ?      ?    1547.19 -26.472      266.58   -26.472     329.411   153.528      
1 1 1 25 26 31 o 0 204.3   99.3  ?      ?    1758.62 94.2968      331.53   94.2968     331.564   -85.7032     
1 1 1 25 28 31 o 0 22.9    123.3 ?      ?    1125.1  178.668      52.8779  -1.33243    453.091   -1.33243     
1 1 1 25 30 31 o 0 227.4   175.4 ?      ?    1249.23 -94.7972     355.396  -94.7972    57.5844   85.2028      
1 1 1 1  31 26 o 0 482.1   34.1  ?      ?    2763.39 -40.3622     1497.89  -40.3622    56.766    -40.3622     
1 1 1 3  31 26 o 0 683.6   36.7  ?      ?    2785.92 121.507      2080.91  121.507     642.56    121.507      
1 1 1 5  31 26 o 0 1079.4  46.2  ?      ?    4094.05 147.98       2425.5   147.98      338.962   147.98       
1 1 1 7  31 26 o 0 423.4   34.2  ?      ?    3010.81 -27.4915     1143.41  -27.4915    366.996   152.508      
1 1 1 9  31 26 o 0 109.4   30.7  ?      ?    812.596 75.5512      187.501  75.5512     212.592   -104.449     
1 1 1 11 31 26 o 0 1511.7  69.1  ?      ?    3175.34 15.6244      3498.3   15.6244     1968.56   15.6244      
1 1 1 13 31 26 o 0 28.4    30.1  ?      ?    748.284 -177.974     183.908  2.02619     535.463   2.02619      
1 1 1 15 31 26 o 0 30.3    37.5  ?      ?    973.538 -74.3973     229.072  105.603     672.833   105.603      
1 1 1 17 31 26 o 0 904.4   59.1  ?      ?    2976.22 133.086      2171.05  133.086     858.116   133.086      
1 1 1 19 31 26 o 0 586.3   60.6  ?      ?    3093.01 -87.7566     1316.02  -87.7566    16.9767   92.2434      
1 1 1 21 31 26 o 0 -191.7  62.1  ?      ?    369.897 -155.686     127.278  24.3137     280.153   24.3137      
1 1 1 23 31 26 o 0 1065    96.9  ?      ?    3570.69 -38.6164     1963.74  -38.6164    583.736   -38.6164     
1 1 1 25 31 26 o 0 322.2   105.8 ?      ?    1058.48 -123.657     682.584  -123.657    289.204   -123.657     
1 1 1 26 27 31 o 0 1358    147.3 ?      ?    2619.91 81.7529      2481     81.7529     1549.48   81.7529      
1 1 1 26 29 31 o 0 143.6   160.6 ?      ?    839.545 65.776       161.313  65.776      116.474   -114.224     
1 1 1 0  31 27 o 0 5.9     44.5  ?      ?    414.898 -90          25.0006  -90         186.775   90           
1 1 1 2  31 27 o 0 147.3   29    ?      ?    1238.01 -94.5577     432.648  -94.5577    194.343   85.4423      
1 1 1 4  31 27 o 0 187.2   28.8  ?      ?    938.672 -31.0273     601.762  -31.0273    131.542   -31.0273     
1 1 1 6  31 27 o 0 178.1   29.7  ?      ?    1262.88 -88.2481     589.857  -88.2481    34.0196   91.7519      
1 1 1 8  31 27 o 0 735.3   43.9  ?      ?    2960.33 160.316      2018.99  160.316     581.098   160.316      
1 1 1 10 31 27 o 0 1043.1  56.1  ?      ?    3033.63 -164.475     2639.19  -164.475    1194.89   -164.475     
1 1 1 12 31 27 o 0 -7.8    34.7  ?      ?    461.002 48.8261      155.538  -131.174    369.644   -131.174     
1 1 1 14 31 27 o 0 1462.2  69.4  ?      ?    3975.97 81.3787      2865.93  81.3787     1068.25   81.3787      
1 1 1 16 31 27 f 1 1294.1  67.9  ?      ?    3338.77 -83.2487     2740.29  -83.2487    1268.09   -83.2487     
1 1 1 18 31 27 o 0 281.2   51.9  ?      ?    1659.51 23.1673      798.789  23.1673     86.3707   23.1673      
1 1 1 20 31 27 o 0 599.9   70.9  ?      ?    2393.91 -74.8118     1507.96  -74.8118    520.087   -74.8118     
1 1 1 22 31 27 o 0 496.2   82.9  ?      ?    1901.14 -143.99      1285.57  -143.99     550.054   -143.99      
1 1 1 24 31 27 o 0 524.3   106.8 ?      ?    2946.18 -39.5513     1040.76  -39.5513    58.3192   140.449      
1 1 1 26 31 27 o 0 826.6   132.1 ?      ?    1765.35 101.869      1805.84  101.869     1185.89   101.869      
1 1 1 27 28 31 o 0 -97.7   172.4 ?      ?    1182.47 46.5         67.1536  -133.5      458.007   -133.5       
1 1 1 1  31 28 o 0 354.8   39.5  ?      ?    1521    144.721      1364.34  144.721     610.655   144.721      
1 1 1 3  31 28 o 0 789.3   46    ?      ?    3909.63 50.1012      1765.98  50.1012     154.467   -129.899     
1 1 1 5  31 28 o 0 1139.3  52    ?      ?    3460.15 -163.325     2710.15  -163.325    1030.63   -163.325     
1 1 1 7  31 28 o 0 275.8   36.1  ?      ?    1447.49 144.099      1015.55  144.099     323.434   144.099      
1 1 1 9  31 28 o 0 1045.1  58.6  ?      ?    3185.49 -119.709     2522.31  -119.709    1028.82   -119.709     
1 1 1 11 31 28 o 0 2239.2  94.4  ?      ?    5697.42 23.782       3335.03  23.782      720.521   23.782       
1 1 1 13 31 28 o 0 2793.8  109.4 ?      ?    6473.39 -123.681     3613.17  -123.681    715.734   -123.681     
1 1 1 15 31 28 o 0 984.8   60.5  ?      ?    3198.17 98.5847      2217.14  98.5847     826.169   98.5847      
1 1 1 17 31 28 o 0 445.5   53    ?      ?    1426    102.947      1339.02  102.947     730.486   102.947      
1 1 1 19 31 28 o 0 207.2   77.6  ?      ?    2901.81 147.272      136.969  147.272     1056.13   -32.7275     
1 1 1 21 31 28 o 0 1368.1  114.3 ?      ?    3883.76 -107.027     2330.44  -107.027    829.652   -107.027     
1 1 1 23 31 28 o 0 427.5   102.8 ?      ?    1423.76 170.594      1077.42  170.594     545.495   170.594      
1 1 1 25 31 28 o 0 1390.7  148.4 ?      ?    4710.02 -7.81232     1880.39  -7.81232    219.228   -7.81232     
1 1 1 27 31 28 o 0 919.4   172.6 ?      ?    3806.58 99.62        1378.14  99.62       132.32    99.62        
1 1 1 28 29 31 o 0 1044    212.6 ?      ?    5384.67 -96.26       958.154  -96.26      719.354   83.74        
1 1 1 0  31 29 o 0 -16.8   54.8  ?      ?    81.4173 -90          4.36693  -90         34.9997   90           
1 1 1 2  31 29 o 0 688.4   49.3  ?      ?    2691.27 -50.5994     1983.2   -50.5994    690.169   -50.5994     
1 1 1 4  31 29 o 0 1800.7  73.7  ?      ?    5405.47 46.1493      2940.11  46.1493     372.038   46.1493      
1 1 1 6  31 29 o 0 1893    78.3  ?      ?    5164.23 -156.2       3148.91  -156.2      727.111   -156.2       
1 1 1 8  31 29 o 0 535.5   46.5  ?      ?    2788.09 64.7925      1441.8   64.7924     155.35    64.7924      
1 1 1 10 31 29 o 0 3291.4  128.7 ?      ?    6272.27 -80.234      4306.73  -80.234     1468.63   -80.234      
1 1 1 12 31 29 o 0 729     59.1  ?      ?    2824.5  109.379      1845.95  109.379     596.972   109.379      
1 1 1 14 31 29 o 0 125.4   44.6  ?      ?    340.52  -40.6791     68.4266  -40.6791    80.2189   139.321      
1 1 1 16 31 29 o 0 55      47.7  ?      ?    601.532 -83.4802     76.1291  96.5198     330.78    96.5198      
1 1 1 18 31 29 f 1 210.1   68.8  ?      ?    3216.5  37.4713      51.8238  37.4713     1270.48   -142.529     
1 1 1 20 31 29 o 0 916.2   105   ?      ?    3234.42 -110.522     1827.84  -110.522    565.416   -110.522     
1 1 1 22 31 29 f 1 1798.6  139.4 ?      ?    7299.44 98.702       1594.98  98.702      1145.33   -81.298      
1 1 1 24 31 29 o 0 2536.9  168.6 ?      ?    6727.67 -116.22      2526.47  -116.22     149.106   -116.22      
1 1 1 26 31 29 o 0 1438.4  182   ?      ?    4288.55 3.5236       1973.5   3.5236      563.152   3.5236       
1 1 1 28 31 29 o 0 -6.9    205.2 ?      ?    1627.67 -155.082     4.72012  -155.082    498.81    24.9184      
1 1 1 1  31 30 o 0 284.3   50.4  ?      ?    1701.11 -37.9415     932.651  -37.9415    136.558   -37.9415     
1 1 1 3  31 30 o 0 1459.4  66.8  ?      ?    4847.82 -132.779     2567.81  -132.779    315.789   -132.779     
1 1 1 5  31 30 o 0 1270.5  66.3  ?      ?    4269.85 80.607       2455.91  80.607      493.697   80.607       
1 1 1 7  31 30 o 0 3166.8  119.2 ?      ?    5862.84 -138.282     4354.96  -138.282    1698.57   -138.282     
1 1 1 9  31 30 o 0 1566.1  80.1  ?      ?    5238.94 58.2815      2464.91  58.2815     132.472   58.2815      
1 1 1 11 31 30 o 0 947.1   67.9  ?      ?    3355.8  -141.925     2055.88  -141.925    572.592   -141.925     
1 1 1 13 31 30 o 0 1486.1  83.8  ?      ?    2852.73 -10.738      3111.2   -10.738     1881.01   -10.738      
1 1 1 15 31 30 o 0 492.8   64.5  ?      ?    2618.94 -141.356     1197.28  -141.356    99.7192   -141.356     
1 1 1 17 31 30 o 0 125.8   68.6  ?      ?    1716.89 -52.9487     42.846   -52.9487    639.677   127.051      
1 1 1 19 31 30 o 0 115.8   96.1  ?      ?    429.126 -14.846      50.84    -14.846     115.727   165.154      
1 1 1 21 31 30 o 0 745     121.7 ?      ?    3583.98 -62.258      1287.24  -62.258     39.8814   117.742      
1 1 1 23 31 30 o 0 952.5   145.8 ?      ?    4378.13 51.806       1343.78  51.806      202.735   -128.194     
1 1 1 25 31 30 o 0 747.1   169.7 ?      ?    2505.82 -152.348     1430.08  -152.348    604.008   -152.348     
1 1 1 0  31 31 o 0 220.4   81.7  ?      ?    1311.37 -90          596.224  -90         0.780789  90           
1 1 1 2  31 31 o 0 -35.8   53    ?      ?    1589.85 168.151      491.529  -11.8485    1211.81   -11.8485     
1 1 1 4  31 31 o 0 96      40.7  ?      ?    280.277 78.1195      24.5004  78.1195     101.408   -101.88      
1 1 1 6  31 31 o 0 1178.6  69.1  ?      ?    3393.09 59.3435      2553.61  59.3435     1047.47   59.3435      
1 1 1 8  31 31 o 0 43.3    42.8  ?      ?    851.264 32.3887      159.687  -147.611    536.928   -147.611     
1 1 1 10 31 31 f 1 269.7   47.5  ?      ?    2783.89 161.076      486.117  161.076     731.237   -18.9245     
1 1 1 12 31 31 o 0 155.3   78.8  ?      ?    2985.71 -111.902     115.467  68.0985     1384.71   68.0985      
1 1 1 14 31 31 o 0 -8.5    63.4  ?      ?    1488.35 -163.196     343.925  16.804      960.104   16.804       
1 1 1 16 31 31 o 0 157.9   73.7  ?      ?    1047.24 135.894      204.985  135.894     207.182   -44.106      
1 1 1 18 31 31 o 0 139     86.8  ?      ?    300.273 -115.764     54.436   -115.764    61.2227   64.2357      
1 1 1 20 31 31 o 0 2531.1  163.8 ?      ?    6434.3  132.875      2720.66  132.875     350.564   132.875      
1 1 1 22 31 31 o 0 1954.7  174.3 ?      ?    5064.87 -91.9876     2458.01  -91.9876    673.664   -91.9876     
1 1 1 24 31 31 o 0 1985.4  192.2 ?      ?    5518.01 19.0387      2239.05  19.0387     419.848   19.0387      
1 1 1 0  32 0  o 0 197     18.5  ?      ?    1628.7  8.99203e-14  881.522  0           163.508   -180         
1 1 1 0  2  32 o 0 30.9    8.1   ?      ?    1129.3  180          200.226  180         499.083   -2.59728e-14 
1 1 1 0  4  32 f 1 809.2   36.8  ?      ?    2114.09 180          2459.04  180         1138.81   180          
1 1 1 0  6  32 f 1 10.6    8.4   ?      ?    1522.67 -180         69.0401  180         880.563   1.75219e-14  
1 1 1 0  8  32 o 0 710.1   35.9  ?      ?    3914.27 -3.79948e-15 2287.77  0           126.154   180          
1 1 1 0  10 32 o 0 22.8    9     ?      ?    526.769 180          63.5216  180         258.165   -8.70167e-14 
1 1 1 0  12 32 f 1 -1.1    9.7   ?      ?    495.1   180          9.48053  180         290.327   -1.12489e-14 
1 1 1 0  14 32 o 0 743.2   36.3  ?      ?    2663.01 5.94598e-15  2244.38  0           669.977   -1.39727e-14 
1 1 1 0  16 32 o 0 134.8   14.6  ?      ?    3146.69 180          917.642  180         882.846   -1.47774e-15 
1 1 1 0  18 32 o 0 187.1   19.5  ?      ?    2086.07 180          1023.53  180         138.554   -2.28933e-14 
1 1 1 0  20 32 f 1 12      17.4  ?      ?    883.818 -180         42.2461  180         437.789   8.27152e-15  
1 1 1 0  22 32 o 0 -22.8   19.4  ?      ?    797.142 -1.91913e-14 12.0829  0           414.277   180          
1 1 1 0  24 32 o 0 558.8   39.6  ?      ?    2705.04 -180         1724.09  180         332.905   180          
1 1 1 0  26 32 o 0 214.7   33.2  ?      ?    101.507 -180         79.3973  180         28.5168   180          
1 1 1 0  28 32 o 0 1243.5  93.1  ?      ?    5889.25 -8.13456e-16 2348.76  0           462.564   180          
1 1 1 0  30 32 o 0 417.2   79.7  ?      ?    1523.59 -1.16559e-14 1140.8   0           449.883   1.79008e-14  
1 1 1 1  9  32 f 1 544.3   19.6  ?      ?    3303.68 -69.8321     1772.87  -69.8321    258.733   110.168      
1 1 1 1  13 32 o 0 361.8   14.5  ?      ?    1802.66 -50.1782     1760.45  -50.1782    688.661   -50.1782     
1 1 1 1  19 32 o 0 16.6    11.9  ?      ?    918.126 -82.0984     347.697  97.9016     849.809   97.9016      
1 1 1 1  21 32 o 0 189.1   16.5  ?      ?    1482.23 -32.3735     792.454  -32.3735    12.2038   147.627      
1 1 1 1  23 32 o 0 846.2   35.5  ?      ?    3356.41 121.974      2379.21  121.974     623.054   121.974      
1 1 1 1  25 32 o 0 22.7    18.9  ?      ?    43.2263 67.4917      14.2564  -112.508    36.3517   -112.508     
1 1 1 1  27 32 o 0 442.4   40.1  ?      ?    2819.65 107.193      1253.27  107.193     124.628   -72.8071     
1 1 1 1  29 32 o 0 2943.9  114.2 ?      ?    6323.41 -61.0836     3996.9   -61.0836    1058.95   -61.0836     
1 1 1 1  31 32 o 0 72.7    55.6  ?      ?    1447.35 -178.354     138.326  1.64553     784.935   1.64553      
1 1 1 0  32 2  o 0 -9.9    7.7   ?      ?    23.8825 180          0.208092 180         15.037    -2.30211e-11 
1 1 1 2  8  32 o 0 958.4   32.1  ?      ?    3302.39 128.097      3082.06  128.097     1062.56   128.097      
1 1 1 2  18 32 o 0 844.8   32.8  ?      ?    2639.39 46.2066      2841.61  46.2066     1382.7    46.2066      
1 1 1 2  20 32 f 1 16.9    12.8  ?      ?    1507.49 -35.2987     587.865  144.701     1429.64   144.701      
1 1 1 2  22 32 o 0 381.6   22.3  ?      ?    3103.58 160.984      1086.8   160.984     561.917   -19.0155     
1 1 1 2  24 32 o 0 450.8   26.5  ?      ?    2586.13 -69.8177     1513.83  -69.8177    192.075   -69.8177     
1 1 1 2  26 32 o 0 298     30.1  ?      ?    1474.22 68.8008      1152.63  68.8008     417.833   68.8008      
1 1 1 2  28 32 o 0 580     47.1  ?      ?    3513.94 -130.135     1322.99  -130.135    346.036   49.8648      
1 1 1 2  30 32 o 0 710.1   62.6  ?      ?    2641.85 162.787      1905.12  162.787     712.367   162.787      
1 1 1 3  17 32 o 0 244.8   13.5  ?      ?    1863.77 137.012      1077.07  137.012     37.6397   137.012      
1 1 1 3  19 32 o 0 316.6   16.4  ?      ?    1927.35 -28.3095     1357.83  -28.3095    312.967   -28.3095     
1 1 1 3  21 32 o 0 610.9   26.7  ?      ?    3482.38 -145.461     1717.87  -145.461    156.816   34.5389      
1 1 1 3  23 32 o 0 218     19.4  ?      ?    1509.84 28.0973      908.72   28.0973     124.998   28.0973      
1 1 1 3  25 32 o 0 212.8   25.1  ?      ?    1115.42 -108.994     772.915  -108.994    207.021   -108.994     
1 1 1 3  27 32 o 0 265.7   31.1  ?      ?    2595.11 27.8853      684.678  27.8853     574.638   -152.115     
1 1 1 3  29 32 o 0 1912.5  87.2  ?      ?    5617.46 179.17       2926.76  179.17      333.697   179.17       
1 1 1 3  31 32 o 0 284.9   51.7  ?      ?    2543.45 25.9097      635.836  25.9097     493.69    -154.09      
1 1 1 0  32 4  f 1 44.7    9.2   ?      ?    1424.51 3.23929e-14  359.116  0           558.077   -180         
1 1 1 4  32 4  o 0 591     20    ?      ?    3246.05 90.1774      2011.67  90.1774     2.52201   -89.8226     
1 1 1 4  16 32 o 0 396.7   16.9  ?      ?    1789.36 5.93131      1796.05  5.93131     790.723   5.93131      
1 1 1 4  18 32 o 0 720.7   27.5  ?      ?    3334.17 153.401      2139.19  153.401     314.524   153.401      
1 1 1 4  20 32 o 0 148.7   14    ?      ?    1426.65 76.3638      626.682  76.3638     157.783   -103.636     
1 1 1 4  22 32 o 0 17.6    10.9  ?      ?    475.694 77.2151      178.917  -102.785    429.232   -102.785     
1 1 1 4  24 32 o 0 22.1    12.8  ?      ?    609.288 -163.617     199.934  16.3834     508.494   16.3834      
1 1 1 4  26 32 o 0 1590.7  60.4  ?      ?    5778.27 151.212      2537.36  151.212     317.415   -28.7878     
1 1 1 4  28 32 o 0 288.7   35    ?      ?    2223.31 -7.44588     843.845  -7.44588    203.3     172.554      
1 1 1 4  30 32 f 1 334.3   46.1  ?      ?    3119.25 89.642       657.943  89.642      746.988   -90.358      
1 1 1 5  9  32 o 0 668.7   23.6  ?      ?    3141.54 134.322      2259.51  134.322     375.221   134.322      
1 1 1 5  13 32 f 1 392.5   16.5  ?      ?    2448.43 -68.7559     1558.38  -68.7559    123.603   -68.7559     
1 1 1 5  17 32 o 0 433.8   19.5  ?      ?    809.972 -89.1761     1942.44  -89.1761    1495.66   -89.1761     
1 1 1 5  19 32 o 0 636.8   27.8  ?      ?    2889.74 21.2079      2063.15  21.2079     513.627   21.2079      
1 1 1 5  21 32 o 0 300.7   21.6  ?      ?    2486.03 170.045      1025.43  170.045     298.445   -9.95477     
1 1 1 5  23 32 o 0 891.4   41.1  ?      ?    4596.64 171.959      1861.66  171.959     498.998   -8.04119     
1 1 1 5  25 32 o 0 1239.3  57.7  ?      ?    4534.83 -29.8393     2511.63  -29.8393    234.89    -29.8393     
1 1 1 5  27 32 o 0 117.3   38.7  ?      ?    2925.82 129.505      224.074  -50.4951    1629.45   -50.4951     
1 1 1 5  29 32 o 0 2427.3  98.4  ?      ?    6194.89 21.3532      3352.19  21.3532     520.855   21.3532      
1 1 1 5  31 32 o 0 355.4   53.3  ?      ?    1741.3  -129.97      1071.26  -129.97     305.378   -129.97      
1 1 1 0  32 6  f 1 135.9   11.7  ?      ?    1097.15 180          777.645  180         72.1178   -180         
1 1 1 4  32 6  o 0 928.6   30.1  ?      ?    3411.35 -22.0528     2977.02  -22.0528    863.865   -22.0528     
1 1 1 6  32 6  f 1 636     21.6  ?      ?    2113.3  162.631      2714.74  162.631     1420.57   162.631      
1 1 1 6  14 32 o 0 255     13.3  ?      ?    1457.85 -99.5356     1266.02  -99.5356    438.195   -99.5356     
1 1 1 6  16 32 o 0 685.1   28.5  ?      ?    3524.46 164.241      1967.02  164.241     10.1915   164.241      
1 1 1 6  18 32 o 0 415.2   21.4  ?      ?    3510.28 -35.2698     1040.49  -35.2698    857.666   144.73       
1 1 1 6  20 32 f 1 836.7   34.9  ?      ?    889.767 -134.706     3114.39  -134.706    2632.93   -134.706     
1 1 1 6  22 32 o 0 2673.9  93.6  ?      ?    6225.92 89.9356      4297.01  89.9356     1060.05   89.9356      
1 1 1 6  24 32 o 0 2316.8  85.5  ?      ?    5708.19 -107.342     3818.97  -107.342    911.881   -107.342     
1 1 1 6  26 32 o 0 190.7   35.6  ?      ?    1978.47 77.3514      541.329  77.3514     424.624   -102.649     
1 1 1 6  28 32 o 0 113.5   49.5  ?      ?    1459.43 23.412       98.1078  23.412      581.263   -156.588     
1 1 1 6  30 32 o 0 224     39.9  ?      ?    2142.85 -34.4919     552.013  -34.4919    396.715   145.508      
1 1 1 3  32 7  o 0 965.6   30.6  ?      ?    3411.95 -125.052     3098.93  -125.052    972.908   -125.052     
1 1 1 7  13 32 f 1 312.3   14.8  ?      ?    3302.26 -145.961     760.725  -145.961    1150.9    34.0394      
1 1 1 7  17 32 o 0 65.7    15.4  ?      ?    1116.84 21.9353      34.5559  21.9353     573.624   -158.065     
1 1 1 7  19 32 f 1 53.4    16.9  ?      ?    1306.44 -7.89843     113.211  172.102     833.338   172.102      
1 1 1 7  21 32 o 0 1200.7  47.7  ?      ?    4141.6  11.0764      2844.75  11.0764     668.233   11.0764      
1 1 1 7  23 32 o 0 1015.3  45.3  ?      ?    5125.58 177.092      1872.76  177.092     724.698   -2.90783     
1 1 1 7  25 32 o 0 179.6   34.7  ?      ?    2277.71 44.799       399.363  44.799      728.998   -135.201     
1 1 1 7  27 32 o 0 244.1   43.4  ?      ?    3585.44 -89.0174     180.725  -89.0174    1518.65   90.9826      
1 1 1 7  29 32 o 0 1103.1  70.7  ?      ?    2767.55 141.03       2690.56  141.03      1442.39   141.03       
1 1 1 7  31 32 o 0 1605.7  82.8  ?      ?    4182.78 30.3792      2815.5   30.3792     999.954   30.3792      
1 1 1 0  32 8  o 0 15.8    10.3  ?      ?    475.718 -180         34.3472  180         268.144   4.898e-14    
1 1 1 8  10 32 f 1 711.4   25.2  ?      ?    4316.48 64.1586      1686.95  64.1586     856.264   -115.841     
1 1 1 8  14 32 o 0 992.9   35.8  ?      ?    4353.12 150.059      2394.01  150.059     45.3907   -29.9412     
1 1 1 8  16 32 o 0 484.6   24.4  ?      ?    1301.56 0.910561     2200.91  0.910561    1488.07   0.910561     
1 1 1 8  18 32 o 0 180.2   17.8  ?      ?    832.055 -114.683     760.347  -114.683    316.684   -114.683     
1 1 1 8  20 32 f 1 6.5     19    ?      ?    1864.24 129.747      764.858  -50.2527    1759.26   -50.2527     
1 1 1 8  22 32 f 1 536.9   30.7  ?      ?    3732.02 -151.184     1283.13  -151.184    639.973   28.8161      
1 1 1 8  24 32 o 0 477     36.5  ?      ?    2495.52 67.4978      1529.93  67.4978     277.599   67.4978      
1 1 1 8  26 32 o 0 33.6    39.4  ?      ?    1104.22 1.86812      229.842  -178.132    761.001   -178.132     
1 1 1 8  28 32 o 0 233     52.6  ?      ?    1397.7  143.111      721.704  143.111     80.727    143.111      
1 1 1 8  30 32 o 0 461.1   76    ?      ?    1178.82 -98.17       1396.68  -98.1701    875.402   -98.1701     
1 1 1 1  32 9  f 1 752.9   25.4  ?      ?    3011.95 153.367      2707.09  153.367     804.202   153.367      
1 1 1 5  32 9  o 0 493.5   19.5  ?      ?    2761.25 164.46       1877.59  164.46      198.944   164.46       
1 1 1 7  32 9  f 1 372.9   15.8  ?      ?    1878.45 71.0595      1779.94  71.0595     652.03    71.0595      
1 1 1 9  11 32 f 1 609.3   23.9  ?      ?    2103.01 -43.4019     2493.28  -43.4019    1271.34   -43.4019     
1 1 1 9  13 32 o 0 397.7   18    ?      ?    3011.41 13.9976      1262.38  13.9976     430.083   -166.002     
1 1 1 9  15 32 o 0 769.5   31.5  ?      ?    3545.85 127.527      2181.55  127.527     230.728   127.527      
1 1 1 9  17 32 o 0 465.1   24.6  ?      ?    3458.58 18.603       1237.17  18.603      618.422   -161.397     
1 1 1 9  19 32 o 0 97.6    21.1  ?      ?    983.114 -92.7526     211.832  -92.7526    313.74    87.2474      
1 1 1 9  21 32 o 0 169.9   23.8  ?      ?    1381.18 -164.541     653.601  -164.541    60.944    15.4589      
1 1 1 9  23 32 o 0 409.5   31.6  ?      ?    3078.05 125.114      1080.29  125.114     482.011   -54.8856     
1 1 1 9  25 32 o 0 53.2    36.1  ?      ?    338.136 116.059      37.845   -63.941     202.65    -63.941      
1 1 1 9  27 32 o 0 435.6   52.1  ?      ?    2621.39 -31.1664     1213.89  -31.1664    6.38423   148.834      
1 1 1 9  29 32 o 0 -11.4   64.3  ?      ?    853.828 -32.4041     191.265  147.596     569.973   147.596      
1 1 1 9  31 32 o 0 25.6    41.7  ?      ?    2483.5  -141.184     652.624  38.8161     1712.61   38.8161      
1 1 1 0  32 10 o 0 399.7   22.7  ?      ?    2547.86 -180         1750.87  180         146.988   180          
1 1 1 10 12 32 o 0 457.4   20.3  ?      ?    3290.77 -21.6156     1354.22  -21.6156    498.656   158.384      
1 1 1 10 14 32 o 0 5.4     10.9  ?      ?    949.528 -147.436     432.436  32.5637     956.605   32.5637      
1 1 1 10 16 32 f 1 1504.5  55.7  ?      ?    4076.85 131.915      3537.18  131.915     1326.61   131.915      
1 1 1 10 18 32 o 0 718.4   34.2  ?      ?    3029.63 -81.9064     2249.35  -81.9064    619.06    -81.9064     
1 1 1 10 20 32 o 0 1274.1  54.1  ?      ?    2993.14 -18.3323     3514.7   -18.3323    1953.48   -18.3323     
1 1 1 10 22 32 o 0 20.1    24.8  ?      ?    2507.89 86.8498      838.228  -93.1502    2101.35   -93.1502     
1 1 1 10 24 32 o 0 584.4   42.7  ?      ?    2385.05 48.6116      1867.11  48.6116     691.109   48.6116      
1 1 1 10 26 32 f 1 878.8   56.5  ?      ?    3256.24 -129.581     2168.98  -129.581    621.852   -129.581     
1 1 1 10 28 32 o 0 455.7   61.2  ?      ?    2436.91 22.7363      1292.66  22.7363     195.34    22.7363      
1 1 1 10 30 32 o 0 501.4   75.1  ?      ?    2352.68 -83.7822     1341.02  -83.7822    319.753   -83.7822     
1 1 1 7  32 11 o 0 378.3   15.9  ?      ?    2330.52 -144.616     1582.02  -144.616    207.353   -144.616     
1 1 1 9  32 11 f 1 358.3   16.2  ?      ?    1761.38 57.3772      1708.71  57.3772     684.327   57.3772      
1 1 1 11 13 32 o 0 440     20.9  ?      ?    3110.01 -120.735     1356.07  -120.735    364.638   59.265       
1 1 1 11 15 32 o 0 457.8   21.9  ?      ?    3057.34 -57.1275     1416.96  -57.1275    237.714   122.873      
1 1 1 11 17 32 o 0 2163.3  83.4  ?      ?    6314.69 141.632      3605.42  141.632     156.179   141.632      
1 1 1 11 19 32 o 0 874.1   41    ?      ?    4450.52 15.9332      1931.76  15.9332     405.624   -164.067     
1 1 1 11 21 32 o 0 1220.4  54.7  ?      ?    5060.82 -26.9742     2350.16  -26.9742    220.44    153.026      
1 1 1 11 23 32 o 0 590.3   46.7  ?      ?    2386.56 -10.6912     1900.72  -10.6912    712.038   -10.6912     
1 1 1 11 25 32 o 0 390.5   44    ?      ?    2685.08 178.743      1105.2   178.743     178.393   -1.25704     
1 1 1 11 27 32 o 0 61.6    48.4  ?      ?    704.892 -92.2721     64.1138  87.728      385.819   87.728       
1 1 1 11 29 32 o 0 84.4    68.8  ?      ?    1846.45 90.8025      135.777  -89.1975    949.554   -89.1975     
1 1 1 11 31 32 o 0 818.8   92.7  ?      ?    3338.08 -107.125     1687.06  -107.125    291.236   -107.125     
1 1 1 0  32 12 f 1 10.1    13.2  ?      ?    924.625 -5.78019e-14 45.1293  0           531.748   180          
1 1 1 12 32 12 o 0 304.5   15.9  ?      ?    2905.81 159.702      897.595  159.702     698.144   -20.298      
1 1 1 12 14 32 o 0 96.9    13.3  ?      ?    1588.23 145.988      212.573  145.988     649.245   -34.0119     
1 1 1 12 16 32 o 0 43.6    14    ?      ?    1163.29 -147.883     166.318  32.1173     782.365   32.1173      
1 1 1 12 18 32 o 0 1390.1  56.6  ?      ?    4599.07 12.4207      3026.84  12.4207     597.942   12.4207      
1 1 1 12 20 32 f 1 2097.3  83.2  ?      ?    4532.88 166.01       4185.12  166.01      1853.18   166.01       
1 1 1 12 22 32 o 0 1048.8  52.4  ?      ?    3930.32 -125.474     2398.44  -125.474    423.835   -125.474     
1 1 1 12 24 32 f 1 404.4   44    ?      ?    4422.41 91.6777      415.111  91.6777     1732.86   -88.3223     
1 1 1 12 26 32 o 0 181.6   46.2  ?      ?    1829.97 35.0554      444.701  35.0554     400.451   -144.945     
1 1 1 12 28 32 o 0 1617.4  88.2  ?      ?    4507.3  -152.146     2816.31  -152.146    830.355   -152.146     
1 1 1 12 30 32 o 0 550.6   84.6  ?      ?    3619.45 -87.3392     1004.8   -87.3392    531.884   92.6608      
1 1 1 5  32 13 f 1 1269.4  43    ?      ?    4984.82 -156.856     2792.45  -156.856    170.499   23.1443      
1 1 1 9  32 13 o 0 619.1   23.2  ?      ?    1572.12 -50.1544     2663.67  -50.1544    1778.33   -50.1544     
1 1 1 13 32 13 o 0 265.5   17.7  ?      ?    1849.44 107.609      1141.95  107.609     148.086   107.609      
1 1 1 13 15 32 o 0 359.8   20.9  ?      ?    2383.88 17.926       1327.48  17.926      61.4159   17.926       
1 1 1 13 17 32 o 0 146.7   17.3  ?      ?    1713.08 -105.085     474.074  -105.085    434.56    74.9147      
1 1 1 13 19 32 o 0 1073.2  48.8  ?      ?    5106.28 -98.6303     2040.35  -98.6303    586.947   81.3697      
1 1 1 13 21 32 o 0 598.9   39.8  ?      ?    5026.12 54.3934      780.48   54.3934     1763.07   -125.607     
1 1 1 13 23 32 o 0 3638.1  148.4 ?      ?    8327.04 116.712      4058.69  116.712     1.46707   116.712      
1 1 1 13 25 32 o 0 893.2   58.8  ?      ?    4114.71 -70.5954     1808.01  -70.5954    112.079   109.405      
1 1 1 13 27 32 o 0 1445.4  82.6  ?      ?    4296.11 95.63        2666.98  95.63       751.37    95.63        
1 1 1 13 29 32 o 0 -29.8   72.8  ?      ?    111.516 -76.1016     24.8734  103.898     72.8648   103.898      
1 1 1 13 31 32 f 1 838.5   103.9 ?      ?    2776.1  71.9879      1860.55  71.9879     743.819   71.9879      
1 1 1 0  32 14 o 0 69.7    15.2  ?      ?    337.941 180          143.151  180         62.5329   -3.95885e-13 
1 1 1 2  32 14 o 0 793.9   29.1  ?      ?    3737.29 50.8448      2318.59  50.8448     76.5942   50.8448      
1 1 1 4  32 14 o 0 1050.8  37.3  ?      ?    3707.35 109.388      2994.07  109.388     805.258   109.388      
1 1 1 6  32 14 o 0 296     15.7  ?      ?    1171.98 107.688      1516.26  107.688     843.158   107.688      
1 1 1 8  32 14 o 0 455.3   20    ?      ?    793.801 -173.508     2055.55  -173.508    1608.27   -173.508     
1 1 1 12 32 14 o 0 87.1    14.4  ?      ?    820.959 -61.8996     204.99   -61.8996    237.44    118.1        
1 1 1 14 32 14 o 0 423.4   24    ?      ?    1806.66 -34.9383     1770.33  -34.9383    822.12    -34.9383     
1 1 1 14 16 32 o 0 327.9   24.6  ?      ?    1809.12 -39.4513     1384.86  -39.4513    422.357   -39.4513     
1 1 1 14 18 32 o 0 1824.2  73.9  ?      ?    4452.12 161.946      3827.44  161.946     1526.47   161.946      
1 1 1 14 20 32 o 0 1116.5  51.5  ?      ?    3937.51 -84.4417     2625.41  -84.4417    655.936   -84.4417     
1 1 1 14 22 32 o 0 2464.5  106.2 ?      ?    6924.87 -8.13138     3305.33  -8.13138    93.6329   171.869      
1 1 1 14 24 32 o 0 758.4   58.1  ?      ?    2722.35 -11.3723     2104.62  -11.3723    821.05    -11.3723     
1 1 1 14 26 32 o 0 741.9   66.1  ?      ?    4233.63 138.842      1357.78  138.842     549.657   -41.1579     
1 1 1 14 28 32 o 0 1655.1  99    ?      ?    5469.99 -18.149      2370.98  -18.149     11.2836   161.851      
1 1 1 14 30 32 o 0 912.5   97.5  ?      ?    2905.51 -145.382     1998.93  -145.382    797.05    -145.382     
1 1 1 1  32 15 o 0 358     16.6  ?      ?    2107.48 -161.582     1595.37  -161.582    348.473   -161.582     
1 1 1 3  32 15 o 0 361.4   18.4  ?      ?    2855.61 -128.698     1233.92  -128.698    430.525   51.3017      
1 1 1 5  32 15 o 0 515.5   23.1  ?      ?    2263.85 51.4727      2091.06  51.4727     793.187   51.4727      
1 1 1 7  32 15 o 0 322.3   17.5  ?      ?    2050.53 -115.104     1385.77  -115.104    231.388   -115.104     
1 1 1 9  32 15 o 0 284.3   17    ?      ?    1910.55 50.1182      1240.34  50.1182     186.13    50.1182      
1 1 1 11 32 15 o 0 10      13.6  ?      ?    525.327 151.863      212.225  -28.1367    495.694   -28.1367     
1 1 1 13 32 15 o 0 120.1   16.8  ?      ?    895.851 6.17438      419.683  6.17438     51.7637   -173.826     
1 1 1 15 32 15 f 1 514.7   28.5  ?      ?    1945.46 -156.65      2012.96  -156.65     986.4     -156.65      
1 1 1 15 17 32 o 0 202.4   22.9  ?      ?    2945.09 121.734      340.855  121.734     1186.04   -58.2664     
1 1 1 15 19 32 o 0 376.3   30.6  ?      ?    1397.37 173.011      1575.72  173.011     873.601   173.011      
1 1 1 15 21 32 o 0 260.3   28.3  ?      ?    1208.3  -160.236     980.765  -160.236    384.151   -160.236     
1 1 1 15 23 32 f 1 643.4   44.4  ?      ?    4547.35 -99.3888     1053.74  -99.3888    1118.39   80.6112      
1 1 1 15 25 32 f 1 2383.5  116.7 ?      ?    5636.56 -39.0492     3499.58  -39.0492    923.027   -39.0492     
1 1 1 15 27 32 o 0 69.6    65.2  ?      ?    825.443 -157.257     44.997   22.7432     408.227   22.7432      
1 1 1 15 29 32 o 0 961.6   74.2  ?      ?    2778.33 -166.549     2169.88  -166.549    1006.89   -166.549     
1 1 1 15 31 32 o 0 -11.9   72    ?      ?    873.688 156.332      176.954  -23.6675    521.232   -23.6675     
1 1 1 0  32 16 o 0 0       15.4  ?      ?    2075.34 180          56.9947  180         1164.02   -2.14617e-15 
1 1 1 4  32 16 o 0 168.4   14.5  ?      ?    2071.27 53.6647      584.63   53.6647     598.854   -126.335     
1 1 1 6  32 16 o 0 167.9   15.3  ?      ?    1442.4  162.574      760.968  162.574     49.1153   -17.4264     
1 1 1 8  32 16 o 0 126.5   14.3  ?      ?    1017.01 95.5881      497.287  95.5881     63.0997   -84.4119     
1 1 1 10 32 16 f 1 1105.8  41.5  ?      ?    3193.63 -118.176     3140.52  -118.176    1407.97   -118.176     
1 1 1 12 32 16 o 0 150     17.2  ?      ?    2346.31 84.9467      323.246  84.9467     912.799   -95.0533     
1 1 1 14 32 16 o 0 56      18.3  ?      ?    730.678 135.573      45.3856  -44.4266    429.779   -44.4266     
1 1 1 16 32 16 o 0 96.9    20.1  ?      ?    2700.76 -163.799     212.583  16.2014     1590.95   16.2014      
1 1 1 16 18 32 o 0 187.3   27.3  ?      ?    578.724 -58.1497     530.426  -58.1497    238.717   -58.1497     
1 1 1 16 20 32 o 0 990.1   50.9  ?      ?    3812.22 91.0277      2293.56  91.0277     402.652   91.0277      
1 1 1 16 22 32 o 0 512.4   40.1  ?      ?    2147.51 -2.9373      1683.99  -2.9373     657.878   -2.9373      
1 1 1 16 24 32 o 0 1728.1  81.3  ?      ?    4576.95 -177.892     3075.74  -177.892    979.967   -177.892     
1 1 1 16 26 32 o 0 1697.2  87.7  ?      ?    5436.95 -45.6236     2536.87  -45.6236    156.357   -45.6236     
1 1 1 16 28 32 o 0 808.1   69.6  ?      ?    2824.35 102.775      1875.8   102.775     681.368   102.775      
1 1 1 16 30 32 o 0 325.3   71.7  ?      ?    2327.74 58.9196      743.177  58.9196     172.596   -121.08      
1 1 1 1  32 17 o 0 113.9   14.5  ?      ?    1737.39 2.08073      321.838  2.08073     680.069   -177.919     
1 1 1 3  32 17 o 0 104.3   14.4  ?      ?    504.027 159.361      247.916  159.361     38.6168   -20.6392     
1 1 1 5  32 17 o 0 430.3   22.5  ?      ?    2983.37 -28.995      1396.9   -28.995     271.943   151.005      
1 1 1 7  32 17 o 0 150.6   15.6  ?      ?    971.904 66.9663      645.949  66.9663     111.992   66.9663      
1 1 1 9  32 17 o 0 104.4   14.9  ?      ?    828.993 -174.908     318.781  -174.908    127.606   5.09156      
1 1 1 11 32 17 o 0 221.6   19.7  ?      ?    2135.59 51.738       832.469  51.738      332.016   -128.262     
1 1 1 13 32 17 o 0 536.5   29.1  ?      ?    3437.32 -75.9146     1467.11  -75.9146    342.791   104.085      
1 1 1 15 32 17 o 0 1416.7  58.5  ?      ?    4564.87 37.5849      3000.19  37.5849     664.383   37.5849      
1 1 1 17 32 17 o 0 1025.8  48.2  ?      ?    5083.82 148.985      1872.67  148.985     645.579   -31.0151     
1 1 1 17 19 32 o 0 1226.3  60.9  ?      ?    5113.97 -68.1509     2190.94  -68.1509    353.56    111.849      
1 1 1 17 21 32 o 0 290.3   30.6  ?      ?    2145.09 -117.787     932.089  -117.787    97.4544   62.2135      
1 1 1 17 23 32 o 0 37      36.2  ?      ?    910.407 12.474       198.76   -167.526    618.073   -167.526     
1 1 1 17 25 32 o 0 1934    96.8  ?      ?    5516.87 138.703      2866.5   138.703     433.45    138.703      
1 1 1 17 27 32 o 0 1688.6  94.4  ?      ?    4213.85 -49.3663     2871.86  -49.3663    1074.31   -49.3663     
1 1 1 17 29 32 o 0 356.6   68.5  ?      ?    2381.26 57.3462      833.916  57.3462     112.43    -122.654     
1 1 1 17 31 32 o 0 -40.3   81.8  ?      ?    290.113 86.6119      57.2414  -93.3881    167.89    -93.3881     
1 1 1 0  32 18 o 0 4882.4  210.4 ?      ?    8976.61 -5.05343e-15 5605.21  0           471.792   5.49848e-14  
1 1 1 2  32 18 o 0 815     31.7  ?      ?    2843.03 127.389      2722.08  127.389     1117.04   127.389      
1 1 1 4  32 18 o 0 99.9    14.4  ?      ?    1371.01 44.9996      286.906  44.9996     475.648   -135         
1 1 1 6  32 18 o 0 934.8   39    ?      ?    3800.01 -155.106     2477.5   -155.106    399.304   -155.106     
1 1 1 8  32 18 o 0 168.5   17.2  ?      ?    1303.78 -130.285     749.603  -130.285    49.9573   -130.285     
1 1 1 10 32 18 o 0 1136.2  43.1  ?      ?    4186.12 78.3765      2750.85  78.3765     495.142   78.3765      
1 1 1 12 32 18 o 0 1304.3  51.5  ?      ?    4501.92 -146.244     2889.69  -146.244    521.101   -146.244     
1 1 1 14 32 18 o 0 2655.1  100.8 ?      ?    5857.38 -33.6398     4385.08  -33.6398    1385.46   -33.6398     
1 1 1 16 32 18 o 0 425.4   31.4  ?      ?    2770.1  -146.033     1309.24  -146.033    66.5997   33.9669      
1 1 1 18 32 18 o 0 383.2   33    ?      ?    2807.03 130.681      1057.67  130.681     312.816   -49.3188     
1 1 1 18 20 32 o 0 930.9   52.2  ?      ?    3409.03 -125.705     2271.37  -125.705    630.299   -125.705     
1 1 1 18 22 32 o 0 402.3   43.7  ?      ?    3253.18 61.3662      867.731  61.3662     637.115   -118.634     
1 1 1 18 24 32 o 0 853.4   60.4  ?      ?    2704.02 11.7487      2172.05  11.7487     972.726   11.7487      
1 1 1 18 26 32 o 0 1991.2  104.1 ?      ?    5933.43 135.663      2616.57  135.663     67.5297   135.663      
1 1 1 18 28 32 o 0 1568.2  100   ?      ?    3911.54 -49.4362     2690.8   -49.4362    1091.34   -49.4362     
1 1 1 18 30 32 o 0 -2.2    86.2  ?      ?    1718.93 -87.0423     294.819  92.9577     956.939   92.9577      
1 1 1 1  32 19 o 0 1755.2  59.5  ?      ?    5514.36 -47.2071     3406.34  -47.2071    321.035   -47.2071     
1 1 1 3  32 19 o 0 45.7    14.7  ?      ?    1198.94 30.252       161.909  -149.748    823.736   -149.748     
1 1 1 5  32 19 o 0 150.4   17.2  ?      ?    2360.54 156.78       330.019  156.78      952.85    -23.22       
1 1 1 7  32 19 f 1 159.9   18.5  ?      ?    1396.61 148.982      705.141  148.982     71.4841   -31.0181     
1 1 1 9  32 19 o 0 211.2   18.9  ?      ?    2078.28 -54.6126     754.579  -54.6126    361.04    125.387      
1 1 1 11 32 19 o 0 910.1   40    ?      ?    5001.39 38.2985      1748.19  38.2985     876.693   -141.702     
1 1 1 13 32 19 o 0 383.2   26.9  ?      ?    3172.08 143.816      1021.13  143.816     601.803   -36.1841     
1 1 1 15 32 19 o 0 1560.5  65    ?      ?    3979.51 163.661      3449.73  163.661     1471.6    163.661      
1 1 1 17 32 19 o 0 187.1   29.6  ?      ?    1715.35 164.283      587.002  164.283     252.85    -15.7172     
1 1 1 19 32 19 o 0 1516.2  68.9  ?      ?    5404.79 20.7038      2464.82  20.7038     85.0467   -159.296     
1 1 1 19 21 32 o 0 106.5   42.5  ?      ?    1397.02 5.72051      70.1719  5.72051     577.864   -174.279     
1 1 1 19 23 32 o 0 1385.2  76.9  ?      ?    5176.36 -94.8962     2199.61  -94.8962    105.772   85.1038      
1 1 1 19 25 32 o 0 1542.5  89.7  ?      ?    4681.91 -36.2335     2505.79  -36.2335    483.379   -36.2335     
1 1 1 19 27 32 o 0 353.9   69.5  ?      ?    2149.68 37.9045      909.52   37.9045     24.4679   37.9045      
1 1 1 19 29 32 f 1 437.8   89.6  ?      ?    2345.41 -102.043     1037.09  -102.043    121.037   -102.043     
1 1 1 19 31 32 o 0 -198.5  110.9 ?      ?    1200.05 60.1743      277.455  -119.826    716.208   -119.826     
1 1 1 0  32 20 f 1 1250.3  67.1  ?      ?    4920.53 180          2751.38  180         13.6379   180          
1 1 1 2  32 20 f 1 1331.3  47.4  ?      ?    5248.35 -74.8385     2716.55  -74.8385    272.094   105.162      
1 1 1 4  32 20 o 0 188.1   18.1  ?      ?    2752.04 -165.749     394.209  -165.749    1142.2    14.2505      
1 1 1 6  32 20 f 1 1232.9  46.5  ?      ?    3201.79 11.9237      3470.28  11.9237     1718.92   11.9237      
1 1 1 8  32 20 f 1 1565.2  60    ?      ?    3565.78 123.378      3905.39  123.378     1991.05   123.378      
1 1 1 10 32 20 o 0 1188.4  48    ?      ?    3802.58 -148.043     2965.61  -148.043    978.17    -148.043     
1 1 1 12 32 20 f 1 446.9   28.3  ?      ?    3428.77 -16.8426     1122.43  -16.8426    637.039   163.157      
1 1 1 14 32 20 o 0 957.2   45.8  ?      ?    4309.19 99.301       2086.43  99.301      53.4225   -80.699      
1 1 1 16 32 20 o 0 3516.8  134.5 ?      ?    6997.56 3.87229      4580.78  3.87229     1151.68   3.87229      
1 1 1 18 32 20 o 0 518.2   41.7  ?      ?    3465.7  126.619      1182.64  126.619     457.346   -53.381      
1 1 1 20 32 20 o 0 633.3   48.2  ?      ?    3134.9  -107.323     1550.16  -107.323    126.395   -107.323     
1 1 1 20 22 32 o 0 2430.1  105.3 ?      ?    6600.82 161.757      3103.44  161.757     156.203   161.757      
1 1 1 20 24 32 o 0 1535    88.5  ?      ?    4285.19 -168.577     2663.14  -168.577    804.944   -168.577     
1 1 1 20 26 32 f 1 1565.3  104.1 ?      ?    4720.43 -45.1596     2401.72  -45.1596    437.082   -45.1596     
1 1 1 20 28 32 o 0 273.2   90.1  ?      ?    3468.41 -114.492     192.487  -114.492    1163.44   65.5082      
1 1 1 20 30 32 o 0 37.8    99.6  ?      ?    1146.08 50.9512      93.1641  -129.049    515.533   -129.049     
1 1 1 1  32 21 o 0 806.5   33.9  ?      ?    3040.99 101.928      2564.23  101.928     878.77    101.928      
1 1 1 3  32 21 o 0 557.7   27.3  ?      ?    3993.46 -114.883     1320.53  -114.883    865.253   65.1165      
1 1 1 5  32 21 o 0 317.2   22.2  ?      ?    1133.2  -47.2314     1435.62  -47.2314    824.571   -47.2314     
1 1 1 7  32 21 o 0 153.4   20.7  ?      ?    1493.65 149.684      556.84   149.684     234.761   -30.3165     
1 1 1 9  32 21 o 0 278.9   22.8  ?      ?    1678.57 43.4114      1172.94  43.4114     300.771   43.4114      
1 1 1 11 32 21 o 0 485.7   30.7  ?      ?    2116.29 -146.086     1800.14  -146.086    725.022   -146.086     
1 1 1 13 32 21 o 0 1139.2  49.9  ?      ?    3296.45 -23.1603     2885.6   -23.1603    1224.26   -23.1603     
1 1 1 15 32 21 o 0 309.5   32.6  ?      ?    1487.77 173.197      1176.6   173.197     448.263   173.197      
1 1 1 17 32 21 o 0 -7.1    33.2  ?      ?    1243.92 7.76644      421.986  -172.234    1011.21   -172.234     
1 1 1 19 32 21 o 0 1175.1  61.7  ?      ?    4759.26 -175.189     2056.38  -175.189    112.204   4.81129      
1 1 1 21 32 21 o 0 382.5   56.3  ?      ?    2302.56 43.8605      1073.69  43.8605     67.7885   43.8605      
1 1 1 21 23 32 o 0 483.1   57.7  ?      ?    2891.87 32.2375      1128.22  32.2375     128.569   -147.763     
1 1 1 21 25 32 o 0 1260.8  84.9  ?      ?    3967.08 112.825      2247     112.825     599.359   112.825      
1 1 1 21 27 32 o 0 688.5   85    ?      ?    3099.84 -151.733     1442.54  -151.733    224.766   -151.733     
1 1 1 21 29 32 o 0 205.3   112   ?      ?    1920.14 -65.5815     268.545  -65.5815    443.517   114.419      
1 1 1 21 31 32 o 0 173.6   151.1 ?      ?    1661.46 24.0525      261.663  24.0525     320.788   -155.948     
1 1 1 0  32 22 o 0 318.6   37.3  ?      ?    659.026 -4.19456e-14 820.035  0           459.891   3.28478e-14  
1 1 1 2  32 22 o 0 -2.2    19.7  ?      ?    951.131 142.316      409.655  -37.6843    923.893   -37.6843     
1 1 1 4  32 22 o 0 688     30.9  ?      ?    3942.88 101.562      1708.98  101.562     394.608   -78.4377     
1 1 1 6  32 22 o 0 62.8    21.1  ?      ?    2492.9  76.6706      453.888  -103.329    1763.05   -103.329     
1 1 1 8  32 22 f 1 557.2   29.6  ?      ?    3878.72 -99.4657     1285.97  -99.4657    725.249   80.5343      
1 1 1 10 32 22 o 0 348.7   26.9  ?      ?    2513.35 154.714      1154.02  154.714     114.941   -25.2858     
1 1 1 12 32 22 o 0 278.7   28.3  ?      ?    1683.84 -58.7316     1047.37  -58.7316    202.641   -58.7316     
1 1 1 14 32 22 o 0 61.8    27.8  ?      ?    2434.82 -15.4206     463.061  164.579     1651.63   164.579      
1 1 1 16 32 22 o 0 350.4   37.2  ?      ?    2251.16 45.5806      1110.12  45.5806     44.7649   45.5806      
1 1 1 18 32 22 o 0 683.5   50.8  ?      ?    2836    -171.845     1793.77  -171.845    499.96    -171.845     
1 1 1 20 32 22 o 0 942.9   64.5  ?      ?    4612.01 19.4001      1597.81  19.4001     424.236   -160.6       
1 1 1 22 32 22 o 0 98.8    46.9  ?      ?    1370.35 -161.747     7.96096  18.2532     590.45    18.2532      
1 1 1 22 24 32 o 0 562.6   66.5  ?      ?    3920.62 -90.6077     912.322  -90.6077    719.026   89.3923      
1 1 1 22 26 32 o 0 691.7   85.3  ?      ?    3622.02 124.07       1265.66  124.07      142.813   -55.9295     
1 1 1 22 28 32 o 0 177.1   99.2  ?      ?    1541.5  24.2525      232.76   24.2525     341.47    -155.748     
1 1 1 22 30 32 o 0 833     146.1 ?      ?    3893    -81.5048     1296.37  -81.5048    76.4105   98.4952      
1 1 1 1  32 23 o 0 847.1   36.6  ?      ?    3218.43 -118.314     2489.73  -118.314    774.869   -118.314     
1 1 1 3  32 23 o 0 131.4   22.1  ?      ?    1879.15 59.0909      325.248  59.0909     664.587   -120.909     
1 1 1 5  32 23 o 0 497.6   28    ?      ?    2608.54 44.211       1688.07  44.211      333.328   44.211       
1 1 1 7  32 23 o 0 1414.5  56.3  ?      ?    5683.86 156.528      2448.36  156.528     454.445   -23.4718     
1 1 1 9  32 23 o 0 941.2   45.9  ?      ?    2841.78 15.5641      2677.58  15.5641     1229.01   15.5641      
1 1 1 11 32 23 o 0 567.2   34.8  ?      ?    1300.49 -77.7781     2102.94  -77.7781    1454.7    -77.7781     
1 1 1 13 32 23 o 0 492.6   36.4  ?      ?    2704.79 155.677      1450.9   155.677     136.757   155.677      
1 1 1 15 32 23 f 1 419.9   39.3  ?      ?    3018.67 -120.738     1053.99  -120.738    378.561   59.2621      
1 1 1 17 32 23 o 0 459.2   44.9  ?      ?    3224.17 -36.4171     1042.26  -36.4171    427.455   143.583      
1 1 1 19 32 23 o 0 294.8   47.3  ?      ?    2724.22 65.3119      651.163  65.3119     544.966   -114.688     
1 1 1 21 32 23 o 0 940     72.4  ?      ?    3553.51 159.154      1896.83  159.154     380.393   159.154      
1 1 1 23 32 23 f 1 118.4   59.6  ?      ?    1299.6  -174.91      83.6444  -174.91     448.237   5.08953      
1 1 1 23 25 32 o 0 3927.9  175.3 ?      ?    9354.12 -11.0368     3131.37  -11.0368    511.306   168.963      
1 1 1 23 27 32 o 0 732.6   102   ?      ?    3115.36 169.982      1448.57  169.982     278.939   169.982      
1 1 1 23 29 32 o 0 445.3   139.4 ?      ?    2742.99 132.448      799.44   132.448     171.791   -47.5525     
1 1 1 23 31 32 o 0 411.3   181.1 ?      ?    3129.31 -126.317     529.889  -126.317    499.472   53.6833      
1 1 1 0  32 24 o 0 1621.2  89.2  ?      ?    5399.34 180          2994.47  180         166.266   180          
1 1 1 2  32 24 o 0 217.2   24.3  ?      ?    2193.17 -67.3524     719.671  -67.3524    418.312   112.648      
1 1 1 4  32 24 o 0 412.3   28.6  ?      ?    1454.22 -173.357     1737.41  -173.357    992.089   -173.357     
1 1 1 6  32 24 o 0 541.7   30.8  ?      ?    4114.17 26.8116      1059.58  26.8116     1054.32   -153.188     
1 1 1 8  32 24 o 0 1740.1  70.1  ?      ?    5828.96 90.9681      2822.64  90.9681     119.321   -89.0319     
1 1 1 10 32 24 o 0 1642.8  69.7  ?      ?    4711.24 -111.618     3126.88  -111.618    797.917   -111.618     
1 1 1 12 32 24 f 1 15.1    29.3  ?      ?    1667.82 -73.5023     530.883  106.498     1340.43   106.498      
1 1 1 14 32 24 o 0 1282.5  63.6  ?      ?    5741.76 63.0638      1892.35  63.0638     804.29    -116.936     
1 1 1 16 32 24 o 0 218.5   37.7  ?      ?    2017.08 176.838      575.996  176.838     340.926   -3.16235     
1 1 1 18 32 24 o 0 88.9    43.5  ?      ?    1356.8  34.8719      25.3381  -145.128    620.711   -145.128     
1 1 1 20 32 24 o 0 164.3   58.4  ?      ?    1578.05 -19.8506     288.418  -19.8506    386.196   160.149      
1 1 1 22 32 24 o 0 95.5    61.3  ?      ?    968.796 -62.8005     15.5229  -62.8005    380.462   117.2        
1 1 1 24 32 24 o 0 66.6    75.7  ?      ?    1169.57 17.9117      77.76    -162.088    523.379   -162.088     
1 1 1 24 26 32 o 0 998.5   106   ?      ?    4063.19 -66.5078     1631.3   -66.5078    104.348   -66.5078     
1 1 1 24 28 32 f 1 429.4   130.6 ?      ?    1919.4  16.1305      966.105  16.1305     281.076   16.1305      
1 1 1 24 30 32 o 0 3083.5  225   ?      ?    6037.86 156.532      3118.29  156.532     1124.93   156.532      
1 1 1 1  32 25 o 0 495.9   37.3  ?      ?    3231.42 176.341      1331.25  176.341     345.642   -3.65945     
1 1 1 3  32 25 o 0 188     27.7  ?      ?    1196.34 -44.3026     663.611  -44.3026    49.1652   -44.3026     
1 1 1 5  32 25 o 0 497.3   33.7  ?      ?    3869.18 -53.5606     1019.03  -53.5606    942.049   126.439      
1 1 1 7  32 25 o 0 1692.6  66.8  ?      ?    4250.07 4.58064      3455.23  4.58064     1335.57   4.58064      
1 1 1 9  32 25 o 0 266.4   33.6  ?      ?    2454.49 144.131      744.132  144.131     456.89    -35.8688     
1 1 1 11 32 25 o 0 2249.6  87.4  ?      ?    4387.99 -146.968     4094.18  -146.968    1994.15   -146.968     
1 1 1 13 32 25 o 0 332.1   35.1  ?      ?    1747.76 -3.46464     1112.5   -3.46464    298.343   -3.46464     
1 1 1 15 32 25 f 1 104.1   40.6  ?      ?    1124.13 -42.4306     77.6546  -42.4306    433.805   137.569      
1 1 1 17 32 25 o 0 939.4   65.1  ?      ?    3307.48 -10.6592     2100.26  -10.6592    652.762   -10.6592     
1 1 1 19 32 25 o 0 476.9   58    ?      ?    3016.28 120.864      1049.39  120.864     239.595   -59.1363     
1 1 1 21 32 25 o 0 -16.7   70.9  ?      ?    999.909 -21.066      209.775  158.934     619.341   158.934      
1 1 1 23 32 25 o 0 813.8   83    ?      ?    3155.22 -176.451     1639.25  -176.451    431.318   -176.451     
1 1 1 25 32 25 o 0 710.8   97.6  ?      ?    3659.87 178.054      1214.27  178.054     132.397   -1.94631     
1 1 1 25 27 32 o 0 939.2   142.5 ?      ?    3582.1  -51.2563     1576.27  -51.2563    304.415   -51.2563     
1 1 1 25 29 32 o 0 254.2   160.3 ?      ?    1624.05 -82.6931     418.347  -82.6931    118.798   97.3069      
1 1 1 0  32 26 o 0 2264.4  123   ?      ?    6534.2  3.08736e-15  3374.95  0           51.5148   -1.99178e-13 
1 1 1 2  32 26 o 0 1401.2  57.4  ?      ?    4853.37 -165.26      2689.14  -165.26     240.573   -165.26      
1 1 1 4  32 26 o 0 659.7   38.5  ?      ?    3371.47 -173.567     1697.91  -173.567    15.9995   -173.567     
1 1 1 6  32 26 o 0 829.7   43.2  ?      ?    3088.61 -12.6404     2223.97  -12.6404    705.007   -12.6404     
1 1 1 8  32 26 o 0 8.3     33.7  ?      ?    1071.24 120.074      330.115  -59.9264    847.919   -59.9264     
1 1 1 10 32 26 f 1 1613.3  72.4  ?      ?    5223.41 4.45207      2705.19  4.45207     217.364   4.45207      
1 1 1 12 32 26 o 0 961.7   53.4  ?      ?    4515.05 154.014      1766.95  154.014     318.2     -25.9861     
1 1 1 14 32 26 o 0 2172.9  87.8  ?      ?    6610.93 -50.1763     2784.93  -50.1763    185.988   129.824      
1 1 1 16 32 26 o 0 1416.8  75.1  ?      ?    4485.97 150.626      2481.44  150.626     527.33    150.626      
1 1 1 18 32 26 o 0 807.8   64    ?      ?    4620.55 -55.103      1222.35  -55.103     747.352   124.897      
1 1 1 20 32 26 f 1 179.1   68.4  ?      ?    2026.78 -161.025     257.904  -161.025    576.903   18.9754      
1 1 1 22 32 26 o 0 3138.9  165   ?      ?    5960.7  76.5677      3629.76  76.5677     1342.07   76.5677      
1 1 1 24 32 26 o 0 725.5   113.5 ?      ?    2547.1  -86.8148     1568.11  -86.8148    625.959   -86.8148     
1 1 1 26 32 26 o 0 351.2   131.1 ?      ?    2056.04 -145.857     680.68   -145.857    34.886    34.1433      
1 1 1 26 28 32 o 0 1002.5  173.5 ?      ?    4203.84 149.267      1403.29  149.267     12.9798   149.267      
1 1 1 1  32 27 o 0 32.4    40.3  ?      ?    1111.81 110.9        239.418  -69.0995    789.003   -69.0995     
1 1 1 3  32 27 o 0 420.8   37.3  ?      ?    602.61  -20.5102     1238.68  -20.5102    943.495   -20.5102     
1 1 1 5  32 27 o 0 654.5   41    ?      ?    4137.17 124.881      1299.43  124.881     702.457   -55.1189     
1 1 1 7  32 27 o 0 1494.8  68.1  ?      ?    5669.05 -69.8994     2332.59  -69.8994    368.656   110.101      
1 1 1 9  32 27 o 0 77.4    37.6  ?      ?    1585.23 -55.804      138.129  124.196     878.484   124.196      
1 1 1 11 32 27 o 0 909.4   59.6  ?      ?    4069.11 2.84669      1822.88  2.84669     36.4479   -177.153     
1 1 1 13 32 27 o 0 2770.4  109.9 ?      ?    6404.56 151.462      3598.6   151.462     745.401   151.462      
1 1 1 15 32 27 o 0 340.5   48.3  ?      ?    2754.76 -34.1824     756.139  -34.1824    452.396   145.818      
1 1 1 17 32 27 o 0 263.1   55.6  ?      ?    1583.45 102.899      727.336  102.899     55.3787   102.899      
1 1 1 19 32 27 o 0 685.3   74.4  ?      ?    2199.83 -65.3274     1737.88  -65.3274    838.892   -65.3274     
1 1 1 21 32 27 o 0 468.5   85.3  ?      ?    1951.15 50.3778      1212.1   50.3778     452.983   50.3778      
1 1 1 23 32 27 o 0 87.3    100.9 ?      ?    2168.05 -55.3917     121.141  124.608     925.434   124.608      
1 1 1 25 32 27 o 0 203.7   136.2 ?      ?    859.847 162.091      261.638  162.091     39.3408   -17.9093     
1 1 1 27 32 27 o 0 84      162.6 ?      ?    1277.68 35.4036      93.9458  35.4036     320.873   -144.596     
1 1 1 0  32 28 o 0 980.2   80    ?      ?    3758.32 180          2106.27  180         293.593   180          
1 1 1 2  32 28 o 0 253.7   38.6  ?      ?    2025.96 -171.423     764.652  -171.423    205.948   8.57665      
1 1 1 4  32 28 o 0 1636.6  68.9  ?      ?    4954.88 3.67251      2874.18  3.67251     524.231   3.67251      
1 1 1 6  32 28 o 0 593     44    ?      ?    2424.25 -163.712     1752.01  -163.712    617.525   -163.712     
1 1 1 8  32 28 o 0 1051.5  60.6  ?      ?    4073.13 -38.7706     2128.01  -38.7706    253.309   -38.7706     
1 1 1 10 32 28 o 0 5084.7  187.7 ?      ?    7900.49 161.409      5329.31  161.409     1764.8    161.409      
1 1 1 12 32 28 o 0 825.3   66.9  ?      ?    3482.82 16.3856      1807.36  16.3856     272.373   16.3856      
1 1 1 14 32 28 o 0 15.6    44.7  ?      ?    1965.85 108.817      525.399  -71.1825    1380.33   -71.1825     
1 1 1 16 32 28 o 0 558     58.2  ?      ?    3580.13 -121.061     1044.22  -121.061    465.03    58.9394      
1 1 1 18 32 28 o 0 -36.2   64.2  ?      ?    1690.55 -14.9748     436.788  165.025     1124.65   165.025      
1 1 1 20 32 28 o 0 150.4   98.4  ?      ?    790.734 -133.338     157.447  -133.338    149.602   46.6621      
1 1 1 22 32 28 o 0 485.4   123.5 ?      ?    2794.2  -80.2761     957.837  -80.2761    74.1635   99.7239      
1 1 1 24 32 28 f 1 1302.9  148.3 ?      ?    5097.08 155.281      1621.05  155.281     179.275   -24.7186     
1 1 1 26 32 28 o 0 991.3   175.8 ?      ?    2630.06 -78.6583     1788.37  -78.6583    929.109   -78.6583     
1 1 1 1  32 29 o 0 271.7   48.3  ?      ?    2233.14 74.0278      761.109  74.0278     284.045   -105.972     
1 1 1 3  32 29 o 0 408.2   44.5  ?      ?    2847.85 -144.528     1044.15  -144.528    278.385   35.4725      
1 1 1 5  32 29 o 0 1594    72.1  ?      ?    5450.56 -26.2544     2497.89  -26.2544    5.14551   153.746      
1 1 1 7  32 29 o 0 3728.2  141.2 ?      ?    6611.62 134.091      4626.28  134.091     1633.94   134.091      
1 1 1 9  32 29 o 0 226.2   49    ?      ?    1857.53 -20.4728     623.952  -20.4728    201.79    159.527      
1 1 1 11 32 29 o 0 902.2   67.2  ?      ?    3557.8  127.377      1884.85  127.377     315.308   127.377      
1 1 1 13 32 29 o 0 -98.1   47.4  ?      ?    271.95  82.2697      97.0402  -97.7303    214.038   -97.7303     
1 1 1 15 32 29 o 0 -30.6   54    ?      ?    124.201 130.349      34.4289  -49.651     86.3339   -49.651      
1 1 1 17 32 29 o 0 524.2   64.9  ?      ?    3254.47 -114.539     1034.45  -114.539    255.105   65.4605      
1 1 1 19 32 29 f 1 180.1   95.8  ?      ?    2698.75 57.8874      58.8133  57.8874     990.721   -122.113     
1 1 1 21 32 29 o 0 1345.9  139.6 ?      ?    4662.11 -179.382     1909.04  -179.382    189.917   -179.382     
1 1 1 23 32 29 o 0 1086.1  145   ?      ?    3597.43 67.1319      1793.65  67.1319     528.813   67.1319      
1 1 1 25 32 29 o 0 737.8   176.9 ?      ?    3888.03 170.792      1041.58  170.792     233.583   -9.20837     
1 1 1 0  32 30 o 0 1948    121.3 ?      ?    6236.44 1.47555e-14  2809.64  0           33.8725   -180         
1 1 1 2  32 30 o 0 803.6   62.1  ?      ?    2671.78 161.996      2121.08  161.996     909.28    161.996      
1 1 1 4  32 30 f 1 312.4   46.5  ?      ?    3072.23 -96.9899     600.145  -96.9899    788.762   83.0101      
1 1 1 6  32 30 o 0 376.1   50.7  ?      ?    2352.31 19.7795      1055.43  19.7795     10.9725   19.7795      
1 1 1 8  32 30 o 0 882.6   66.1  ?      ?    3002.21 92.8115      2061.7   92.8115     731.42    92.8115      
1 1 1 10 32 30 o 0 1351.6  82.5  ?      ?    3873.14 -46.4417     2541.38  -46.4417    858.148   -46.4417     
1 1 1 12 32 30 o 0 2067.4  107   ?      ?    4474.63 35.5956      3268.23  35.5956     1367.9    35.5956      
1 1 1 14 32 30 o 0 1805.5  94.2  ?      ?    5440.85 -105.961     2470.18  -105.961    220.843   -105.961     
1 1 1 16 32 30 o 0 1441.9  98.7  ?      ?    5125.57 102.344      2041.08  102.344     27.5318   102.344      
1 1 1 18 32 30 o 0 185.2   84.2  ?      ?    1213.99 -54.0225     292.997  -54.0225    173.523   125.978      
1 1 1 20 32 30 o 0 958.4   124.1 ?      ?    2748.94 74.2234      1912.8   74.2234     903.035   74.2234      
1 1 1 22 32 30 o 0 386.6   159.4 ?      ?    2844.51 26.8641      595.827  26.8641     403.039   -153.136     
1 1 1 24 32 30 o 0 917.3   185   ?      ?    3708.06 -64.1604     1394.18  -64.1604    176.22    -64.1604     
1 1 1 1  32 31 o 0 -43.2   59.9  ?      ?    1456.23 -158.754     437.12   21.246      1089.37   21.246       
1 1 1 3  32 31 o 0 464.9   55.9  ?      ?    2578.08 34.4684      1211     34.4684     63.6405   34.4684      
1 1 1 5  32 31 o 0 306.9   54.7  ?      ?    3254.61 132.855      464.316  132.855     969.616   -47.1455     
1 1 1 7  32 31 o 0 484.3   56.1  ?      ?    3450.61 -140.415     930.528  -140.415    569.135   39.5848      
1 1 1 9  32 31 o 0 1168.4  79    ?      ?    4260.8  -32.4504     2043.69  -32.4504    223.585   -32.4504     
1 1 1 11 32 31 o 0 1301.8  85.1  ?      ?    4006.6  -112.891     2314.99  -112.891    638.931   -112.891     
1 1 1 13 32 31 f 1 -17.3   64.5  ?      ?    1911.53 114.136      474.026  -65.8635    1242.95   -65.8635     
1 1 1 15 32 31 o 0 72.7    73    ?      ?    1299.4  171.533      87.032   -8.46665    598.822   -8.46665     
1 1 1 17 32 31 o 0 124.2   83.7  ?      ?    1061.58 -68.777      91.5869  -68.777     312.923   111.223      
1 1 1 19 32 31 o 0 259.2   118.8 ?      ?    615.924 -111.654     314.138  -111.654    89.2576   -111.654     
1 1 1 21 32 31 o 0 271.8   155.8 ?      ?    952.909 -124.606     451.779  -124.606    118.335   -124.606     
1 1 1 23 32 31 o 0 320.5   161.9 ?      ?    1557.36 144.3        582.826  144.3       71.7206   144.3        
1 1 1 0  32 32 o 0 57.7    93.9  ?      ?    1677.75 180          192.934  180         536.938   2.52126e-15  
1 1 1 2  32 32 o 0 205.4   65.9  ?      ?    806.588 21.3081      423.002  21.3081     73.4349   21.3081      
1 1 1 4  32 32 o 0 828.8   67.2  ?      ?    3717.96 -69.6045     1627.86  -69.6045    28.7578   -69.6045     
1 1 1 6  32 32 o 0 1561    91.2  ?      ?    4952.53 108.685      2385.6   108.685     279.522   108.685      
1 1 1 8  32 32 o 0 1936.4  105.3 ?      ?    5495.49 -75.5371     2652.84  -75.5371    350.711   -75.5371     
1 1 1 10 32 32 o 0 1022.8  81.9  ?      ?    3820.87 128.404      1890.36  128.404     350.654   128.404      
1 1 1 12 32 32 o 0 1326.6  114.1 ?      ?    3234.52 117.265      2565.53  117.265     1274.07   117.265      
1 1 1 14 32 32 o 0 48.6    108.8 ?      ?    914.318 -77.4422     25.834   102.558     381.319   102.558      
1 1 1 16 32 32 o 0 40.2    96.2  ?      ?    1732    -139.537     190.118  40.463      839.785   40.463       
1 1 1 18 32 32 o 0 557.6   114   ?      ?    3447.38 143.363      932.645  143.363     315.648   -36.6371     
1 1 1 20 32 32 o 0 865.5   151   ?      ?    3120.53 -12.9876     1570.84  -12.9876    502.986   -12.9876     
1 1 1 22 32 32 o 0 -24.7   188.7 ?      ?    2236.44 73.5715      101.465  -106.428    833.117   -106.428     
1 1 1 0  1  33 o 0 842.3   39.6  ?      ?    3029.28 -90          2408.78  -90         602.921   -90          
1 1 1 0  3  33 o 0 3382.2  145.4 ?      ?    7677.27 90           4831.12  90          231.908   90           
1 1 1 0  5  33 o 0 1316.7  59.7  ?      ?    4385.28 -90          3026.57  -90         397.368   -90          
1 1 1 0  7  33 o 0 5.5     9.4   ?      ?    1316.32 90           38.3047  90          748.258   -90          
1 1 1 0  9  33 o 0 20.5    10.9  ?      ?    743.819 -90          68.3157  -90         372.804   90           
1 1 1 0  11 33 o 0 919.7   43.2  ?      ?    3006.77 90           2474.82  90          712.549   90           
1 1 1 0  13 33 o 0 2039.2  89.9  ?      ?    6607.53 -90          3621.36  -90         151.323   90           
1 1 1 0  15 33 o 0 466.5   26.2  ?      ?    3827.77 90           1700.36  90          441.38    -90          
1 1 1 0  17 33 o 0 206.1   21.7  ?      ?    2072.68 -90          1059.69  -90         72.0238   90           
1 1 1 0  19 33 o 0 -13.8   19.2  ?      ?    185.599 90           3.53341  90          97.477    -90          
1 1 1 0  21 33 o 0 661.1   45    ?      ?    3567.95 -90          1922.33  -90         43.1392   -90          
1 1 1 0  23 33 o 0 1843.5  94.7  ?      ?    5905.13 90           3095.05  90          97.5831   90           
1 1 1 0  25 33 o 0 786     54.2  ?      ?    3273.72 -90          1938.9   -90         315.592   -90          
1 1 1 0  27 33 o 0 1585    86.6  ?      ?    4235.92 90           2633.45  90          628.555   90           
1 1 1 0  29 33 o 0 1051.3  97.8  ?      ?    4071.36 -90          2035.06  -90         200.351   -90          
1 1 1 0  31 33 o 0 192.8   87.9  ?      ?    2588.06 -90          639.442  -90         481.896   90           
1 1 1 0  33 1  o 0 140     11.9  ?      ?    1758.41 90           931.126  90          153       -90          
1 1 1 1  14 33 o 0 844.9   28.8  ?      ?    3880.03 145.862      2271.85  145.862     85.0877   145.862      
1 1 1 1  16 33 o 0 214     12.9  ?      ?    1557.26 -96.2765     993.968  -96.2765    135.578   -96.2765     
1 1 1 1  18 33 o 0 584.7   25.4  ?      ?    2950.54 27.1489      1877.97  27.149      293.869   27.149       
1 1 1 1  20 33 o 0 193.3   16.8  ?      ?    1408.02 165.407      811.974  165.407     59.8721   165.407      
1 1 1 1  22 33 o 0 369     24.6  ?      ?    1777.84 -72.115      1516.98  -72.115     599.616   -72.115      
1 1 1 1  24 33 o 0 269.8   25.2  ?      ?    1872.25 92.7999      973.728  92.7999     27.7981   92.7999      
1 1 1 1  26 33 f 1 435.9   33.2  ?      ?    2054.87 -124.072     1492.72  -124.072    492.327   -124.072     
1 1 1 1  28 33 o 0 227.2   51.5  ?      ?    1929.49 -168.436     636.151  -168.436    253.928   11.5638      
1 1 1 1  30 33 o 0 52      66    ?      ?    377.193 -44.0994     34.4555  135.901     202.14    135.901      
1 1 1 1  32 33 f 1 10.7    77.4  ?      ?    2750.54 126.106      601.021  -53.8943    1765.18   -53.8943     
1 1 1 2  5  33 o 0 502.1   18.1  ?      ?    2465.24 -150.525     2023.17  -150.525    555.006   -150.525     
1 1 1 2  11 33 o 0 485.5   19    ?      ?    2854.94 50.1813      1720.56  50.1813     59.6966   50.1813      
1 1 1 2  13 33 o 0 517.6   19.6  ?      ?    1960.83 -31.3291     2203.19  -31.3291    1091.88   -31.3291     
1 1 1 2  15 33 o 0 261.7   13.8  ?      ?    2276.01 -25.3146     995.603  -25.3146    268.716   154.685      
1 1 1 2  17 33 o 0 2294.2  75.3  ?      ?    6156.87 124.331      3876.87  124.331     538.384   124.331      
1 1 1 2  19 33 o 0 1078.8  41.1  ?      ?    4193.19 -69.5135     2624.3   -69.5135    357.124   -69.5135     
1 1 1 2  21 33 o 0 377.1   22.8  ?      ?    3716.57 158.855      769.19   158.855     1176.34   -21.1453     
1 1 1 2  23 33 o 0 224.1   21.8  ?      ?    2933.38 -4.12674     445.825  -4.12674    1034.83   175.873      
1 1 1 2  25 33 o 0 190.8   24.9  ?      ?    984.099 -162.641     622.219  -162.641    136.711   -162.641     
1 1 1 2  27 33 o 0 136.7   32.5  ?      ?    1141.59 -37.1377     279.793  -37.1377    258.105   142.862      
1 1 1 2  29 33 o 0 357.1   54    ?      ?    2537.82 95.9124      946.01   95.9124     193.156   -84.0876     
1 1 1 2  31 33 o 0 296.2   69.7  ?      ?    1518.22 75.2721      858.932  75.2721     203.309   75.2721      
1 1 1 0  33 3  o 0 52      9.8   ?      ?    1450.91 90           401.332  90          497.818   -90          
1 1 1 3  6  33 o 0 1133.8  36.6  ?      ?    4475.41 -175.553     2781.54  -175.553    130.438   -175.553     
1 1 1 3  10 33 o 0 538.6   20.4  ?      ?    2747.18 24.5421      1970.15  24.5421     368.564   24.5421      
1 1 1 3  14 33 o 0 1012.7  35.8  ?      ?    2870.96 -120.729     3193.84  -120.729    1589.22   -120.729     
1 1 1 3  16 33 o 0 999     35.2  ?      ?    3799.07 19.6581      2637.58  19.6581     560.586   19.6581      
1 1 1 3  18 33 o 0 299.8   18.2  ?      ?    2618.69 90.5277      980.366  90.5277     414.376   -89.4723     
1 1 1 3  20 33 o 0 249.2   17.6  ?      ?    1498.13 -116.768     1089.92  -116.768    295.822   -116.768     
1 1 1 3  22 33 o 0 1777    62.6  ?      ?    4489.87 28.3572      3699.03  28.3572     1399.19   28.3572      
1 1 1 3  24 33 o 0 283.2   24    ?      ?    2704.92 -178.236     741.425  -178.236    615.782   1.76389      
1 1 1 3  26 33 o 0 723.5   40.2  ?      ?    4277.04 38.4729      1407.16  38.4729     650.037   -141.527     
1 1 1 3  28 33 f 1 169.3   36.3  ?      ?    1925.42 -83.1729     362.707  -83.1729    525.171   96.8271      
1 1 1 3  30 33 o 0 2521.3  113.8 ?      ?    5983.62 80.9481      3354.17  80.9481     708.713   80.9481      
1 1 1 3  32 33 o 0 26.2    64.1  ?      ?    1135.06 12.9757      192.407  -167.024    667.731   -167.024     
1 1 1 3  33 4  o 0 544.3   19.2  ?      ?    2320.41 -94.4653     2288.72  -94.4653    881.746   -94.4653     
1 1 1 4  5  33 o 0 626.1   21.7  ?      ?    3754.13 23.0158      1755.83  23.0158     462.199   -156.984     
1 1 1 4  11 33 o 0 648.7   23.7  ?      ?    2892.93 -70.8197     2237.86  -70.8197    570.158   -70.8197     
1 1 1 4  13 33 o 0 394.7   16.9  ?      ?    2689.62 150.025      1405.22  150.025     105.093   -29.9752     
1 1 1 4  15 33 o 0 1392    47    ?      ?    5636.63 -150.585     2575.37  -150.585    526.81    29.415       
1 1 1 4  17 33 o 0 1104    38.4  ?      ?    4288.53 -6.71616     2591.63  -6.71616    287.594   -6.71616     
1 1 1 4  19 33 o 0 294.9   19    ?      ?    2341.76 39.3097      1065.01  39.3097     189.675   -140.69      
1 1 1 4  21 33 o 0 22.1    15    ?      ?    760.043 47.6044      253.297  -132.396    647.647   -132.396     
1 1 1 4  23 33 o 0 903.7   43.6  ?      ?    3798.18 -110.793     2163.3   -110.793    228.807   -110.793     
1 1 1 4  25 33 o 0 282.4   25.3  ?      ?    2009.38 87.0141      959.82   87.0141     23.3381   -92.9859     
1 1 1 4  27 33 o 0 508.6   34.1  ?      ?    2617.52 -179.965     1448.55  -179.965    224.954   -179.965     
1 1 1 4  29 33 o 0 125.3   39.5  ?      ?    1973.45 129.886      106.285  129.886     772.882   -50.1137     
1 1 1 4  31 33 f 1 2540.5  115.9 ?      ?    6551.15 2.15549      3025.25  2.15549     200.543   2.15549      
1 1 1 0  33 5  o 0 605.4   30.3  ?      ?    4195.86 -90          2125.31  -90         477.349   90           
1 1 1 5  12 33 o 0 348.7   16    ?      ?    2331.35 -0.335319    1384.15  -0.335319   70.6223   -0.335319    
1 1 1 5  16 33 f 1 1380.6  47.3  ?      ?    5036.7  84.4618      2808.03  84.4618     67.2125   84.4618      
1 1 1 5  18 33 o 0 525.2   23.9  ?      ?    2921.86 -35.5603     1728.83  -35.5603    133.638   -35.5603     
1 1 1 5  20 33 o 0 970.6   40.9  ?      ?    3624.15 -125.867     2567.42  -125.867    665.967   -125.867     
1 1 1 5  22 33 o 0 244.1   25.8  ?      ?    2837.78 -136.694     582.231  -136.694    856.736   43.3062      
1 1 1 5  24 33 o 0 313.7   30.6  ?      ?    2268.49 46.705       1018.34  46.705      108.629   -133.295     
1 1 1 5  26 33 f 1 1462.1  68.8  ?      ?    2982.69 70.4428      3445.06  70.4428     2016.27   70.4428      
1 1 1 5  28 33 o 0 1784.5  85.8  ?      ?    4846.29 124.458      3021.7   124.458     820.384   124.458      
1 1 1 5  30 33 o 0 2542.9  110.8 ?      ?    6718.32 -58.5647     3040.85  -58.5647    97.71     -58.5647     
1 1 1 5  32 33 o 0 -6.7    57.8  ?      ?    2242.58 -108.519     583.563  71.4807     1495.9    71.4807      
1 1 1 6  7  33 o 0 359.3   14.4  ?      ?    2084.01 -170.929     1595.84  -170.929    381.613   -170.929     
1 1 1 6  9  33 o 0 311.5   14.6  ?      ?    1484.79 106.905      1594.66  106.905     737.059   106.905      
1 1 1 6  11 33 o 0 486.9   19.3  ?      ?    2187.04 27.2073      1992.1   27.2073     757.252   27.2073      
1 1 1 6  13 33 o 0 748.3   27.6  ?      ?    3779.61 153.707      2022.41  153.707     76.8276   -26.2926     
1 1 1 6  15 33 o 0 841.2   30.6  ?      ?    2678.67 -29.5355     2770.96  -29.5355    1313.16   -29.5355     
1 1 1 6  17 33 o 0 1035.4  41.5  ?      ?    4267.48 79.8074      2414.67  79.8074     147.86    79.8074      
1 1 1 6  19 33 o 0 185.9   19.4  ?      ?    1403    -88.8025     762.764  -88.8025    19.6137   -88.8025     
1 1 1 6  21 33 o 0 196.7   24.7  ?      ?    2546.61 -118.182     471.909  -118.182    834.328   61.8175      
1 1 1 6  23 33 o 0 2329.5  85.2  ?      ?    7775.35 80.6576      2784.77  80.6576     1130.33   -99.3424     
1 1 1 6  25 33 o 0 670.2   43.2  ?      ?    4071.36 -132.007     1368.99  -132.007    600.576   47.9931      
1 1 1 6  27 33 o 0 2543.5  106.2 ?      ?    6288.31 26.4107      3498.33  26.4107     591.612   26.4107      
1 1 1 6  29 33 o 0 273.7   65.5  ?      ?    3208.46 -17.034      389.745  -17.034     1023.88   162.966      
1 1 1 6  31 33 o 0 1001.8  75.7  ?      ?    3328.68 -147.121     2081.56  -147.121    669.833   -147.121     
1 1 1 0  33 7  o 0 287.9   16.7  ?      ?    1296.35 90           1360.48  90          559.059   90           
1 1 1 4  33 7  o 0 392.1   15.4  ?      ?    1686.84 -23.8216     1950.42  -23.8216    939.709   -23.8216     
1 1 1 7  12 33 o 0 397.7   17.5  ?      ?    2105.35 78.5829      1664.09  78.5829     491.595   78.5829      
1 1 1 7  14 33 f 1 717.5   27.8  ?      ?    3387.83 31.2616      2090.88  31.2616     228.485   31.2616      
1 1 1 7  16 33 o 0 550.7   25    ?      ?    2485.91 -168.541     1972.11  -168.541    643.408   -168.541     
1 1 1 7  18 33 o 0 215.3   21.7  ?      ?    1846.97 32.5309      844.452  32.5309     141.757   -147.469     
1 1 1 7  20 33 o 0 1696.1  63.7  ?      ?    4879.63 -147.546     3405.6   -147.546    877.779   -147.546     
1 1 1 7  22 33 o 0 837.2   40.8  ?      ?    3551.73 1.76757      2166.29  1.76757     388.222   1.76757      
1 1 1 7  24 33 o 0 510     37.1  ?      ?    2602.25 75.1263      1557.83  75.1263     281.573   75.1263      
1 1 1 7  26 33 o 0 817.6   56.7  ?      ?    1573.13 -121.602     2538.73  -121.602    1800.08   -121.602     
1 1 1 7  28 33 o 0 953.2   69.4  ?      ?    4509.13 -123.864     1697.39  -123.864    324.654   56.1361      
1 1 1 7  30 33 o 0 490.8   77    ?      ?    2299.15 102.894      1321.94  102.894     327.528   102.894      
1 1 1 7  32 33 o 0 23.5    53.5  ?      ?    834.7   -122.685     169.404  57.3147     504.699   57.3147      
1 1 1 8  11 33 o 0 396.9   17.4  ?      ?    2000.81 178.729      1705.36  178.729     589.354   178.729      
1 1 1 8  13 33 o 0 993.5   35.3  ?      ?    4252.54 -37.9007     2398.55  -37.9007    66.4539   -37.9007     
1 1 1 8  15 33 o 0 1777.6  61.5  ?      ?    4578.31 58.4102      3791.09  58.4102     1331.99   58.4102      
1 1 1 8  17 33 o 0 1959.5  72.4  ?      ?    5023.16 -109.866     3920.52  -109.866    1194.26   -109.866     
1 1 1 8  19 33 o 0 209.7   23.2  ?      ?    1504.8  79.3534      869.969  79.3534     83.8433   79.3534      
1 1 1 8  21 33 o 0 741.5   35.9  ?      ?    2786.52 -169.714     2280.32  -169.714    871.002   -169.714     
1 1 1 8  23 33 o 0 176.1   30.4  ?      ?    2100.11 37.1819      439.011  37.1819     603.48    -142.818     
1 1 1 8  25 33 o 0 238.5   38.7  ?      ?    1981.05 -41.4528     752.733  -41.4528    191.918   138.547      
1 1 1 8  27 33 o 0 587.1   56.9  ?      ?    2177.36 179.88       1761.62  179.88      769.644   179.88       
1 1 1 8  29 33 o 0 397.3   68.1  ?      ?    1926.17 166.778      1168.04  166.778     320.025   166.778      
1 1 1 8  31 33 o 0 277.6   83.5  ?      ?    1454.29 33.9655      753.042  33.9655     145.188   33.9655      
1 1 1 0  33 9  o 0 437.6   24.2  ?      ?    1359.89 -90          1739.87  -90         905.648   -90          
1 1 1 9  12 33 o 0 649.8   25.9  ?      ?    3529.49 -155.178     1839.2   -155.178    100.344   24.8219      
1 1 1 9  14 33 o 0 2.2     11.3  ?      ?    622.066 169.002      282.52   -10.9981    617.871   -10.9981     
1 1 1 9  16 33 o 0 0.9     13.2  ?      ?    1429.1  50.5185      649.76   -129.482    1429.52   -129.482     
1 1 1 9  18 33 o 0 641.7   34.1  ?      ?    4215.89 78.0967      1416.79  78.0967     801.148   -101.903     
1 1 1 9  20 33 o 0 798.6   40.8  ?      ?    2873.96 -40.4164     2411.08  -40.4164    944.783   -40.4164     
1 1 1 9  22 33 o 0 1657.3  68.3  ?      ?    4946.51 -178.2       3086.79  -178.2      605.442   -178.2       
1 1 1 9  24 33 o 0 466.5   40.1  ?      ?    1356.39 -57.7739     1726.84  -57.7739    1072.05   -57.7739     
1 1 1 9  26 33 o 0 459     53.6  ?      ?    1741.35 -11.3131     1524.55  -11.3131    719.94    -11.3131     
1 1 1 9  28 33 o 0 339.6   63.4  ?      ?    3213.77 21.5797      627.109  21.5797     790.837   -158.42      
1 1 1 9  30 33 o 0 115.1   72.6  ?      ?    1441.03 15.1129      66.9307  15.1129     546.211   -164.887     
1 1 1 9  32 33 o 0 1052.3  87.3  ?      ?    2193.73 -121.268     2439.08  -121.268    1560.62   -121.268     
1 1 1 1  33 10 o 0 1200.1  39.1  ?      ?    3691.71 113.851      3456.36  113.851     1220.42   113.851      
1 1 1 3  33 10 o 0 763.7   28.5  ?      ?    3150.56 -121.626     2536.32  -121.626    657.531   -121.626     
1 1 1 7  33 10 o 0 403.3   17.4  ?      ?    3145.48 27.2843      1239.72  27.2843     571.076   -152.716     
1 1 1 9  33 10 o 0 390.9   17.4  ?      ?    2697.62 -131.567     1378.45  -131.567    128.18    48.4334      
1 1 1 10 11 33 o 0 545.4   22.9  ?      ?    2996.62 68.672       1771.99  68.672      123.759   68.672       
1 1 1 10 13 33 o 0 294.8   16.9  ?      ?    2206.93 -130.161     1149.45  -130.161    43.2303   49.8392      
1 1 1 10 15 33 o 0 1054.8  41.8  ?      ?    3821.44 -124.46      2669.8   -124.46     648.306   -124.46      
1 1 1 10 17 33 f 1 3411.8  127.3 ?      ?    8562.83 32.9345      4136.3   32.9345     419.731   -147.066     
1 1 1 10 19 33 o 0 284.4   28.3  ?      ?    3104.89 -117.821     655.867  -117.821    939.899   62.1789      
1 1 1 10 21 33 o 0 554.4   37    ?      ?    2837.29 -175.102     1648.82  -175.102    212.66    -175.102     
1 1 1 10 23 33 o 0 429.1   36.8  ?      ?    1840.07 49.0458      1545.04  49.0458     647.192   49.0458      
1 1 1 10 25 33 o 0 -35.6   44.2  ?      ?    1493.09 -109.352     519.436  70.6477     1217.99   70.6477      
1 1 1 10 27 33 o 0 36.2    55.2  ?      ?    1347.93 152.275      232.726  -27.7251    835.975   -27.7251     
1 1 1 10 29 33 f 1 194.8   72.1  ?      ?    2099.9  -17.7987     326.633  -17.7987    586.422   162.201      
1 1 1 10 31 33 o 0 -46.5   91.5  ?      ?    1780.43 -135.851     375.842  44.1485     1092.02   44.1485      
1 1 1 0  33 11 o 0 1407.7  65    ?      ?    4545.25 -90          3163.32  -90         408.832   -90          
1 1 1 2  33 11 o 0 690.5   24.2  ?      ?    3862.01 75.9807      1923.93  75.9807     382.433   -104.019     
1 1 1 4  33 11 o 0 272.4   14.8  ?      ?    1732.43 -157.733     1349.07  -157.733    331.031   -157.733     
1 1 1 11 12 33 o 0 260.9   16.4  ?      ?    2241.84 21.0876      979.956  21.0876     233.188   -158.912     
1 1 1 11 14 33 o 0 40      13    ?      ?    886.3   -13.3283     138.012  166.672     608.184   166.672      
1 1 1 11 16 33 f 1 101.5   15.8  ?      ?    100.23  168.887      36.6886  168.887     16.8752   -11.1126     
1 1 1 11 18 33 f 1 583.2   33.3  ?      ?    2649.7  -107.787     1927.69  -107.787    549.982   -107.787     
1 1 1 11 20 33 o 0 2757.8  107.5 ?      ?    7099.19 58.1132      3829.57  58.1132     271.958   58.1132      
1 1 1 11 22 33 o 0 1137.9  55.3  ?      ?    3846.9  -84.7148     2573.85  -84.7148    679.413   -84.7148     
1 1 1 11 24 33 o 0 1034.3  60.5  ?      ?    4697.92 6.27948      1894.19  6.27948     331.145   -173.721     
1 1 1 11 26 33 o 0 584.1   62.5  ?      ?    3484.23 -176.645     1278.14  -176.645    300.923   3.35519      
1 1 1 11 28 33 o 0 710.5   74    ?      ?    2833.94 -11.984      1723.88  -11.984     480.91    -11.984      
1 1 1 11 30 33 o 0 858.7   93.7  ?      ?    3402.71 -176.868     1739.19  -176.868    320.134   -176.868     
1 1 1 11 32 33 o 0 33      114.3 ?      ?    2088.76 108.708      209.33   -71.292     1028.91   -71.292      
1 1 1 3  33 12 o 0 417.5   18.5  ?      ?    3621    -2.54913     1067.78  -2.54913    1061.61   177.451      
1 1 1 5  33 12 o 0 465.4   18.6  ?      ?    1431.23 -21.7181     2205.2   -21.7181    1385.92   -21.7181     
1 1 1 7  33 12 o 0 2069.3  65.8  ?      ?    6074.99 -147.597     3674.7   -147.597    260.629   -147.597     
1 1 1 9  33 12 o 0 149.7   13.2  ?      ?    2083.05 -35.1437     441.977  -35.1437    705.146   144.856      
1 1 1 11 33 12 o 0 246.9   15.7  ?      ?    2780.43 -135.259     673.526  -135.259    823.44    44.741       
1 1 1 12 13 33 o 0 554.1   24.9  ?      ?    2709.45 98.7417      1872.54  98.7417     432.864   98.7417      
1 1 1 12 15 33 o 0 372.4   21.7  ?      ?    3159.87 -70.1879     1028.62  -70.1879    655.816   109.812      
1 1 1 12 17 33 o 0 834     37.7  ?      ?    2448.53 67.3563      2727.48  67.3563     1455.63   67.3563      
1 1 1 12 19 33 f 1 1512.2  64    ?      ?    3320.76 -115.242     3702.78  -115.242    2018.87   -115.242     
1 1 1 12 21 33 o 0 214.2   33.7  ?      ?    1455.52 -60.4814     768.273  -60.4814    45.908    -60.4814     
1 1 1 12 23 33 o 0 69.5    37.6  ?      ?    1024.53 -5.66727     50.6465  174.333     540.514   174.333      
1 1 1 12 25 33 o 0 54.2    52.5  ?      ?    1388.54 -25.6642     190.639  154.336     826.889   154.336      
1 1 1 12 27 33 o 0 37.6    60.2  ?      ?    619.908 -54.6016     81.8101  125.398     353.392   125.398      
1 1 1 12 29 33 o 0 460.7   83.3  ?      ?    2089.01 -15.5907     1260.27  -15.5907    376.484   -15.5907     
1 1 1 12 31 33 o 0 25.4    106.6 ?      ?    659.73  109.486      37.4267  -70.5145    300.481   -70.5145     
1 1 1 0  33 13 o 0 144.6   17.3  ?      ?    1325.18 90           783.078  90          1.28935   90           
1 1 1 2  33 13 o 0 882.8   31.6  ?      ?    4233.67 -54.1279     2256.57  -54.1279    205.842   125.872      
1 1 1 4  33 13 o 0 182.4   13.5  ?      ?    2389.16 -80.7457     538.614  -80.7457    829.096   99.2543      
1 1 1 8  33 13 o 0 2089.1  66.8  ?      ?    4816.73 130.474      4315.03  130.474     1657.44   130.474      
1 1 1 10 33 13 o 0 263.9   15.6  ?      ?    1112.96 25.7347      1272.79  25.7347     671.764   25.7347      
1 1 1 12 33 13 o 0 395.9   20.1  ?      ?    2042.87 -32.7672     1593.32  -32.7672    516.314   -32.7672     
1 1 1 13 14 33 o 0 708.7   31.7  ?      ?    3604.91 -146.698     1934.47  -146.698    9.18951   -146.698     
1 1 1 13 16 33 o 0 501.8   27    ?      ?    2323.8  -153.813     1823.49  -153.813    612.391   -153.813     
1 1 1 13 18 33 o 0 806.1   38.1  ?      ?    2404.51 37.1757      2607.71  37.1757     1389.39   37.1757      
1 1 1 13 20 33 o 0 698.8   42.4  ?      ?    3083.54 123.454      1927.77  123.454     387.684   123.454      
1 1 1 13 22 33 f 1 888.4   52.7  ?      ?    4261.88 -120.399     1795.62  -120.399    269.884   59.6006      
1 1 1 13 24 33 o 0 49.8    50.8  ?      ?    752.911 100.716      98.4896  -79.2836    446.76    -79.2836     
1 1 1 13 26 33 o 0 596.7   62    ?      ?    2525.99 26.6018      1629.57  26.6018     510.639   26.6018      
1 1 1 13 28 33 o 0 80.3    66.5  ?      ?    1555.9  31.3359      98.3075  -148.664    764.948   -148.664     
1 1 1 13 30 33 o 0 723.1   98.2  ?      ?    3301.89 155.65       1462.84  155.65      145.009   155.65       
1 1 1 13 32 33 f 1 1302.2  132.6 ?      ?    2568.67 -6.5535      2602.45  -6.5535     1613.25   -6.5535      
1 1 1 3  33 14 o 0 369.4   16.8  ?      ?    1862.88 -177.739     1686.89  -177.739    622.093   -177.739     
1 1 1 5  33 14 o 0 25.9    12.1  ?      ?    1913.09 68.2221      654.645  -111.778    1730.18   -111.778     
1 1 1 7  33 14 f 1 182     15.4  ?      ?    2282.99 -73.3334     556.962  -73.3334    710.284   106.667      
1 1 1 9  33 14 o 0 195.5   15.7  ?      ?    2130.36 117.698      688.424  117.698     463.721   -62.3016     
1 1 1 11 33 14 o 0 175.1   16.8  ?      ?    1618.57 -6.60173     722.754  -6.60173    132.896   173.398      
1 1 1 13 33 14 o 0 48.2    18    ?      ?    704.428 129.091      97.0483  -50.909     469.355   -50.909      
1 1 1 14 15 33 o 0 528     31.5  ?      ?    2222.38 70.5081      1951.35  70.5081     790.732   70.5081      
1 1 1 14 17 33 o 0 341.6   28.5  ?      ?    2424.67 -88.5658     1168.1   -88.5658    64.7286   91.4342      
1 1 1 14 19 33 o 0 164.6   31.8  ?      ?    1768.15 -32.7556     465.917  -32.7556    421.569   147.244      
1 1 1 14 21 33 o 0 273.7   36.7  ?      ?    2942.52 127.811      581.148  127.811     846.075   -52.1886     
1 1 1 14 23 33 f 1 2202.3  103   ?      ?    3680.91 71.1538      4199.66  71.1538     2473.74   71.1538      
1 1 1 14 25 33 f 1 4266.3  182.3 ?      ?    5629.92 -111.382     5498.61  -111.382    2966.78   -111.382     
1 1 1 14 27 33 o 0 99.2    68.6  ?      ?    868.098 -71.9868     39.9658  -71.9868    336.109   108.013      
1 1 1 14 29 33 o 0 -33.3   82.4  ?      ?    871.071 3.78274      170.999  -176.217    530.204   -176.217     
1 1 1 14 31 33 o 0 318.1   108.7 ?      ?    2207.52 16.6075      663.332  16.6075     194.157   -163.392     
1 1 1 0  33 15 o 0 1144.1  54.3  ?      ?    4426.68 90           2747.42  90          190.943   90           
1 1 1 2  33 15 o 0 475.3   22.4  ?      ?    3082.92 -20.2646     1542.63  -20.2646    213.791   159.735      
1 1 1 4  33 15 o 0 1079.8  39.9  ?      ?    3696.4  157.644      2955.29  157.644     881.694   157.644      
1 1 1 6  33 15 o 0 147.3   14    ?      ?    1559.21 -99.6044     592.229  -99.6044    267.422   80.3956      
1 1 1 8  33 15 o 0 340.9   18.7  ?      ?    2728.89 48.785       1121.3   48.785      354.444   -131.215     
1 1 1 10 33 15 o 0 270.9   17.3  ?      ?    2452.64 -136.484     917.511  -136.484    380.532   43.5161      
1 1 1 12 33 15 o 0 1293.4  50.2  ?      ?    4233.77 42.2638      3020.4   42.2638     777.107   42.2638      
1 1 1 14 33 15 o 0 -24.6   18.5  ?      ?    460.378 -156.032     209.921  23.9683     447.277   23.9683      
1 1 1 15 16 33 o 0 825.9   41.2  ?      ?    4022.88 -51.7992     1956.79  -51.7992    93.0184   128.201      
1 1 1 15 18 33 o 0 402.9   34    ?      ?    2290.16 -54.1234     1361.17  -54.1234    207.57    -54.1234     
1 1 1 15 20 33 o 0 2210.6  91.8  ?      ?    5492.46 100.708      3602.73  100.708     925.362   100.708      
1 1 1 15 22 33 o 0 1223.6  60.1  ?      ?    3988.03 -52.709      2560.29  -52.709     686.023   -52.709      
1 1 1 15 24 33 o 0 215.9   54    ?      ?    1551.36 -147.028     626.521  -147.028    72.7512   32.972       
1 1 1 15 26 33 o 0 898.6   80.9  ?      ?    4743.85 -170.755     1386.54  -170.755    688.08    9.24499      
1 1 1 15 28 33 o 0 1547.2  109.5 ?      ?    5216.13 -170.445     2207.24  -170.445    32.4915   -170.445     
1 1 1 15 30 33 o 0 1402.3  116.1 ?      ?    3478.09 -46.9449     2558.55  -46.9449    1190.45   -46.9449     
1 1 1 15 32 33 o 0 247.3   95.6  ?      ?    2000.56 -152.052     432.222  -152.052    308.574   27.9482      
1 1 1 1  33 16 o 0 373.4   18.7  ?      ?    1924.01 -70.231      1667.39  -70.231     576.842   -70.231      
1 1 1 3  33 16 o 0 822.1   33.3  ?      ?    4063.85 145.437      2095.63  145.437     175.249   -34.5626     
1 1 1 5  33 16 f 1 213.1   18.1  ?      ?    2645.61 -17.616      568.121  -17.616     894.699   162.384      
1 1 1 7  33 16 o 0 500.6   23.9  ?      ?    2130.96 -12.6763     1975.49  -12.6763    824.994   -12.6763     
1 1 1 9  33 16 o 0 -11.1   15.8  ?      ?    331.934 -54.8891     155.527  125.111     337.38    125.111      
1 1 1 11 33 16 f 1 -24.8   15    ?      ?    355.639 -117.01      173.798  62.9901     363.462   62.9901      
1 1 1 13 33 16 o 0 150.5   20.5  ?      ?    1719.9  61.2447      482.987  61.2447     405.853   -118.755     
1 1 1 15 33 16 o 0 -4.4    21.3  ?      ?    153.603 52.3099      60.5924  -127.69     137.689   -127.69      
1 1 1 16 17 33 o 0 465.7   34    ?      ?    3627.2  126.232      1022.76  126.232     808.261   -53.7685     
1 1 1 16 19 33 o 0 -29.1   31.5  ?      ?    809.579 -164.553     315.845  15.4466     711.89    15.4466      
1 1 1 16 21 33 o 0 1140.7  61.2  ?      ?    4533.27 75.9517      2175.11  75.9517     33.9731   75.9517      
1 1 1 16 23 33 o 0 983.5   58.6  ?      ?    5505.69 -166.347     1356.59  -166.347    1141.04   13.6531      
1 1 1 16 25 33 o 0 811.7   61.2  ?      ?    3481.5  53.1052      1756.21  53.1052     242.642   53.1052      
1 1 1 16 27 33 o 0 30.9    47.1  ?      ?    69.2507 -137.496     13.4501  42.5042     42.594    42.5042      
1 1 1 16 29 33 o 0 116.4   66.1  ?      ?    719.527 -49.5869     58.8927  -49.5869    223.427   130.413      
1 1 1 16 31 33 o 0 663.7   97.2  ?      ?    3591.27 148.081      1155.34  148.081     191.102   -31.9188     
1 1 1 0  33 17 o 0 1520.8  70.8  ?      ?    4388.72 -90          3087.32  -90         617.584   -90          
1 1 1 2  33 17 o 0 1154.4  41.4  ?      ?    5437.64 103.671      2187.5   103.671     833.618   -76.3285     
1 1 1 4  33 17 o 0 862.9   34.4  ?      ?    3117.65 -33.8706     2634.98  -33.8706    928.511   -33.8706     
1 1 1 6  33 17 o 0 561.2   27.2  ?      ?    3731.12 -113.302     1429.11  -113.302    578.674   66.6979      
1 1 1 8  33 17 o 0 249.6   19    ?      ?    1247.61 116.334      1218.18  116.334     536.1     116.334      
1 1 1 10 33 17 f 1 236.9   20.8  ?      ?    1181.05 -59.5899     1039.32  -59.5899    409.971   -59.5899     
1 1 1 12 33 17 o 0 63.9    20.2  ?      ?    502.302 96.0085      7.29164  96.0085     252.466   -83.9915     
1 1 1 14 33 17 o 0 1006.6  45.3  ?      ?    3479.44 -134.83      2608.63  -134.83     858.169   -134.83      
1 1 1 16 33 17 o 0 112.5   27    ?      ?    760.802 122.609      198.476  122.609     179.1     -57.3912     
1 1 1 17 18 33 o 0 151.6   30.1  ?      ?    2192.76 45.4766      269.916  45.4766     805.031   -134.523     
1 1 1 17 20 33 o 0 190.5   39.5  ?      ?    1268.11 -174.509     624.278  -174.509    23.236    -174.509     
1 1 1 17 22 33 o 0 92.9    34    ?      ?    1472.27 71.1049      14.2351  -108.895    685.395   -108.895     
1 1 1 17 24 33 o 0 343.1   47.5  ?      ?    1553.04 -85.4369     1099.77  -85.4369    420.327   -85.4369     
1 1 1 17 26 33 o 0 918.9   71.4  ?      ?    3324.79 36.1679      1928.47  36.1679     518.359   36.1679      
1 1 1 17 28 33 o 0 -52.2   65.6  ?      ?    679.029 -94.302      177.239  85.698      446.134   85.698       
1 1 1 17 30 33 f 1 811.2   97.4  ?      ?    2723.04 129.072      1740.14  129.072     697.123   129.072      
1 1 1 17 32 33 o 0 1411.2  134.5 ?      ?    5816.41 37.4974      1585.62  37.4974     498.467   -142.503     
1 1 1 1  33 18 o 0 1033.8  38.3  ?      ?    4250.61 -114.154     2512.03  -114.154    168.714   -114.154     
1 1 1 3  33 18 o 0 533.2   24.8  ?      ?    3887.78 -50.4608     1274.44  -50.4608    840.112   129.539      
1 1 1 5  33 18 o 0 798.5   34.9  ?      ?    4170.67 156.219      1959.55  156.219     353.131   -23.7809     
1 1 1 7  33 18 o 0 1019.6  42.8  ?      ?    4984.32 46.1888      2075.94  46.1888     612.697   -133.811     
1 1 1 9  33 18 o 0 198.6   20.3  ?      ?    2156.83 -104.22      647.494  -104.22     492.552   75.7798      
1 1 1 11 33 18 f 1 452.9   27.7  ?      ?    2456.25 -96.6639     1583.7   -96.6639    307.675   -96.6639     
1 1 1 13 33 18 o 0 828     39.7  ?      ?    3020.56 101.808      2390.51  101.808     870.117   101.808      
1 1 1 15 33 18 o 0 269.9   28.2  ?      ?    1822.4  56.9432      970.559  56.9432     64.027    56.9432      
1 1 1 17 33 18 o 0 823.8   46.2  ?      ?    2853.07 -82.6657     2255.93  -82.6657    883.211   -82.6657     
1 1 1 18 19 33 f 1 45.9    37    ?      ?    1286.82 168.945      224.368  -11.0553    838.933   -11.0553     
1 1 1 18 21 33 o 0 895.7   62.7  ?      ?    3293.02 -117.402     2108.34  -117.402    602.12    -117.402     
1 1 1 18 23 33 o 0 313.4   47.8  ?      ?    1650.13 -125.298     991.674  -125.298    266.325   -125.298     
1 1 1 18 25 33 f 1 3.4     54.9  ?      ?    688.558 88.9253      161.991  -91.0747    457.48    -91.0747     
1 1 1 18 27 33 o 0 97      68.6  ?      ?    1683.35 -37.5523     70.6297  142.448     742.302   142.448      
1 1 1 18 29 33 o 0 1009.2  100.9 ?      ?    4620.36 35.0955      1494.03  35.0955     281.734   -144.904     
1 1 1 18 31 33 o 0 302.8   106.9 ?      ?    2883.96 -102.493     410.576  -102.493    633.685   77.5073      
1 1 1 0  33 19 o 0 69.1    23.8  ?      ?    1795.6  -90          415.853  -90         589.411   90           
1 1 1 2  33 19 o 0 241.3   20.3  ?      ?    1522.48 161.547      1091.71  161.547     249.4     161.547      
1 1 1 4  33 19 o 0 112.9   17.2  ?      ?    2124.8  -171.051     124.947  -171.051    1033.95   8.94902      
1 1 1 6  33 19 o 0 -19.9   19.3  ?      ?    1173.3  -135.916     545.846  44.0843     1175.26   44.0843      
1 1 1 8  33 19 o 0 118     19.2  ?      ?    1863.85 33.2628      236.85   33.2628     744.222   -146.737     
1 1 1 10 33 19 o 0 678.1   32.9  ?      ?    3191.3  163.776      1969.6   163.776     325.601   163.776      
1 1 1 12 33 19 f 1 154.8   24.4  ?      ?    2245.84 45.2847      337.396  45.2847     798.01    -134.715     
1 1 1 14 33 19 o 0 695.2   39.6  ?      ?    3101.63 -21.5502     1904.54  -21.5502    360.955   -21.5502     
1 1 1 16 33 19 o 0 190.4   30.5  ?      ?    1786.64 -96.3878     580.896  -96.3878    280.782   83.6122      
1 1 1 18 33 19 f 1 1629    74    ?      ?    5715.61 69.6216      2463.59  69.6216     211.742   -110.378     
1 1 1 19 20 33 o 0 438     47.4  ?      ?    2893.14 142.712      1106.86  142.712     218.809   -37.2877     
1 1 1 19 22 33 o 0 1918.4  91.3  ?      ?    4582.77 66.3821      3233.68  66.3821     1212.87   66.3821      
1 1 1 19 24 33 o 0 329.2   59    ?      ?    1245.87 1.10651      963.969  1.10651     429.907   1.10651      
1 1 1 19 26 33 o 0 94.1    69.8  ?      ?    530.859 -67.4301     23.9218  -67.4301    193.466   112.57       
1 1 1 19 28 33 o 0 1722.8  115.2 ?      ?    4818.88 -116.929     2498.54  -116.929    632.851   -116.929     
1 1 1 19 30 33 o 0 761     112.7 ?      ?    1933.84 -84.8179     1744.21  -84.8179    1037.81   -84.8179     
1 1 1 19 32 33 o 0 776.2   150.5 ?      ?    1805.7  142.161      1670.07  142.161     1057.1    142.161      
1 1 1 1  33 20 o 0 939.7   37.7  ?      ?    5103.33 38.8418      1847.25  38.8418     946.667   -141.158     
1 1 1 3  33 20 o 0 1624.4  57.6  ?      ?    5292.71 123.864      3207.93  123.864     346.708   123.864      
1 1 1 5  33 20 o 0 1184.4  44.6  ?      ?    4446.77 -161.474     2696.18  -161.474    328.28    -161.474     
1 1 1 7  33 20 o 0 472.3   26.7  ?      ?    3755.73 -145.967     1094.93  -145.967    870.203   34.033       
1 1 1 9  33 20 o 0 260.6   24.6  ?      ?    1521.12 8.11227      1103.16  8.11227     323.104   8.11227      
1 1 1 11 33 20 o 0 532.7   32.5  ?      ?    3549.72 52.7894      1334.21  52.7894     444.91    -127.211     
1 1 1 13 33 20 o 0 907.4   45.5  ?      ?    3509.61 -85.0577     2247.44  -85.0577    503.21    -85.0577     
1 1 1 15 33 20 o 0 0.2     30.8  ?      ?    2462.63 -158.256     877.282  21.7435     2065.54   21.7435      
1 1 1 17 33 20 o 0 56.3    35.7  ?      ?    737.2   19.4657      75.4769  -160.534    419.471   -160.534     
1 1 1 19 33 20 o 0 980.6   59.7  ?      ?    3984.94 4.72718      1970.18  4.72718     182.526   4.72718      
1 1 1 20 21 33 o 0 4028.4  159.4 ?      ?    8530.31 -19.4702     3982.48  -19.4702    215.231   -19.4702     
1 1 1 20 23 33 o 0 151.1   51.2  ?      ?    1812.99 -114.253     200.827  -114.253    578.591   65.7473      
1 1 1 20 25 33 o 0 599     79    ?      ?    2980.69 93.1376      1313.54  93.1376     87.7296   93.1376      
1 1 1 20 27 33 o 0 78.8    88.2  ?      ?    1319.76 55.6356      40.6186  -124.364    554.474   -124.364     
1 1 1 20 29 33 f 1 430.9   115.6 ?      ?    3962.78 162.685      458.064  162.685     1007.95   -17.3146     
1 1 1 20 31 33 o 0 604.9   141.6 ?      ?    1746.42 24.3096      1367.48  24.3096     769.591   24.3096      
1 1 1 0  33 21 o 0 137.5   26.8  ?      ?    870.315 90           468.372  90          2.02692   -90          
1 1 1 2  33 21 o 0 890.3   37.5  ?      ?    4080.05 -89.5016     2193.69  -89.5016    12.1571   -89.5016     
1 1 1 4  33 21 o 0 1268.4  47.9  ?      ?    4706.75 68.3262      2721.64  68.3262     238.657   68.3262      
1 1 1 6  33 21 o 0 479.3   28.6  ?      ?    2726.16 82.9714      1576     82.9714     160.712   82.9714      
1 1 1 8  33 21 o 0 96.3    22.1  ?      ?    656.619 -141.432     164.976  -141.432    169.619   38.5684      
1 1 1 10 33 21 o 0 367.1   29.9  ?      ?    1914.06 -34.3318     1363.57  -34.3318    391.915   -34.3318     
1 1 1 12 33 21 o 0 1984.8  77.6  ?      ?    5821.49 -156.086     3165.67  -156.086    281.691   -156.086     
1 1 1 14 33 21 o 0 602.7   39.5  ?      ?    3440.29 40.6964      1457.14  40.6964     200.498   -139.304     
1 1 1 16 33 21 o 0 868.8   53.6  ?      ?    4335.38 -122.909     1675.06  -122.909    349.028   57.0908      
1 1 1 18 33 21 o 0 284.5   44.9  ?      ?    2283.52 -68.073      768.664  -68.073     258.516   111.927      
1 1 1 20 33 21 o 0 1074.9  65    ?      ?    3096.11 -111.18      2411.22  -111.18     1073.55   -111.18      
1 1 1 21 22 33 o 0 149.3   52.8  ?      ?    1446.28 78.4094      235.035  78.4094     387.491   -101.591     
1 1 1 21 24 33 o 0 976.4   81.1  ?      ?    4451.46 146.788      1562.62  146.788     272.758   -33.2123     
1 1 1 21 26 33 f 1 1378.4  106.7 ?      ?    3633.6  -23.263      2453.13  -23.263     1024.76   -23.263      
1 1 1 21 28 33 o 0 120.2   111   ?      ?    3478.98 82.71        367.628  -97.29      1654.27   -97.29       
1 1 1 21 30 33 o 0 410     143.7 ?      ?    3603.55 -137.242     470.409  -137.242    792.295   42.7582      
1 1 1 21 32 33 f 1 264.9   181.3 ?      ?    1874.64 -7.69056     398.206  -7.69056    215.182   172.309      
1 1 1 1  33 22 o 0 767.9   35    ?      ?    3403.14 -140.117     2170.05  -140.117    374.462   -140.117     
1 1 1 3  33 22 o 0 163.6   24.1  ?      ?    1726.48 173.114      565.503  173.114     334.889   -6.88576     
1 1 1 5  33 22 o 0 1890    67.4  ?      ?    5232.3  -13.8732     3543.51  -13.8732    853.679   -13.8732     
1 1 1 7  33 22 o 0 197.8   24.8  ?      ?    1450.89 90.2455      786.123  90.2455     52.8523   90.2455      
1 1 1 9  33 22 o 0 19      27.4  ?      ?    921.063 -137.078     289.611  42.9216     754.075   42.9216      
1 1 1 11 33 22 o 0 452.8   35.2  ?      ?    2561.07 35.4311      1400.47  35.4311     138.098   35.4311      
1 1 1 13 33 22 f 1 205.7   33.4  ?      ?    2547.8  100.188      420.871  100.188     809.602   -79.8118     
1 1 1 15 33 22 o 0 1552.1  68.9  ?      ?    5090.6  -156.929     2635.25  -156.929    261.925   -156.929     
1 1 1 17 33 22 o 0 14.7    38.1  ?      ?    953.947 -44.3461     259.638  135.654     689.035   135.654      
1 1 1 19 33 22 o 0 220.3   47.1  ?      ?    1718.35 68.9868      608.133  68.9868     136.479   -111.013     
1 1 1 21 33 22 o 0 113.5   60    ?      ?    696.813 -1.74763     73.2859  -1.74763    220.023   178.252      
1 1 1 22 23 33 o 0 1448.3  92.3  ?      ?    4470.39 -6.79708     2332.77  -6.79708    488.004   -6.79708     
1 1 1 22 25 33 o 0 2125.2  124.2 ?      ?    6051.92 -126.951     2584.41  -126.951    213.51    -126.951     
1 1 1 22 27 33 o 0 1616.4  123.3 ?      ?    4551.77 101.752      2350.92  101.752     661.484   101.752      
1 1 1 22 29 33 o 0 187.4   125.2 ?      ?    2317.05 37.7653      177.342  37.7653     638.6     -142.235     
1 1 1 22 31 33 o 0 1214.4  189.7 ?      ?    3289.48 -152.717     1939.74  -152.717    862.629   -152.717     
1 1 1 0  33 23 o 0 342.4   46.3  ?      ?    3625.23 90           1354.67  90          528.229   -90          
1 1 1 2  33 23 o 0 449.8   29.9  ?      ?    2878.07 83.429       1396.09  83.429      84.4096   -96.571      
1 1 1 4  33 23 o 0 1191.1  48.9  ?      ?    5724.91 -158.216     1905.82  -158.216    1054.02   21.7839      
1 1 1 6  33 23 o 0 978.7   45.1  ?      ?    3799.9  -49.6871     2335.79  -49.6871    401.134   -49.6871     
1 1 1 8  33 23 o 0 140     28    ?      ?    1494.03 99.378       367.815  99.378      379.145   -80.622      
1 1 1 10 33 23 o 0 2310.6  86.1  ?      ?    5777.57 70.3344      3630.52  70.3344     802.347   70.3344      
1 1 1 12 33 23 o 0 697.5   44.4  ?      ?    2259.02 -53.1134     2154.24  -53.1134    1074.98   -53.1134     
1 1 1 14 33 23 f 1 419.4   40.7  ?      ?    2701.78 63.8172      1128.88  63.8172     131.733   -116.183     
1 1 1 16 33 23 o 0 195.4   44.8  ?      ?    2580.82 123.445      302.462  123.445     857.686   -56.5546     
1 1 1 18 33 23 o 0 638.7   56.3  ?      ?    2229.14 -126.219     1791.06  -126.219    824.274   -126.219     
1 1 1 20 33 23 o 0 1776.1  94.9  ?      ?    6111.81 -57.4672     2213.14  -57.4672    367.901   122.533      
1 1 1 22 33 23 o 0 -35.6   73    ?      ?    1746.42 -176.984     409.798  3.01589     1114.57   3.01589      
1 1 1 23 24 33 o 0 203     85.3  ?      ?    2884.52 115.634      114.698  115.634     1015.85   -64.3665     
1 1 1 23 26 33 o 0 392.1   97.8  ?      ?    2031.26 106.378      919.369  106.378     164.084   106.378      
1 1 1 23 28 33 o 0 803.2   135.3 ?      ?    3838.97 -91.469      1267.6   -91.469     88.5791   88.531       
1 1 1 23 30 33 o 0 2589.9  207.3 ?      ?    5169.39 67.2126      2941.39  67.2126     1240.98   67.2126      
1 1 1 1  33 24 o 0 1559.7  59.3  ?      ?    5202.08 45.0978      2872.22  45.0978     192.323   45.0978      
1 1 1 3  33 24 o 0 512.2   34.4  ?      ?    3025.23 138.077      1450.31  138.077     91.8066   -41.9226     
1 1 1 5  33 24 o 0 872.7   42.7  ?      ?    3476.91 162.722      2207.61  162.722     459.057   162.722      
1 1 1 7  33 24 o 0 228.6   30.3  ?      ?    1555.07 -74.8747     827.118  -74.8747    57.8147   -74.8747     
1 1 1 9  33 24 o 0 705.6   43.2  ?      ?    2337.43 -47.5225     2181.27  -47.5225    1047.17   -47.5225     
1 1 1 11 33 24 o 0 74.2    34.6  ?      ?    2615.36 17.897       412.466  -162.103    1653.1    -162.103     
1 1 1 13 33 24 o 0 45.1    36.3  ?      ?    1077.51 15.5178      207.608  -164.482    704.898   -164.482     
1 1 1 15 33 24 o 0 587.2   49.2  ?      ?    3148.55 13.1872      1405.21  13.1872     5.45067   -166.813     
1 1 1 17 33 24 o 0 357.2   52.1  ?      ?    2240.95 105.394      999.982  105.394     29.2375   105.394      
1 1 1 19 33 24 o 0 1307.4  80.1  ?      ?    5013.27 -39.5074     1959.51  -39.5074    159.955   140.493      
1 1 1 21 33 24 o 0 1203.8  89.3  ?      ?    4723.05 -165.394     1817.97  -165.394    94.8994   14.606       
1 1 1 23 33 24 o 0 990.8   89.9  ?      ?    4103.96 87.1008      1647.42  87.1008     73.839    87.1008      
1 1 1 24 25 33 o 0 1585.2  120.9 ?      ?    3700.48 -8.93551     2601.96  -8.93551    1219.02   -8.93551     
1 1 1 24 27 33 o 0 276.9   127.5 ?      ?    2439.59 165.845      410.971  165.845     452.032   -14.155      
1 1 1 24 29 33 f 1 346.4   170   ?      ?    2406.94 -94.0183     545.955  -94.0183    252.433   85.9817      
1 1 1 0  33 25 o 0 1949.4  108.9 ?      ?    4644.27 -90          3113.65  -90         765.415   -90          
1 1 1 2  33 25 o 0 597.3   38.4  ?      ?    3093.15 -33.4916     1652.02  -33.4916    101.105   -33.4916     
1 1 1 4  33 25 o 0 2349.2  84.8  ?      ?    7088.23 78.7192      3103.83  78.7192     409.489   -101.281     
1 1 1 6  33 25 o 0 1626.8  65.5  ?      ?    6477.66 -171.366     2240.09  -171.366    924.117   8.63399      
1 1 1 8  33 25 o 0 391.4   39.3  ?      ?    3371.11 26.0229      838.086  26.0229     779.86    -153.977     
1 1 1 10 33 25 o 0 2364.1  94.6  ?      ?    6759.17 -71.3796     3105.26  -71.3796    67.3017   108.62       
1 1 1 12 33 25 o 0 1154.8  61.4  ?      ?    4965.15 -109.86      1940.87  -109.86     334.092   70.1403      
1 1 1 14 33 25 f 1 328.9   49.2  ?      ?    2994.36 -91.0378     681.372  -91.0378    660.627   88.9622      
1 1 1 16 33 25 o 0 771     60.7  ?      ?    3928.95 54.2144      1485.31  54.2144     211.129   -125.786     
1 1 1 18 33 25 f 1 1521.2  87.8  ?      ?    3536.97 -124.65      2848.63  -124.65     1346.38   -124.65      
1 1 1 20 33 25 o 0 1051.5  88.4  ?      ?    4361.2  105.562      1700.54  105.562     68.244    -74.4384     
1 1 1 22 33 25 o 0 1664.6  118.5 ?      ?    4228.51 -84.235      2617.04  -84.235     989.235   -84.235      
1 1 1 24 33 25 o 0 392.3   98.6  ?      ?    3189.32 -61.4811     622.721  -61.4811    544.25    118.519      
1 1 1 25 26 33 o 0 -33.3   118.5 ?      ?    377.741 160.438      36.2207  -19.5621    169.781   -19.5621     
1 1 1 25 28 33 o 0 1358.9  197   ?      ?    3070.75 55.5557      2207.9   55.5557     1194.16   55.5557      
1 1 1 1  33 26 f 1 381.6   43    ?      ?    2586.44 -152.402     1138.68  -152.402    140.918   27.5976      
1 1 1 3  33 26 o 0 286.4   37    ?      ?    3070.36 -75.612      584.62   -75.612     911.764   104.388      
1 1 1 5  33 26 f 1 1125.4  55.5  ?      ?    3743.18 45.8714      2527.59  45.8714     715.928   45.8714      
1 1 1 7  33 26 o 0 421.6   40.4  ?      ?    3008.28 135.306      1048.64  135.306     374.421   -44.6943     
1 1 1 9  33 26 o 0 66.8    40.4  ?      ?    2218.53 -51.507      364.945  128.493     1394.74   128.493      
1 1 1 11 33 26 o 0 1646.9  76.8  ?      ?    5850.42 -130.196     2378.74  -130.196    277.15    49.8038      
1 1 1 13 33 26 o 0 62.2    43.3  ?      ?    1267.85 41.0277      148.578  -138.972    709.483   -138.972     
1 1 1 15 33 26 o 0 95.7    48.9  ?      ?    1108.85 -67.2862     3.3528   -67.2862    479.516   112.714      
1 1 1 17 33 26 o 0 147.6   55.7  ?      ?    1746.76 -97.1227     184.141  -97.1227    551.294   82.8773      
1 1 1 19 33 26 o 0 1292.8  90    ?      ?    4624.37 160.342      1997.47  160.342     123.415   160.342      
1 1 1 21 33 26 f 1 858.5   102   ?      ?    2818.07 -124.46      1823.81  -124.46     730.962   -124.46      
1 1 1 23 33 26 o 0 -104.6  96.1  ?      ?    116.227 -104.806     24.4047  75.1944     66.9032   75.1944      
1 1 1 25 33 26 o 0 214.7   119   ?      ?    1085.46 -124.464     321.019  -124.464    55.1943   55.5361      
1 1 1 26 27 33 o 0 999.1   172.4 ?      ?    1303.82 -95.6542     1973.87  -95.6542    1543.87   -95.6542     
1 1 1 0  33 27 o 0 63.6    58.7  ?      ?    3234.79 -90          333.574  -90         1221.34   90           
1 1 1 2  33 27 o 0 529.7   44.1  ?      ?    2479.49 76.9477      1587.8   76.9476     404.3     76.9476      
1 1 1 4  33 27 o 0 322.2   38.1  ?      ?    2302.99 -72.4478     950.912  -72.4478    136.933   107.552      
1 1 1 6  33 27 o 0 12.1    38.9  ?      ?    1321.32 138.111      382.742  -41.889     998.377   -41.889      
1 1 1 8  33 27 o 0 399.9   46    ?      ?    2210.19 119.897      1214.21  119.897     201.772   119.897      
1 1 1 10 33 27 o 0 759.5   59.4  ?      ?    3639.12 -151.572     1636.87  -151.572    3.42796   -151.572     
1 1 1 12 33 27 o 0 102.3   46.3  ?      ?    1975.26 -148.663     64.1796  31.3371     929.901   31.3371      
1 1 1 14 33 27 o 0 172.5   51.2  ?      ?    2337.67 -54.2495     214.417  -54.2495    796.123   125.75       
1 1 1 16 33 27 o 0 267.2   60.2  ?      ?    2611.61 133.164      510.266  133.164     583.589   -46.8357     
1 1 1 18 33 27 o 0 1086.2  89.3  ?      ?    3915.23 87.4432      1931.69  87.4432     381.045   87.4432      
1 1 1 20 33 27 o 0 268.5   75.9  ?      ?    2706.05 -121.389     440.91   -121.389    602.088   58.611       
1 1 1 22 33 27 o 0 -18     98.7  ?      ?    1276.54 54.0694      191.968  -125.931    659.716   -125.931     
1 1 1 24 33 27 o 0 784.1   144.3 ?      ?    2503.88 85.405       1577.31  85.405      705.27    85.405       
1 1 1 26 33 27 o 0 436     177.5 ?      ?    1169.92 -39.2675     796.446  -39.2675    417.618   -39.2675     
1 1 1 1  33 28 o 0 383.1   47.5  ?      ?    3217.77 108.113      823.921  108.113     678.627   -71.8874     
1 1 1 3  33 28 f 1 299.1   44.5  ?      ?    3158.03 66.3043      535.705  66.3043     935.278   -113.696     
1 1 1 5  33 28 o 0 665.4   50.5  ?      ?    3303.36 -102.701     1577.66  -102.701    65.2175   -102.701     
1 1 1 7  33 28 o 0 873.9   61.8  ?      ?    3241.28 60.7924      2054.22  60.7924     592.204   60.7924      
1 1 1 9  33 28 o 0 1295.3  74.7  ?      ?    4697.28 -128.321     2230.92  -128.321    150.673   -128.321     
1 1 1 11 33 28 o 0 1529.7  87.3  ?      ?    5442    84.2802      2216.56  84.2802     174.164   -95.7198     
1 1 1 13 33 28 o 0 94.9    48.4  ?      ?    2277.4  -173.572     209.851  6.42847     1185.11   6.42847      
1 1 1 15 33 28 o 0 196.3   57.6  ?      ?    2863.38 -60.5612     152.713  -60.5612    1037.87   119.439      
1 1 1 17 33 28 o 0 95.7    67.3  ?      ?    171.55  -14.6953     4.66552  -14.6953    62.9343   165.305      
1 1 1 19 33 28 o 0 422.5   82.7  ?      ?    3524.44 -30.0709     648.701  -30.0709    706.076   149.929      
1 1 1 21 33 28 o 0 4.6     103.4 ?      ?    1340.24 77.9973      161.978  -102.003    652.984   -102.003     
1 1 1 23 33 28 o 0 190.3   134.7 ?      ?    2788.22 -37.2075     80.1507  -37.2075    893.348   142.792      
1 1 1 25 33 28 o 0 -74.3   154.3 ?      ?    223.153 37.3672      11.8421  -142.633    84.4855   -142.633     
1 1 1 0  33 29 o 0 1510.1  115.6 ?      ?    3604.01 -90          2468.58  -90         826.716   -90          
1 1 1 2  33 29 o 0 1152.1  64.3  ?      ?    3639.12 33.0752      2463.37  33.0752     814.835   33.0752      
1 1 1 4  33 29 o 0 733.1   56.6  ?      ?    4071.21 -156.429     1401.45  -156.429    425.817   23.5712      
1 1 1 6  33 29 o 0 165.2   48.2  ?      ?    937.899 147.498      361.805  147.498     53.8056   -32.5019     
1 1 1 8  33 29 o 0 1723.3  89.3  ?      ?    5308.07 -20.7781     2580.02  -20.7781    233.641   -20.7781     
1 1 1 10 33 29 f 1 2198.2  107.4 ?      ?    4388.99 162.978      3529.6   162.978     1616.78   162.978      
1 1 1 12 33 29 o 0 1557.7  93.7  ?      ?    4975.46 -33.8452     2360.36  -33.8452    254.156   -33.8452     
1 1 1 14 33 29 o 0 1539.5  89.4  ?      ?    5231.25 153.008      2172.14  153.008     17.3975   153.008      
1 1 1 16 33 29 o 0 210.1   69.9  ?      ?    2071.72 -29.3952     359.08   -29.3952    451.427   150.605      
1 1 1 18 33 29 o 0 722.8   93.8  ?      ?    4813.05 -123.445     891.282  -123.445    949.821   56.5552      
1 1 1 20 33 29 f 1 -21.9   123.6 ?      ?    780.105 23.2686      71.0728  -156.731    357.789   -156.731     
1 1 1 22 33 29 o 0 1066.4  164   ?      ?    4920.37 -113.019     1332.42  -113.019    385.833   66.9805      
1 1 1 24 33 29 f 1 -1.4    182.8 ?      ?    1826.74 147.851      21.721   -32.1489    621.499   -32.1489     
1 1 1 1  33 30 o 0 1467.3  82.4  ?      ?    4927.17 -134.618     2379.26  -134.618    171.876   -134.618     
1 1 1 3  33 30 o 0 740     67.1  ?      ?    2039.64 18.0195      2067.98  18.0195     1160.42   18.0195      
1 1 1 5  33 30 o 0 282.2   53.7  ?      ?    916.195 22.6958      743.771  22.6958     340.347   22.6958      
1 1 1 7  33 30 o 0 -24     52.8  ?      ?    1573.49 29.9045      461.332  -150.096    1144.5    -150.096     
1 1 1 9  33 30 o 0 395.9   63.2  ?      ?    3121.08 55.7276      776.483  55.7276     554.869   -124.272     
1 1 1 11 33 30 o 0 1192.2  86.6  ?      ?    4934.82 -170.157     1773.66  -170.157    286.881   9.84275      
1 1 1 13 33 30 o 0 1154.5  94    ?      ?    3511.83 -13.7127     2200.32  -13.7127    798.815   -13.7127     
1 1 1 15 33 30 o 0 795.3   79.9  ?      ?    3976.65 157.01       1369.83  157.01      192.155   -22.9897     
1 1 1 17 33 30 f 1 51.1    79.1  ?      ?    1173.53 162.264      109.145  -17.7356    557.405   -17.7356     
1 1 1 19 33 30 o 0 -169.7  112   ?      ?    560.66  145.464      118.821  -34.5361    322.776   -34.5361     
1 1 1 21 33 30 o 0 1734.9  188.8 ?      ?    4241.42 118.885      2436.15  118.885     958.109   118.885      
1 1 1 23 33 30 o 0 454.5   187.3 ?      ?    1488.87 61.6275      877.336  61.6275     390.952   61.6275      
1 1 1 0  33 31 o 0 177.4   100.7 ?      ?    2417.21 -90          551.562  -90         501.764   90           
1 1 1 2  33 31 o 0 2060.1  97    ?      ?    4824.86 98.9084      3193.34  98.9084     1099.66   98.9084      
1 1 1 4  33 31 f 1 3060.2  123.1 ?      ?    7285.03 -131.282     3314.08  -131.282    160.449   -131.282     
1 1 1 6  33 31 o 0 2437.6  111.8 ?      ?    5637.78 -2.11481     3267.5   -2.11481    869.039   -2.11481     
1 1 1 8  33 31 o 0 4.1     61.2  ?      ?    614.535 66.7788      128.08   -113.221    385.51    -113.221     
1 1 1 10 33 31 o 0 1357.8  97.1  ?      ?    3569.58 39.1873      2526.51  39.1873     1088.71   39.1873      
1 1 1 12 33 31 o 0 16.3    71.5  ?      ?    1384.56 -141.427     244.679  38.5734     797.004   38.5734      
1 1 1 14 33 31 o 0 20.6    70    ?      ?    1024.18 158.371      167.647  -21.6294    565.312   -21.6294     
1 1 1 16 33 31 o 0 -123    97.9  ?      ?    1432.03 81.7824      332.358  -98.2177    868.546   -98.2177     
1 1 1 18 33 31 o 0 -16.7   109.2 ?      ?    819.386 27.7718      90.5322  -152.228    386.563   -152.228     
1 1 1 20 33 31 o 0 265.3   146.4 ?      ?    3001.34 -99.2115     244.878  -99.2115    779.4     80.7885      
1 1 1 22 33 31 o 0 835.9   195.1 ?      ?    4034.47 19.9963      1143.03  19.9963     172.642   -160.004     
1 1 1 1  33 32 f 1 251     77.7  ?      ?    1449.05 -4.04528     665.289  -4.04528    50.3196   -4.04528     
1 1 1 3  33 32 o 0 9.5     65.1  ?      ?    790.35  159.854      150.148  -20.1457    481.87    -20.1457     
1 1 1 5  33 32 o 0 136     69.7  ?      ?    2275.59 -164.202     12.5152  15.798      939.974   15.798       
1 1 1 7  33 32 o 0 258.4   67.6  ?      ?    603.673 -92.7584     419.936  -92.7584    177.107   -92.7584     
1 1 1 9  33 32 o 0 396.5   72.1  ?      ?    2305.54 -135.941     980.633  -135.941    56.526    -135.941     
1 1 1 11 33 32 o 0 469.8   78.9  ?      ?    1731.37 87.126       1256.06  87.126      576.375   87.126       
1 1 1 13 33 32 f 1 774.3   91.1  ?      ?    1454.1  -122.466     1919.47  -122.466    1359.47   -122.466     
1 1 1 15 33 32 o 0 948.5   113   ?      ?    2524.92 55.552       1982.3   55.552      1047.71   55.552       
1 1 1 17 33 32 o 0 964.6   134.8 ?      ?    2282.76 -127.22      2000.38  -127.22     1183.14   -127.22      
1 1 1 19 33 32 o 0 685.4   143.5 ?      ?    2536.27 82.2569      1375.57  82.2569     515.735   82.2569      
1 1 1 21 33 32 f 1 246.5   218.1 ?      ?    1048.74 -133.448     360.349  -133.448    17.8093   -133.448     
1 1 1 0  33 33 o 0 13.9    117.1 ?      ?    1555.21 90           138.679  90          485.148   -90          
1 1 1 2  33 33 o 0 -78.8   94.2  ?      ?    789.056 -58.8265     166.882  121.173     482.526   121.173      
1 1 1 4  33 33 o 0 249.8   72.3  ?      ?    1703.8  109.542      601.426  109.542     84.649    -70.458      
1 1 1 6  33 33 o 0 29      68.8  ?      ?    643.459 39.0213      95.4966  -140.979    351.845   -140.979     
1 1 1 8  33 33 o 0 371.1   76.4  ?      ?    2720.29 68.9064      770.625  68.9064     297.434   -111.094     
1 1 1 10 33 33 o 0 874.4   94.1  ?      ?    4623.86 -136.516     1260.92  -136.516    521.265   43.4841      
1 1 1 12 33 33 f 1 -9.1    132   ?      ?    3851.18 56.4308      726.337  -123.569    2178.5    -123.569     
1 1 1 14 33 33 o 0 319     139.6 ?      ?    1840.03 -165.699     633.932  -165.699    37.8503   14.3005      
1 1 1 16 33 33 o 0 390.1   134.6 ?      ?    1645.75 138.6        864.259  138.6       281.738   138.6        
1 1 1 18 33 33 o 0 -128    145.9 ?      ?    643.515 117.204      72.4705  -62.7963    288.693   -62.7963     
1 1 1 20 33 33 o 0 -23.6   179.4 ?      ?    1130.02 -116.141     14.134   63.8588     378.817   63.8588      
1 1 1 0  34 0  o 0 311.6   30.1  ?      ?    1219.47 180          976.423  180         251.752   -180         
1 1 1 0  2  34 o 0 145.2   13.4  ?      ?    1256.71 1.76804e-13  788.318  0           63.5809   -2.01533e-12 
1 1 1 0  4  34 o 0 281     18    ?      ?    3266.82 3.03483e-14  1349.25  0           540.232   -180         
1 1 1 0  6  34 o 0 8.2     11.5  ?      ?    1391.89 -180         52.2426  180         751.857   2.70558e-15  
1 1 1 0  8  34 o 0 885.5   45.7  ?      ?    2279.98 -180         2379.61  180         1069.47   180          
1 1 1 0  10 34 o 0 -5.1    12.6  ?      ?    634.565 -6.91779e-14 11.0594  0           346.474   180          
1 1 1 0  12 34 o 0 1222.7  56.7  ?      ?    3195.4  -1.24274e-14 2732.56  0           956.716   2.30675e-14  
1 1 1 0  14 34 f 1 563.5   30.6  ?      ?    1982.87 -4.01975e-14 1817.5   0           728.996   6.00209e-14  
1 1 1 0  16 34 o 0 336.2   23.7  ?      ?    2505.77 -180         1371.2   180         33.3298   180          
1 1 1 0  18 34 o 0 660.9   41.2  ?      ?    4480.27 4.19624e-15  1947.63  0           442.219   -180         
1 1 1 0  20 34 f 1 42.9    24.6  ?      ?    295.875 180          38.7277  180         115.224   -3.66974e-13 
1 1 1 0  22 34 o 0 2672.8  133.9 ?      ?    5683.43 180          3667.29  180         776.271   -180         
1 1 1 0  24 34 o 0 995.5   68.5  ?      ?    3600.4  1.00529e-14  2153.16  0           391.266   -4.52689e-14 
1 1 1 0  26 34 o 0 426.1   48.1  ?      ?    2234.76 180          1311.17  180         264.927   -180         
1 1 1 0  28 34 o 0 238.4   53.6  ?      ?    2398.64 4.05034e-14  883.363  0           188.232   -180         
1 1 1 0  30 34 o 0 -78.8   104.7 ?      ?    1417.87 180          80.9614  180         529.439   -9.88386e-14 
1 1 1 0  32 34 o 0 491.7   131.5 ?      ?    3134.68 1.60307e-14  1181.34  0           70.8005   -180         
1 1 1 1  3  34 o 0 662.2   22.9  ?      ?    1671.74 -47.2496     2840.53  -47.2496    1876.79   -47.2496     
1 1 1 1  5  34 o 0 620.4   21.8  ?      ?    3647.12 88.2122      1754.06  88.2122     349.774   -91.7878     
1 1 1 1  11 34 o 0 791.3   28.4  ?      ?    4046.67 -22.5182     2015.92  -22.5182    243.118   157.482      
1 1 1 1  13 34 o 0 2623.8  81.5  ?      ?    6511.67 -161.951     4247.39  -161.951    669.256   -161.951     
1 1 1 1  15 34 o 0 728.6   27.3  ?      ?    3511.16 -26.1262     2041.62  -26.1262    150.341   -26.1262     
1 1 1 1  17 34 o 0 783.8   31    ?      ?    3496    69.9963      2218.15  69.9963     332.597   69.9963      
1 1 1 1  19 34 o 0 472.9   26.1  ?      ?    2900.77 -103.969     1494.08  -103.969    26.9199   76.0306      
1 1 1 1  21 34 o 0 475     27.7  ?      ?    3113.91 112.004      1361.24  112.004     219.605   -67.9961     
1 1 1 1  23 34 o 0 322.1   28.9  ?      ?    1335.47 -55.8341     1257.76  -55.8341    592.42    -55.8341     
1 1 1 1  25 34 o 0 213.3   26.9  ?      ?    1721.14 -158.564     703.398  -158.564    120.081   21.4363      
1 1 1 1  27 34 o 0 481.2   40    ?      ?    1556.61 -38.3483     1604.7   -38.3483    893.43    -38.3483     
1 1 1 1  29 34 o 0 363.5   64.9  ?      ?    2710.95 80.6523      843.082  80.6523     353.357   -99.3477     
1 1 1 1  31 34 o 0 134.1   77.5  ?      ?    2968.98 -99.3756     203.802  80.6244     1447.05   80.6244      
1 1 1 1  33 34 o 0 226.2   112.5 ?      ?    1147.16 56.2012      415.328  56.2012     35.6195   -123.799     
1 1 1 0  34 2  o 0 42.1    11.5  ?      ?    1302.1  180          286.641  180         492.783   -1.1817e-13  
1 1 1 2  34 2  o 0 489.4   18    ?      ?    3143.97 119.583      1607.76  119.583     247.259   -60.4166     
1 1 1 2  4  34 f 1 769.6   26.2  ?      ?    2696.26 -153.934     2689.24  -153.934    1129.33   -153.934     
1 1 1 2  8  34 o 0 514.2   19.8  ?      ?    3597.94 -55.0363     1407.04  -55.0363    647.798   124.964      
1 1 1 2  12 34 o 0 550.7   21.3  ?      ?    3352.5  176.075      1622.29  176.075     229.088   -3.92498     
1 1 1 2  14 34 o 0 816.5   29    ?      ?    4241.32 62.9899      1930.59  62.9899     370.193   -117.01      
1 1 1 2  16 34 o 0 919.4   32.6  ?      ?    4789.53 -136.826     1874.53  -136.826    667.264   43.1739      
1 1 1 2  18 34 o 0 593.9   27.8  ?      ?    3038.17 -1.06427     1846.46  -1.06427    235.145   -1.06427     
1 1 1 2  20 34 o 0 411     24.9  ?      ?    2653.71 166.741      1354.97  166.741     10.7068   -13.259      
1 1 1 2  22 34 o 0 413.3   25.9  ?      ?    3371.79 -60.3963     964.121  -60.3963    742.574   119.604      
1 1 1 2  24 34 o 0 1579    62.4  ?      ?    5014.62 85.4143      2836.57  85.4143     393.51    85.4143      
1 1 1 2  26 34 o 0 474.2   36.2  ?      ?    3785.77 -127.794     887.193  -127.794    878.224   52.2055      
1 1 1 2  28 34 o 0 437     50.2  ?      ?    2287.32 133.294      1271.4   133.294     252.994   133.294      
1 1 1 2  30 34 o 0 1132.9  82.8  ?      ?    4440.31 -46.2736     1919.64  -46.2736    13.4754   -46.2736     
1 1 1 2  32 34 o 0 231.2   89.8  ?      ?    849.459 -23.6714     406.447  -23.6714    67.9023   -23.6714     
1 1 1 1  34 3  o 0 701.1   25.3  ?      ?    3497.1  25.8858      2153.29  25.8858     70.4208   25.8858      
1 1 1 3  34 3  o 0 665.8   23.4  ?      ?    2641.62 90.9894      2460.72  90.9894     911.066   90.9894      
1 1 1 3  7  34 o 0 332.8   14.4  ?      ?    2749.66 -40.5447     1136.79  -40.5447    433.095   139.455      
1 1 1 3  9  34 o 0 336.9   15.4  ?      ?    3843.15 -156.06      587.367  -156.06     1567.72   23.9397      
1 1 1 3  11 34 o 0 599.7   23.1  ?      ?    2875.82 108.487      2020.97  108.487     427.301   108.487      
1 1 1 3  13 34 f 1 295.1   15.2  ?      ?    2722.09 -25.878      928.91   -25.878     564.225   154.122      
1 1 1 3  15 34 o 0 339.1   16.9  ?      ?    3030.31 132.117      962.914  132.117     657.401   -47.8828     
1 1 1 3  17 34 o 0 112.1   12.9  ?      ?    1193.79 -84.8359     314.107  -84.8359    325.141   95.1641      
1 1 1 3  19 34 o 0 87.5    15.9  ?      ?    1405.07 -139.136     105.983  -139.136    625.648   40.8644      
1 1 1 3  21 34 o 0 531.8   28.2  ?      ?    2752.1  64.0735      1689.2   64.0735     301.308   64.0735      
1 1 1 3  23 34 f 1 578.6   33    ?      ?    1736.02 103.838      2061.94  103.838     1197.62   103.838      
1 1 1 3  25 34 o 0 246.2   28.9  ?      ?    2063.33 -3.58918     765.106  -3.58918    216.291   176.411      
1 1 1 3  27 34 o 0 1755.4  74    ?      ?    3723.8  137.918      3449.42  137.918     1757.15   137.918      
1 1 1 3  29 34 o 0 299.8   50.6  ?      ?    1817.41 -78.6055     865.28   -78.6055    67.2014   -78.6055     
1 1 1 3  31 34 o 0 232.9   65.3  ?      ?    2545.36 -61.2622     393.534  -61.2622    667.494   118.738      
1 1 1 3  33 34 o 0 920.3   100   ?      ?    2959.98 -28.4222     1926.53  -28.4222    767.689   -28.4222     
1 1 1 0  34 4  o 0 596.2   30.6  ?      ?    4339.24 -1.16679e-14 2041.74  0           563.783   180          
1 1 1 2  34 4  f 1 871.8   29.5  ?      ?    3731.76 -156.854     2501.64  -156.854    280.85    -156.854     
1 1 1 4  10 34 o 0 434.7   18    ?      ?    1735.29 177.461      1940.51  177.461     976.848   177.461      
1 1 1 4  14 34 o 0 176     13.2  ?      ?    707.417 -132.082     690.226  -132.082    309.709   -132.082     
1 1 1 4  16 34 o 0 803.4   30    ?      ?    2590.66 19.8626      2714.47  19.8626     1302.58   19.8626      
1 1 1 4  18 34 o 0 153.6   14.7  ?      ?    749.277 -56.1564     489.553  -56.1564    95.4818   -56.1564     
1 1 1 4  20 34 o 0 96.7    16.8  ?      ?    2475.64 -78.6659     125.35   101.334     1388.97   101.334      
1 1 1 4  22 34 o 0 70.7    17.8  ?      ?    2175.22 155.359      282.081  -24.6414    1374.35   -24.6414     
1 1 1 4  24 34 o 0 150.3   20.6  ?      ?    167.569 169.297      98.6871  169.297     17.6766   169.297      
1 1 1 4  26 34 o 0 1120.1  54.5  ?      ?    6261.21 -7.83407     1325.37  -7.83407    1572.91   172.166      
1 1 1 4  28 34 o 0 -7.2    27.4  ?      ?    921.266 -179.378     321.697  0.622148    729       0.622148     
1 1 1 4  30 34 o 0 7.2     51.5  ?      ?    735.852 50.619       175.554  -129.381    489.341   -129.381     
1 1 1 4  32 34 o 0 510.9   80.3  ?      ?    3553.89 -109.24      908.361  -109.24     518.036   70.7602      
1 1 1 3  34 5  o 0 798     26.6  ?      ?    3351.56 157.809      2491.58  157.809     523.882   157.809      
1 1 1 5  34 5  o 0 850.4   28.6  ?      ?    4129.57 -80.5196     2178.34  -80.5196    205.936   99.4804      
1 1 1 5  9  34 o 0 625.7   23.3  ?      ?    3251.83 14.3532      1924.96  14.3532     117.564   14.3532      
1 1 1 5  11 34 o 0 366.6   17.2  ?      ?    2254.04 76.7739      1455.46  76.7739     217.789   76.7739      
1 1 1 5  15 34 o 0 1679    56.8  ?      ?    4754.54 159.355      3474.23  159.355     956.167   159.355      
1 1 1 5  17 34 o 0 107.1   13.7  ?      ?    1575.73 -57.1182     229.262  -57.1182    606.426   122.882      
1 1 1 5  19 34 o 0 38.4    15.3  ?      ?    1195.77 -135.324     270.256  44.6759     886.954   44.6759      
1 1 1 5  21 34 o 0 462.8   30.5  ?      ?    2326.09 -79.2178     1619.44  -79.2178    457.495   -79.2178     
1 1 1 5  23 34 o 0 788.5   44.5  ?      ?    4044.47 21.8243      1700.88  21.8243     282.792   -158.176     
1 1 1 5  25 34 o 0 528.1   42.2  ?      ?    2432.5  121.815      1610.18  121.815     463.763   121.815      
1 1 1 5  27 34 o 0 2262.9  100.9 ?      ?    5533.18 -81.9526     3374.75  -81.9526    882.63    -81.9526     
1 1 1 5  29 34 o 0 231.2   67.6  ?      ?    1637.42 52.6696      604.526  52.6696     108.284   -127.33      
1 1 1 5  31 34 o 0 721.2   73.8  ?      ?    2694.88 -140.927     1688.49  -140.927    596.655   -140.927     
1 1 1 5  33 34 o 0 171.7   78.4  ?      ?    1773.54 134.081      226.781  134.081     461.939   -45.9193     
1 1 1 0  34 6  o 0 557.3   29    ?      ?    3211.09 180          1971.88  180         45.9333   -180         
1 1 1 2  34 6  o 0 860     29.1  ?      ?    3218.82 -20.5077     2756.67  -20.5077    854.154   -20.5077     
1 1 1 6  10 34 o 0 227.5   13.2  ?      ?    1473.11 132.458      1081.43  132.458     271.426   132.458      
1 1 1 6  12 34 o 0 416.6   18.9  ?      ?    2326.09 -0.190039    1601.38  -0.190039   340.536   -0.190039    
1 1 1 6  14 34 f 1 633     27    ?      ?    1652.91 107.983      2534.61  107.983     1649.87   107.983      
1 1 1 6  16 34 o 0 115.2   14.9  ?      ?    893.913 121.067      318.437  121.067     158.906   -58.9331     
1 1 1 6  18 34 o 0 342.8   23.1  ?      ?    1866.81 48.4721      1399.46  48.4721     428.231   48.4721      
1 1 1 6  20 34 o 0 1351.4  52.9  ?      ?    5491.99 142.837      2392.01  142.837     380.854   -37.1627     
1 1 1 6  22 34 o 0 521.9   35    ?      ?    2073.88 -105.718     1804.42  -105.718    774.307   -105.718     
1 1 1 6  24 34 f 1 997.7   50.4  ?      ?    5775.64 -20.3034     1333.19  -20.3034    1444.55   159.697      
1 1 1 6  26 34 o 0 554.8   48.1  ?      ?    2633.81 141.583      1538.73  141.583     332.561   141.583      
1 1 1 6  28 34 o 0 872.9   73.9  ?      ?    4137.54 73.9295      1602.39  73.9295     232.745   -106.071     
1 1 1 6  30 34 o 0 105.8   78.9  ?      ?    2402.09 -163.569     157.665  16.4306     1171.36   16.4306      
1 1 1 6  32 34 f 1 711.2   77.7  ?      ?    3613.53 68.6267      1332.18  68.6267     111.488   -111.373     
1 1 1 1  34 7  o 0 345.4   14.8  ?      ?    1598.27 170.241      1762.36  170.241     812.621   170.241      
1 1 1 7  9  34 o 0 776.1   29.1  ?      ?    3660.34 150.058      2140.56  150.058     127.409   150.058      
1 1 1 7  11 34 o 0 671.1   27.3  ?      ?    1723.05 -111.365     2680.48  -111.365    1744.71   -111.365     
1 1 1 7  13 34 o 0 1809.9  61.3  ?      ?    5196.77 20.6895      3512.47  20.6895     736.332   20.6895      
1 1 1 7  15 34 o 0 696     29.1  ?      ?    3542.29 -76.421      1945.63  -76.421     25.3217   -76.421      
1 1 1 7  17 34 o 0 355.2   24.8  ?      ?    3525.86 95.1381      773.686  95.1381     1074.01   -84.8619     
1 1 1 7  19 34 o 0 574.6   33.2  ?      ?    3427.62 -24.3931     1540.68  -24.3931    205.695   155.607      
1 1 1 7  21 34 o 0 1419.9  58.3  ?      ?    5431.65 108.116      2435.48  108.116     292.224   -71.8841     
1 1 1 7  23 34 o 0 504     40.2  ?      ?    3453.71 -77.9652     1173.41  -77.9652    499.718   102.035      
1 1 1 7  25 34 o 0 21.7    38.8  ?      ?    633.03  -151.015     162.35   28.9848     456.581   28.9848      
1 1 1 7  27 34 o 0 -20.2   55.9  ?      ?    1706.52 -24.4345     475.309  155.565     1234.48   155.565      
1 1 1 7  29 34 o 0 194.3   69.8  ?      ?    1562.11 -24.8091     416.886  -24.8091    254.819   155.191      
1 1 1 7  31 34 f 1 105.5   87.5  ?      ?    283.013 -14.1877     24.2599  -14.1877    89.6489   165.812      
1 1 1 7  33 34 o 0 1408.4  111.6 ?      ?    3998.57 -66.8711     2327.78  -66.8711    801.487   -66.8711     
1 1 1 0  34 8  o 0 55.3    13.6  ?      ?    55.1758 180          18.2002  180         14.7131   -2.64983e-12 
1 1 1 2  34 8  o 0 378.2   16.8  ?      ?    1725.3  116.8        1840.36  116.8       826.069   116.8        
1 1 1 6  34 8  o 0 233.3   13.5  ?      ?    1292.11 -110.934     1164.29  -110.934    437.303   -110.934     
1 1 1 8  34 8  o 0 415     18.8  ?      ?    2501.42 171.825      1545.21  171.825     164.907   171.825      
1 1 1 8  10 34 o 0 310.5   16.7  ?      ?    2167.35 -21.1727     1241.22  -21.1727    63.3062   -21.1727     
1 1 1 8  12 34 o 0 304.1   17    ?      ?    2348.28 64.1729      1121.66  64.1729     135.811   -115.827     
1 1 1 8  14 34 o 0 1623.9  55    ?      ?    5312.25 -85.0766     3067.2   -85.0766    275.154   -85.0766     
1 1 1 8  16 34 o 0 2853.1  97.6  ?      ?    6460.42 82.5193      4491.27  82.5193     1085.98   82.5193      
1 1 1 8  18 34 o 0 1523.7  60.5  ?      ?    4863.31 -85.1372     3069.35  -85.1372    572.61    -85.1372     
1 1 1 8  20 34 o 0 413.1   32.8  ?      ?    2066.08 9.78437      1536.18  9.78437     507.091   9.78437      
1 1 1 8  22 34 o 0 676.7   40.1  ?      ?    3074.5  105.273      1837.81  105.273     331.571   105.273      
1 1 1 8  24 34 f 1 235     37.7  ?      ?    1107.83 -146.776     814.062  -146.776    288.626   -146.776     
1 1 1 8  26 34 o 0 580     60.9  ?      ?    2453.22 -90.0653     1640.84  -90.0653    533.016   -90.0653     
1 1 1 8  28 34 f 1 973.5   78.6  ?      ?    3700.29 -130.433     1942.57  -130.433    315.194   -130.433     
1 1 1 8  30 34 o 0 357.7   86.9  ?      ?    2078.75 32.7914      935.006  32.7914     70.0647   32.7914      
1 1 1 8  32 34 o 0 1974.9  138.2 ?      ?    5634.64 -168.289     2541.32  -168.289    334.216   -168.289     
1 1 1 1  34 9  o 0 1373.3  44.7  ?      ?    5175.09 52.8894      2929.14  52.8894     122.889   -127.111     
1 1 1 3  34 9  o 0 360.4   16.7  ?      ?    3113.12 178.174      1084.49  178.174     705.392   -1.82648     
1 1 1 5  34 9  o 0 399.7   18.5  ?      ?    2742.75 -111.379     1408.61  -111.379    141.956   68.6208      
1 1 1 7  34 9  o 0 145.9   13.1  ?      ?    1340.5  -41.3556     624.853  -41.3556    119.043   138.644      
1 1 1 9  34 9  f 1 177.6   13.7  ?      ?    1370.36 78.3939      806.179  78.3939     56.9601   78.3939      
1 1 1 9  11 34 o 0 590.4   24.9  ?      ?    3205.08 -36.3574     1772.38  -36.3574    54.0718   -36.3574     
1 1 1 9  13 34 o 0 1217.1  45    ?      ?    3814.34 163.717      3021.21  163.717     1010.8    163.717      
1 1 1 9  15 34 o 0 54      14.9  ?      ?    1295.27 -169.29      150.413  10.7101     836.209   10.7101      
1 1 1 9  17 34 o 0 278.9   24.3  ?      ?    2396.6  -170.694     933.72   -170.694    304.26    9.30554      
1 1 1 9  19 34 o 0 -9.1    6.9   ?      ?    792.1   79.3496      380.334  -100.65     777.996   -100.65      
1 1 1 9  21 34 o 0 1069.2  53.8  ?      ?    5232.06 -47.5189     1803.14  -47.5189    784.985   132.481      
1 1 1 9  23 34 o 0 1372.2  63.5  ?      ?    3542.02 43.4634      3066.24  43.4634     1376.49   43.4634      
1 1 1 9  25 34 o 0 3985.9  150.1 ?      ?    7850.22 164.578      4387.79  164.578     795.479   164.578      
1 1 1 9  27 34 o 0 103.5   70    ?      ?    1014.28 -167.232     79.7155  -167.232    364.439   12.7682      
1 1 1 9  29 34 o 0 386.8   84    ?      ?    2232.88 -151.389     1007.02  -151.389    62.0467   -151.389     
1 1 1 9  31 34 o 0 274.4   96.7  ?      ?    2207.96 39.1209      554.812  39.1209     326.514   -140.879     
1 1 1 9  33 34 o 0 919.5   95.3  ?      ?    4338.01 80.2194      1408.86  80.2194     220.536   -99.7806     
1 1 1 0  34 10 o 0 -26     13.9  ?      ?    1122.93 180          11.4322  180         645.141   -3.52499e-14 
1 1 1 2  34 10 o 0 1082.5  36.4  ?      ?    3944.25 33.3924      2909.18  33.3924     635.793   33.3924      
1 1 1 4  34 10 o 0 2380.7  76.8  ?      ?    5501.16 164.71       4545.52  164.71      1425.11   164.71       
1 1 1 6  34 10 o 0 295.7   16.3  ?      ?    2194.9  28.0623      1193.27  28.0623     29.9114   -151.938     
1 1 1 8  34 10 o 0 193.1   14    ?      ?    1247.36 -40.4622     913.852  -40.4622    232.179   -40.4622     
1 1 1 10 12 34 o 0 485.7   22    ?      ?    1870.57 -172.563     1978.97  -172.563    991.496   -172.563     
1 1 1 10 14 34 o 0 2247.7  77.3  ?      ?    6290.59 40.4022      3710.85  40.4022     369.641   40.4022      
1 1 1 10 16 34 o 0 534.2   28.2  ?      ?    2935.67 161.394      1665.88  161.394     142.139   161.394      
1 1 1 10 18 34 o 0 1108.4  50.8  ?      ?    3203.09 -34.3966     2968.05  -34.3966    1349.58   -34.3966     
1 1 1 10 20 34 o 0 303     31.8  ?      ?    2189.31 -84.1814     1005.28  -84.1814    86.5491   95.8186      
1 1 1 10 22 34 o 0 1198.6  61.6  ?      ?    5331.01 -172.929     1969.65  -172.929    598.748   7.07104      
1 1 1 10 24 34 o 0 1926.9  81.5  ?      ?    6157.24 -16.5829     2720.26  -16.5829    130.227   163.417      
1 1 1 10 26 34 o 0 2824.3  123.4 ?      ?    7320.06 115.32       3249.81  115.32      1.18487   115.32       
1 1 1 10 28 34 o 0 215     74.5  ?      ?    749.371 -153.521     403.727  -153.521    81.736    -153.521     
1 1 1 10 30 34 o 0 604.7   100.1 ?      ?    2648.14 -53.7952     1407.33  -53.7952    346.449   -53.7952     
1 1 1 10 32 34 o 0 292.5   122.7 ?      ?    3005.89 -6.8288      348.681  -6.8288     807.683   173.171      
1 1 1 1  34 11 o 0 961.3   33.2  ?      ?    2662.33 6.5335       3267.3   6.5335      1731.44   6.5335       
1 1 1 3  34 11 o 0 796.8   29.7  ?      ?    2615.9  -46.5404     2796.19  -46.5404    1309.65   -46.5404     
1 1 1 7  34 11 o 0 737.5   27.1  ?      ?    2729.15 143.844      2483.21  143.844     986.216   143.844      
1 1 1 9  34 11 o 0 929.5   34.4  ?      ?    3283.72 -146.917     2675.4   -146.917    911.052   -146.917     
1 1 1 11 34 11 o 0 117.1   14.6  ?      ?    1531.06 83.7896      367.842  83.7896     436.014   -96.2104     
1 1 1 11 13 34 o 0 721.1   30.7  ?      ?    2176.82 -10.7998     2596.74  -10.7998    1438.32   -10.7998     
1 1 1 11 15 34 o 0 177.9   18.8  ?      ?    1168.3  148.478      708.335  148.478     99.8243   148.478      
1 1 1 11 17 34 o 0 2923.2  105.8 ?      ?    7164.16 -36.7877     4071.56  -36.7877    433.209   -36.7877     
1 1 1 11 19 34 o 0 3231    123.8 ?      ?    6793.94 -144.6       4450.8   -144.6      1039.86   -144.6       
1 1 1 11 21 34 o 0 4209.6  158.5 ?      ?    6304.2  48.4597      5623.24  48.4597     2560.55   48.4597      
1 1 1 11 23 34 f 1 2870.2  118.7 ?      ?    4960.55 -176.455     4539.61  -176.455    2203.42   -176.455     
1 1 1 11 25 34 o 0 3145.9  135.6 ?      ?    6119.02 -56.3348     4175.59  -56.3348    1427.97   -56.3348     
1 1 1 11 27 34 o 0 622.1   71.5  ?      ?    1677.94 66.2031      1817.15  66.2031     1086.4    66.2031      
1 1 1 11 29 34 f 1 576.2   92.4  ?      ?    2904.99 -169.156     1282.45  -169.156    70.1036   -169.156     
1 1 1 11 31 34 o 0 304.6   111.9 ?      ?    1624.08 -171.188     699.567  -171.188    64.0752   -171.188     
1 1 1 11 33 34 o 0 308     149.6 ?      ?    849.109 179.598      499.72   179.598     187.15    179.598      
1 1 1 0  34 12 o 0 24.6    15.8  ?      ?    1120.78 180          99.7583  180         546.236   -5.73025e-14 
1 1 1 2  34 12 o 0 1243.1  41.5  ?      ?    2512.74 -94.0098     3969.97  -94.0098    2541.73   -94.0098     
1 1 1 4  34 12 o 0 269.6   16.7  ?      ?    1899.31 97.0694      1190.61  97.0694     127.956   97.0694      
1 1 1 6  34 12 o 0 839.9   29.7  ?      ?    2711.64 -47.5593     2779.95  -47.5593    1289.3    -47.5593     
1 1 1 8  34 12 o 0 1379.8  46.1  ?      ?    5314.87 67.8531      2666.75  67.8531     198.241   -112.147     
1 1 1 10 34 12 o 0 1293.5  45.2  ?      ?    4899.19 -145.992     2644.25  -145.992    60.5043   -145.992     
1 1 1 12 34 12 o 0 137.6   16    ?      ?    1416.96 -117.742     464.468  -117.742    283.41    62.2584      
1 1 1 12 14 34 o 0 68.2    17.9  ?      ?    777.325 -15.0219     23.3323  -15.0219    382.421   164.978      
1 1 1 12 16 34 o 0 103.3   19.8  ?      ?    1542.92 -111.763     196.77   -111.763    589.726   68.2371      
1 1 1 12 18 34 o 0 1430.8  62.2  ?      ?    4287.86 161.862      3063.32  161.862     936.908   161.862      
1 1 1 12 20 34 o 0 -10.5   8.8   ?      ?    1410.06 -69.1853     654.164  110.815     1343.91   110.815      
1 1 1 12 22 34 o 0 646.7   50.6  ?      ?    3603.28 -27.5678     1474.27  -27.5678    227.542   152.432      
1 1 1 12 24 34 o 0 98.8    49.3  ?      ?    2689.17 -76.2763     291.365  103.724     1511.17   103.724      
1 1 1 12 26 34 o 0 1103.5  80.4  ?      ?    2480.44 156.81       2653.4   156.81      1560.36   156.81       
1 1 1 12 28 34 o 0 -0.1    77.7  ?      ?    603.591 112.796      99.597   -67.2041    353.481   -67.2041     
1 1 1 12 30 34 o 0 289     102.6 ?      ?    2313.16 123.905      572.919  123.905     346.072   -56.0946     
1 1 1 12 32 34 o 0 236.2   137.5 ?      ?    1941.7  -87.9513     361.969  -87.9513    365.019   92.0487      
1 1 1 3  34 13 f 1 1597.5  54.2  ?      ?    3171.17 151.041      4321.81  151.041     2538.24   151.041      
1 1 1 5  34 13 o 0 1068.2  38.2  ?      ?    4073.68 -40.7289     2679.46  -40.7289    438.626   -40.7289     
1 1 1 7  34 13 o 0 339.8   18    ?      ?    2925.15 171.803      1024.43  171.803     555.059   -8.19665     
1 1 1 9  34 13 o 0 270.9   17    ?      ?    1534.26 50.6269      1238.93  50.6269     427.462   50.6269      
1 1 1 11 34 13 o 0 191.8   17.4  ?      ?    2884.58 76.7918      319.321  76.7918     1209.58   -103.208     
1 1 1 13 34 13 o 0 1155.6  44.8  ?      ?    4247.21 -142.623     2648.44  -142.623    455.496   -142.623     
1 1 1 13 15 34 o 0 145.5   20.6  ?      ?    2133.56 -93.5316     329.609  -93.5316    760.553   86.4684      
1 1 1 13 17 34 o 0 1510    60.3  ?      ?    5742.58 114.787      2534.96  114.787     323.962   -65.2129     
1 1 1 13 19 34 o 0 1643.8  71.1  ?      ?    4094.38 81.8265      3393.71  81.8265     1380      81.8265      
1 1 1 13 21 34 o 0 837.2   48.8  ?      ?    4836.02 -146.927     1412.67  -146.927    887.354   33.073       
1 1 1 13 23 34 o 0 1663.6  83.2  ?      ?    4915.35 -121.908     2827.4   -121.908    578.645   -121.908     
1 1 1 13 25 34 o 0 817.6   81.5  ?      ?    4035.7  61.8932      1561.9   61.8932     210.053   -118.107     
1 1 1 13 27 34 o 0 653     80.9  ?      ?    3731.03 25.8237      1216.98  25.8237     370.999   -154.176     
1 1 1 13 29 34 o 0 208.9   98    ?      ?    1438.52 -61.1236     391.458  -61.1236    180.106   118.876      
1 1 1 13 31 34 o 0 -46.5   125.9 ?      ?    444.78  161.375      42.9937  -18.6249    212.924   -18.6249     
1 1 1 13 33 34 o 0 838.6   179.9 ?      ?    3094.73 -6.0724      1548.67  -6.0724     436.794   -6.0724      
1 1 1 0  34 14 f 1 269.9   24.4  ?      ?    4120.05 1.07186e-16  1304.51  0           1038.97   -180         
1 1 1 2  34 14 o 0 147.4   14.1  ?      ?    3338.16 159.24       139.523  -20.7599    2002.49   -20.7599     
1 1 1 4  34 14 o 0 178.1   15.7  ?      ?    1262.94 137.623      829.712  137.623     135.683   137.623      
1 1 1 6  34 14 f 1 590.8   24    ?      ?    3410.45 111.054      1677.9   111.054     174.259   -68.9459     
1 1 1 8  34 14 o 0 1193.2  41.2  ?      ?    4125.6  -47.7152     2831.83  -47.7152    647.06    -47.7152     
1 1 1 10 34 14 o 0 903.8   33.6  ?      ?    4099.39 92.6407      2205.81  92.6407     27.4982   92.6407      
1 1 1 12 34 14 o 0 1417.6  50.5  ?      ?    5582.76 -78.1981     2542.15  -78.1981    351.944   101.802      
1 1 1 14 34 14 o 0 2653.9  96.2  ?      ?    7004.29 140.482      3756.29  140.482     225.314   140.482      
1 1 1 14 16 34 o 0 175.9   23.1  ?      ?    2058.29 18.3552      521.669  18.3552     505.619   -161.645     
1 1 1 14 18 34 o 0 2099.4  81.4  ?      ?    5835.67 -4.61493     3323     -4.61493    441.382   -4.61493     
1 1 1 14 20 34 o 0 146.4   36.3  ?      ?    1537    167.973      380.763  167.973     354.273   -12.0266     
1 1 1 14 22 34 o 0 1035.5  62.4  ?      ?    4680.69 159.126      1840.66  159.126     315.838   -20.8735     
1 1 1 14 24 34 o 0 803.6   70.3  ?      ?    2857.29 69.1574      2003.43  69.1574     738.076   69.1574      
1 1 1 14 26 34 o 0 214.6   78.5  ?      ?    3093.07 -60.2009     111.648  -60.2009    1218.25   119.799      
1 1 1 14 28 34 o 0 733.2   98.2  ?      ?    3657.88 154.892      1373.55  154.892     97.0309   -25.1075     
1 1 1 14 30 34 o 0 380.4   111   ?      ?    1966.45 43.9661      931.093  43.9661     169.667   43.9661      
1 1 1 14 32 34 o 0 106.7   152.9 ?      ?    1645.31 -157.191     104.96   -157.191    495.133   22.8092      
1 1 1 1  34 15 o 0 559.4   23.4  ?      ?    2732.68 -155.556     1965.89  -155.556    446.922   -155.556     
1 1 1 3  34 15 o 0 1468.4  51.5  ?      ?    5121.29 -12.6769     2993.39  -12.6769    186.709   -12.6769     
1 1 1 5  34 15 o 0 40      15    ?      ?    821.149 89.6048      138.42   -90.3952    581.187   -90.3952     
1 1 1 7  34 15 o 0 201     17.9  ?      ?    1014.66 -157.802     948.626  -157.802    392.337   -157.802     
1 1 1 9  34 15 o 0 697.6   30.1  ?      ?    5069.44 -39.7085     1170.29  -39.7085    1525.9    140.292      
1 1 1 11 34 15 o 0 1117.7  42.3  ?      ?    5235.05 168.31       2098.2   168.31      621.86    -11.6902     
1 1 1 13 34 15 o 0 316.7   26.5  ?      ?    2629.23 66.9159      982.254  66.9159     348.344   -113.084     
1 1 1 15 34 15 o 0 2180    86.6  ?      ?    5376.92 18.8833      3762.99  18.8833     1121.76   18.8833      
1 1 1 15 17 34 o 0 559.2   39.1  ?      ?    3589.63 -38.5547     1305.45  -38.5547    471.645   141.445      
1 1 1 15 19 34 o 0 1591.2  73.4  ?      ?    5919.92 -126.228     2398.43  -126.228    444.087   53.7721      
1 1 1 15 21 34 o 0 846     55.6  ?      ?    3025.92 42.3208      2132.58  42.3208     730.748   42.3208      
1 1 1 15 23 34 o 0 331.8   53.9  ?      ?    2052.54 -48.9089     994.036  -48.9089    78.6571   -48.9089     
1 1 1 15 25 34 o 0 809.2   77.2  ?      ?    3791.67 -130.111     1567.52  -130.111    76.7451   49.8893      
1 1 1 15 27 34 o 0 169.3   92.1  ?      ?    2594.78 20.5976      61.7311  20.5976     1013.37   -159.402     
1 1 1 15 29 34 o 0 381.4   105.3 ?      ?    2678.15 158.171      790.168  158.171     259.015   -21.8294     
1 1 1 15 31 34 o 0 1056.5  143.3 ?      ?    2517.33 34.7878      2138.82  34.7878     1208.4    34.7878      
1 1 1 15 33 34 o 0 1227.9  186.1 ?      ?    2715.64 153.782      2218.39  153.782     1285.76   153.782      
1 1 1 0  34 16 o 0 382.9   28.4  ?      ?    2600.65 -180         1516.7   180         79.8391   180          
1 1 1 2  34 16 o 0 361.6   22.1  ?      ?    3476.68 -63.5032     856.37   -63.5032    1040.29   116.497      
1 1 1 4  34 16 o 0 225.1   19.1  ?      ?    1693.6  103.117      1026.01  103.117     83.3369   103.117      
1 1 1 6  34 16 o 0 337.9   22.9  ?      ?    2650.99 -97.8651     1134.47  -97.8651    302.053   82.1349      
1 1 1 8  34 16 o 0 91.6    17.8  ?      ?    26.0847 138.804      7.21852  138.804     6.644     -41.1961     
1 1 1 10 34 16 o 0 1106.6  42.9  ?      ?    4743.69 -169.467     2317.18  -169.467    149.025   10.533       
1 1 1 12 34 16 o 0 33.7    21.3  ?      ?    990.001 22.3012      241.534  -157.699    743.609   -157.699     
1 1 1 14 34 16 o 0 168.2   24.7  ?      ?    2152.82 3.70433      442.468  3.70433     619.082   -176.296     
1 1 1 16 34 16 o 0 609.9   36.3  ?      ?    3350.06 -100.723     1528.77  -100.723    99.8108   79.2775      
1 1 1 16 18 34 f 1 1219.4  61.7  ?      ?    4551.42 131.595      2351.15  131.595     147.739   131.595      
1 1 1 16 20 34 o 0 833     55.9  ?      ?    3027.83 -24.4421     2111.19  -24.4421    702.833   -24.4421     
1 1 1 16 22 34 o 0 117.7   37.9  ?      ?    2287.86 122.676      15.7897  -57.3235    1041.72   -57.3235     
1 1 1 16 24 34 o 0 232.9   47.6  ?      ?    3272.19 61.4394      180.714  61.4394     1248.19   -118.561     
1 1 1 16 26 34 o 0 474.4   83.3  ?      ?    3233.12 -167.886     929.121  -167.886    421.844   12.1145      
1 1 1 16 28 34 o 0 1030.1  120.5 ?      ?    3497.66 37.7667      1963.59  37.7667     579.602   37.7667      
1 1 1 16 30 34 o 0 -61.8   125.6 ?      ?    2629.17 -158.593     469.582  21.4069     1452.62   21.4069      
1 1 1 16 32 34 o 0 536.4   121.1 ?      ?    2551.61 -31.728      1117.91  -31.728     215.246   -31.728      
1 1 1 1  34 17 o 0 75.8    16.8  ?      ?    824.553 -107.183     72.7056  -107.183    385.65    72.8173      
1 1 1 3  34 17 o 0 140     19.8  ?      ?    420.019 -153.368     284.176  -153.368    53.8228   -153.368     
1 1 1 5  34 17 o 0 656.7   30.7  ?      ?    3128.18 54.3887      2030.35  54.3887     341.654   54.3887      
1 1 1 7  34 17 o 0 168.1   19.4  ?      ?    3007.34 -68.7389     129.329  -68.7389    1464.95   111.261      
1 1 1 9  34 17 o 0 640.9   30.7  ?      ?    2360.58 44.4101      2235     44.4101     1009.13   44.4101      
1 1 1 11 34 17 o 0 549.3   31    ?      ?    2578.15 117.6        1824.5   117.6       516.549   117.6        
1 1 1 13 34 17 o 0 100.1   24.4  ?      ?    1118.36 -39.6524     211.091  -39.6524    341.468   140.348      
1 1 1 15 34 17 o 0 27.7    30.2  ?      ?    1012.17 -167.11      266.334  12.8903     760.277   12.8903      
1 1 1 17 34 17 o 0 139.4   34.9  ?      ?    1685.33 -131.628     313.014  -131.628    481.996   48.3717      
1 1 1 17 19 34 o 0 489.8   45.5  ?      ?    2909.32 -21.0101     1306.02  -21.0101    52.6171   158.99       
1 1 1 17 21 34 f 1 512     49.6  ?      ?    3393.35 107.623      1107.04  107.623     429.226   -72.3772     
1 1 1 17 23 34 o 0 583.9   54.6  ?      ?    2650.91 34.706       1520.62  34.706      372.742   34.706       
1 1 1 17 25 34 f 1 336.3   55.4  ?      ?    2278.71 21.1344      845.348  21.1344     118.756   -158.866     
1 1 1 17 27 34 o 0 1124.3  90.7  ?      ?    4050.77 109.429      1939.11  109.429     344.325   109.429      
1 1 1 17 29 34 o 0 2878.2  159.5 ?      ?    6198.74 -83.8434     3239.82  -83.8434    887.352   -83.8434     
1 1 1 17 31 34 o 0 948.7   121.3 ?      ?    3190.13 106.044      1743.84  106.044     602.398   106.044      
1 1 1 17 33 34 o 0 333     160.1 ?      ?    2376.89 15.2605      525.988  15.2605     263.744   -164.739     
1 1 1 0  34 18 o 0 -11.2   25.7  ?      ?    152.139 180          4.57027  180         79.2634   -2.68502e-13 
1 1 1 2  34 18 o 0 743     32.7  ?      ?    3795.87 133.13       1976.85  133.13      90.1728   -46.8704     
1 1 1 4  34 18 o 0 678.8   32    ?      ?    3287.03 -86.3597     2009.54  -86.3597    245.077   -86.3597     
1 1 1 6  34 18 o 0 -10.1   21.4  ?      ?    1362.12 97.0283      587.211  -82.9717    1306.25   -82.9717     
1 1 1 8  34 18 o 0 369.3   24.3  ?      ?    3540.48 -56.0886     812.743  -56.0886    1020.61   123.911      
1 1 1 10 34 18 o 0 198.3   24.8  ?      ?    2744.6  20.937       395.206  20.937      995.235   -159.063     
1 1 1 12 34 18 o 0 362.7   29.8  ?      ?    3388.93 114.448      816.997  114.448     857.704   -65.5522     
1 1 1 14 34 18 o 0 434.4   35.6  ?      ?    3014.87 142.054      1148.84  142.054     325.286   -37.9462     
1 1 1 16 34 18 f 1 1036.4  54.7  ?      ?    3788.87 -12.1356     2287.41  -12.1356    482.965   -12.1356     
1 1 1 18 34 18 o 0 51.4    38.2  ?      ?    2348.04 -94.7258     465.9    85.2742     1538.38   85.2742      
1 1 1 18 20 34 o 0 -25.3   43.4  ?      ?    1462.24 122.987      477.872  -57.0129    1137.71   -57.0129     
1 1 1 18 22 34 o 0 506.5   52.5  ?      ?    2799.48 -19.7351     1272.78  -19.7351    55.9802   -19.7351     
1 1 1 18 24 34 o 0 3003.4  139.1 ?      ?    7282.73 -175.764     3207.87  -175.764    127.911   -175.764     
1 1 1 18 26 34 o 0 4105.1  183.4 ?      ?    7099.34 -44.0617     4204.29  -44.0617    1390.63   -44.0617     
1 1 1 18 28 34 o 0 749.2   100.6 ?      ?    3488.73 -170.2       1393.41  -170.2      58.6073   -170.2       
1 1 1 18 30 34 o 0 927     124.3 ?      ?    3389.48 57.7092      1656.09  57.7092     431.589   57.7092      
1 1 1 18 32 34 o 0 794.9   142   ?      ?    3725.79 -50.3872     1250.66  -50.3872    1.10678   129.613      
1 1 1 1  34 19 o 0 565.7   29.3  ?      ?    3650.25 152.37       1495.97  152.37      473.43    -27.63       
1 1 1 3  34 19 o 0 683.5   31.5  ?      ?    3733.37 -103.746     1795.15  -103.746    193.699   76.2536      
1 1 1 5  34 19 o 0 507.4   30    ?      ?    1998.7  38.839       1973.72  38.839      925.07    38.839       
1 1 1 7  34 19 o 0 -0.4    22.6  ?      ?    921.413 -160.994     359.36   19.0059     834.273   19.0059      
1 1 1 9  34 19 o 0 539.4   31.4  ?      ?    3989.59 -165.163     1163.33  -165.163    851.392   14.8372      
1 1 1 11 34 19 o 0 234.4   28.5  ?      ?    1551.85 21.9833      867.903  21.9833     88.6934   21.9833      
1 1 1 13 34 19 o 0 397.2   33.1  ?      ?    2787.84 2.9904       1115.79  2.9904      247.42    -177.01      
1 1 1 15 34 19 o 0 634.8   41.7  ?      ?    2593.68 -52.654      1858.3   -52.654     627.603   -52.654      
1 1 1 17 34 19 o 0 251.4   38.5  ?      ?    2755.73 163.203      529.105  163.203     734.698   -16.7968     
1 1 1 19 34 19 o 0 24.1    41.7  ?      ?    1532.29 -3.30609     371.75   176.694     1046.93   176.694      
1 1 1 19 21 34 o 0 1508.3  81.7  ?      ?    5521.88 -113.775     2201.77  -113.775    203.53    66.2254      
1 1 1 19 23 34 o 0 861.1   74.1  ?      ?    2777.75 92.8993      2004.95  92.8993     825.999   92.8993      
1 1 1 19 25 34 o 0 154.3   66.8  ?      ?    1532.77 161.766      189.232  161.766     421.283   -18.2342     
1 1 1 19 27 34 o 0 1433.4  109.7 ?      ?    4120.09 -110.308     2333.01  -110.308    746.484   -110.308     
1 1 1 19 29 34 o 0 1287.6  138.9 ?      ?    3485.78 18.1225      2193.57  18.1225     924.324   18.1225      
1 1 1 19 31 34 o 0 1239.1  151.7 ?      ?    2276.47 -90.1457     2328.81  -90.1457    1556.78   -90.1457     
1 1 1 0  34 20 f 1 1806.2  87.3  ?      ?    6436.7  180          3219.13  180         233.102   7.76052e-14  
1 1 1 2  34 20 o 0 168.1   22.8  ?      ?    992.507 -58.9054     637.326  -58.9054    113.72    -58.9054     
1 1 1 4  34 20 o 0 400.4   26.3  ?      ?    2782.24 -6.89642     1276.01  -6.89642    171.969   173.104      
1 1 1 6  34 20 o 0 51.1    22.5  ?      ?    724.443 128.467      83.4045  -51.5327    454.362   -51.5327     
1 1 1 8  34 20 o 0 70.3    25.2  ?      ?    584.565 -126.588     23.2545  -126.588    270.471   53.4123      
1 1 1 10 34 20 o 0 528.1   32.5  ?      ?    2712.54 141.25       1602.31  141.25      244.993   141.25       
1 1 1 12 34 20 o 0 1098.2  51.9  ?      ?    4890.34 -15.5823     1998.57  -15.5823    388.468   164.418      
1 1 1 14 34 20 o 0 645.9   44.1  ?      ?    4043.88 -90.4431     1291.47  -90.4431    627.401   89.5569      
1 1 1 16 34 20 o 0 776.6   49.4  ?      ?    3561.35 117.669      1747.07  117.669     112.935   117.669      
1 1 1 18 34 20 o 0 344     50    ?      ?    2969.68 -39.2078     741.656  -39.2078    572.444   140.792      
1 1 1 20 34 20 o 0 1743.9  89    ?      ?    4869.81 113.264      2755.06  113.264     686.506   113.264      
1 1 1 20 22 34 o 0 500.1   66.7  ?      ?    1974.44 -98.1511     1412.27  -98.1511    572.662   -98.1511     
1 1 1 20 24 34 f 1 1715.8  104.2 ?      ?    5250.81 6.70867      2372.11  6.70867     219.164   6.70867      
1 1 1 20 26 34 o 0 586.3   90.4  ?      ?    2685.05 155.152      1313.3   155.152     274.475   155.152      
1 1 1 20 28 34 o 0 -223.2  109.1 ?      ?    1465.37 11.0589      359.957  -168.941    896.824   -168.941     
1 1 1 20 30 34 o 0 2405.1  192.6 ?      ?    4974.31 -159.709     2948.73  -159.709    1248.91   -159.709     
1 1 1 20 32 34 o 0 -431.5  188.3 ?      ?    1554.41 34.8109      264.058  -145.189    765.89    -145.189     
1 1 1 1  34 21 o 0 17.4    23.1  ?      ?    1349.16 -76.7065     453.305  103.293     1156.58   103.293      
1 1 1 3  34 21 o 0 955.1   41.6  ?      ?    3480.82 44.4204      2551.44  44.4204     758.261   44.4204      
1 1 1 5  34 21 o 0 12.5    24.2  ?      ?    1396.03 87.9145      476.397  -92.0855    1185.18   -92.0855     
1 1 1 7  34 21 o 0 502     31    ?      ?    2407.91 -159.069     1664.44  -159.069    441.555   -159.069     
1 1 1 9  34 21 o 0 456.2   34.1  ?      ?    2051.3  29.6175      1606.14  29.6175     585.137   29.6175      
1 1 1 11 34 21 o 0 1389.7  60.8  ?      ?    3892.6  -96.7784     3004.47  -96.7784    1111.38   -96.7784     
1 1 1 13 34 21 o 0 762.4   48.6  ?      ?    3538.43 -152.752     1796.22  -152.752    120.346   -152.752     
1 1 1 15 34 21 o 0 637.5   48.2  ?      ?    2351.1  95.8972      1857.1   95.8972     778.246   95.8972      
1 1 1 17 34 21 f 1 173.4   43.6  ?      ?    3340.47 -129.648     76.3459  50.3523     1566.09   50.3523      
1 1 1 19 34 21 o 0 413.8   54.5  ?      ?    2927.1  106.389      943.397  106.389     305.528   -73.6112     
1 1 1 21 34 21 o 0 1761.8  98.5  ?      ?    5666.17 -68.4235     2326.48  -68.4235    20.6065   111.576      
1 1 1 21 23 34 o 0 842.8   79.2  ?      ?    3201.6  -123.085     1748.8   -123.085    441.36    -123.085     
1 1 1 21 25 34 o 0 234.7   82.8  ?      ?    1951.29 29.6273      453.02   29.6273     304.185   -150.373     
1 1 1 21 27 34 o 0 90      99.3  ?      ?    2939.67 -56.3798     317.479  123.62      1399.23   123.62       
1 1 1 21 29 34 o 0 843.6   157.8 ?      ?    3326.92 -9.33179     1467.88  -9.33179    305.31    -9.33179     
1 1 1 21 31 34 o 0 1716.3  196.6 ?      ?    4423.69 95.0176      2215.64  95.0176     777.058   95.0176      
1 1 1 0  34 22 o 0 49.7    34.5  ?      ?    355.841 -9.94308e-14 46.0114  0           140.064   180          
1 1 1 2  34 22 o 0 105.7   27    ?      ?    1153.41 -158.368     188.508  -158.368    408.761   21.632       
1 1 1 4  34 22 o 0 583.3   33.9  ?      ?    3545.28 117.507      1442.35  117.507     370.266   -62.4925     
1 1 1 6  34 22 o 0 455.7   32.9  ?      ?    3428.28 -56.8964     1075.81  -56.8964    649.855   123.104      
1 1 1 8  34 22 o 0 2306.1  85.5  ?      ?    5520.56 69.7382      3779.58  69.7382     1051.64   69.7382      
1 1 1 10 34 22 o 0 1814.7  75.7  ?      ?    4420.5  -41.1731     3470.42  -41.1731    1332.51   -41.1731     
1 1 1 12 34 22 o 0 1269.2  61.3  ?      ?    4372.7  142.239      2488.34  142.239     425.202   142.239      
1 1 1 14 34 22 o 0 609.3   46.8  ?      ?    3134.92 -119.606     1501.36  -119.606    65.5868   -119.606     
1 1 1 16 34 22 o 0 499     50.8  ?      ?    4159.7  90.7333      760.107  90.7333     1084.79   -89.2667     
1 1 1 18 34 22 o 0 720.5   60.9  ?      ?    4328.05 74.782       1204.46  74.782      646.56    -105.218     
1 1 1 20 34 22 o 0 318.4   61.3  ?      ?    3738.66 -117.956     300.459  -117.956    1255.6    62.0439      
1 1 1 22 34 22 o 0 781     84.3  ?      ?    3614.49 -150.753     1438.86  -150.753    2.08386   -150.753     
1 1 1 22 24 34 o 0 157.4   81.3  ?      ?    1312.81 52.933       202.194  52.933      307.883   -127.067     
1 1 1 22 26 34 o 0 710.5   109.3 ?      ?    5095.03 -82.0571     725.149  -82.0571    1154.7    97.9429      
1 1 1 22 28 34 f 1 534.2   140.9 ?      ?    2152.01 -146.24      1174.63  -146.24     415.314   -146.24      
1 1 1 22 30 34 o 0 1192.6  197.8 ?      ?    3050.68 -29.5854     1959.86  -29.5854    962.344   -29.5854     
1 1 1 1  34 23 o 0 87      29    ?      ?    2651.04 115.472      345.898  -64.5282    1698.5    -64.5282     
1 1 1 3  34 23 f 1 527     34.5  ?      ?    3307.92 -0.977338    1351.74  -0.977338   327.402   179.023      
1 1 1 5  34 23 o 0 -11.8   28.9  ?      ?    1056.4  -63.4613     405.123  116.539     931.064   116.539      
1 1 1 7  34 23 o 0 223     32.6  ?      ?    2083.82 -75.1754     673.266  -75.1754    346.972   104.825      
1 1 1 9  34 23 o 0 711.2   45.2  ?      ?    3712.06 -139.129     1619.75  -139.129    162.101   40.8714      
1 1 1 11 34 23 f 1 21.3    37.6  ?      ?    917.212 137.382      226.346  -42.6181    659.061   -42.6181     
1 1 1 13 34 23 o 0 1274.4  66.3  ?      ?    4894.48 3.7332       2181.39  3.7332      51.5738   -176.267     
1 1 1 15 34 23 o 0 -47     45.8  ?      ?    1122.69 -153.597     373.828  26.4025     870.819   26.4025      
1 1 1 17 34 23 o 0 764.3   65.2  ?      ?    4361.09 -34.736      1287.27  -34.736     578.352   145.264      
1 1 1 19 34 23 o 0 215.6   61.9  ?      ?    2919.18 -74.3589     214.263  -74.3589    1003.87   105.641      
1 1 1 21 34 23 o 0 2170.4  118.1 ?      ?    4536.29 121.748      3170.19  121.748     1357.78   121.748      
1 1 1 23 34 23 o 0 430.2   91.2  ?      ?    3024.5  15.7268      809.8    15.7268     333.593   -164.273     
1 1 1 23 25 34 o 0 910.5   112.4 ?      ?    3837.73 -177.198     1516.94  -177.198    99.7799   -177.198     
1 1 1 23 27 34 o 0 292     127.8 ?      ?    1983.94 147.516      545.96   147.516     151.686   -32.4844     
1 1 1 23 29 34 o 0 1499.1  181.4 ?      ?    4682.05 136.478      1927.89  136.478     391.349   136.478      
1 1 1 0  34 24 o 0 54.2    54.4  ?      ?    919.817 5.60118e-15  122.277  0           338.963   -180         
1 1 1 2  34 24 o 0 357.2   35.2  ?      ?    2667.09 -104.759     1038.08  -104.759    287.895   75.2411      
1 1 1 4  34 24 o 0 1618.5  65.3  ?      ?    5401.57 -38.4358     2747.48  -38.4358    93.4882   -38.4358     
1 1 1 6  34 24 f 1 956.1   48    ?      ?    3902.01 118.634      2117.38  118.634     217.809   118.634      
1 1 1 8  34 24 f 1 204     34.6  ?      ?    1908.8  -125.464     608.245  -125.464    304.455   54.5361      
1 1 1 10 34 24 o 0 210.4   43.7  ?      ?    3357.3  77.2978      99.2665  77.2978     1461.27   -102.702     
1 1 1 12 34 24 o 0 1285.4  68.8  ?      ?    3715.47 -158.337     2676.9   -158.337    991.736   -158.337     
1 1 1 14 34 24 o 0 1243.2  69.1  ?      ?    4752.15 -53.006      2112.93  -53.006     17.4558   -53.006      
1 1 1 16 34 24 o 0 92.5    52.1  ?      ?    1035.91 -18.9178     3.67733  161.082     452.171   161.082      
1 1 1 18 34 24 o 0 -45     58.4  ?      ?    662.648 170.46       185.279  -9.54043    461.914   -9.54043     
1 1 1 20 34 24 f 1 1403.7  97.8  ?      ?    4881.72 -48.8372     2033.15  -48.8372    66.0733   -48.8372     
1 1 1 22 34 24 o 0 602.3   103.5 ?      ?    3019.45 104.08       1222.8   104.08      75.055    104.08       
1 1 1 24 34 24 o 0 -25     105.9 ?      ?    882.849 -65.846      117.303  114.154     434.492   114.154      
1 1 1 24 26 34 o 0 1045.2  135.9 ?      ?    4972.35 73.7728      1307.9   73.7728     441.328   -106.227     
1 1 1 24 28 34 o 0 23.4    165.4 ?      ?    919.121 49.7902      34.8349  49.7902     267.346   -130.21      
1 1 1 1  34 25 o 0 1403.6  61.6  ?      ?    3853.83 -113.113     3060.81  -113.113    1178.38   -113.113     
1 1 1 3  34 25 o 0 2476.3  90.6  ?      ?    5643.34 144.306      3879.87  144.306     1149.78   144.306      
1 1 1 5  34 25 o 0 598.1   44.7  ?      ?    3645.16 -94.5073     1343.61  -94.5073    397.254   85.4927      
1 1 1 7  34 25 o 0 750.2   48.2  ?      ?    3681.51 63.4195      1674.07  63.4195     53.5536   -116.58      
1 1 1 9  34 25 o 0 1083.5  60.5  ?      ?    3543.92 -22.5772     2409.26  -22.5772    777.973   -22.5772     
1 1 1 11 34 25 o 0 593.7   51.5  ?      ?    3243.44 8.12889      1392.21  8.12889     67.319    -171.871     
1 1 1 13 34 25 o 0 520     54.9  ?      ?    4083.11 -163.377     836.697  -163.377    953.124   16.6228      
1 1 1 15 34 25 o 0 2372.1  107.6 ?      ?    6876.32 -130.04      2723.11  -130.04     242.473   49.9597      
1 1 1 17 34 25 f 1 74.5    61.3  ?      ?    2159.84 46.2478      263.09   -133.752    1168.33   -133.752     
1 1 1 19 34 25 o 0 362.2   75.4  ?      ?    2746    -153.821     739.508  -153.821    339.669   26.1786      
1 1 1 21 34 25 o 0 -78.3   88.7  ?      ?    430.516 75.3878      91.8864  -104.612    256.056   -104.612     
1 1 1 23 34 25 o 0 155.9   102.3 ?      ?    1456.29 55.5329      151.637  55.533      374.661   -124.467     
1 1 1 25 34 25 o 0 381.2   126.4 ?      ?    1780.16 -128.669     806.99   -128.669    197.496   -128.669     
1 1 1 25 27 34 f 1 1224.7  167.8 ?      ?    4467.91 -101.603     1640.44  -101.603    163.313   -101.603     
1 1 1 0  34 26 o 0 1587.9  102.3 ?      ?    4496.83 180          2658.79  180         509.619   180          
1 1 1 2  34 26 o 0 90.5    37.4  ?      ?    2626.35 37.3924      334.119  -142.608    1580.18   -142.608     
1 1 1 4  34 26 o 0 537.7   45.6  ?      ?    2321.54 85.5636      1636     85.5636     546.32    85.5636      
1 1 1 6  34 26 o 0 1411    64.1  ?      ?    6324.72 -157.141     1826.29  -157.141    1100.99   22.8591      
1 1 1 8  34 26 o 0 227.8   54.3  ?      ?    2649.47 47.5065      424.583  47.5065     780.588   -132.493     
1 1 1 10 34 26 o 0 865.9   63.1  ?      ?    3462.25 -134.723     1926.42  -134.723    383.841   -134.723     
1 1 1 12 34 26 o 0 99.5    48    ?      ?    176.429 99.5684      11.9855  99.5684     65.8029   -80.4316     
1 1 1 14 34 26 o 0 1079.3  74.5  ?      ?    4187.27 141.613      1923.23  141.613     128.05    141.613      
1 1 1 16 34 26 o 0 -89.8   61.8  ?      ?    812.288 -179.494     247.384  0.505919    584.643   0.505919     
1 1 1 18 34 26 o 0 155.9   68.1  ?      ?    1125.75 6.44111      200.265  6.44111     241.493   -173.559     
1 1 1 20 34 26 o 0 -13.9   87    ?      ?    1732.81 138.733      311.634  -41.2668    973.045   -41.2668     
1 1 1 22 34 26 o 0 25.9    109.2 ?      ?    2212.03 157.417      269.018  -22.5829    1071.29   -22.5829     
1 1 1 24 34 26 o 0 496.4   128.5 ?      ?    2076.91 -81.4386     1087.92  -81.4386    372.318   -81.4386     
1 1 1 26 34 26 o 0 286.9   160.7 ?      ?    4344.4  -178.081     89.618   1.91923     1480.61   1.91923      
1 1 1 1  34 27 o 0 293.7   46.4  ?      ?    2307.85 155.704      821.935  155.704     250.739   -24.2963     
1 1 1 3  34 27 o 0 521.2   50.6  ?      ?    3068.55 -111.071     1293.62  -111.071    120.633   68.9295      
1 1 1 5  34 27 o 0 2112.7  86.1  ?      ?    5462.56 69.6497      3242.01  69.6497     754.174   69.6497      
1 1 1 7  34 27 o 0 262.2   46.1  ?      ?    909.668 -119.452     744.409  -119.452    336.406   -119.452     
1 1 1 9  34 27 o 0 32.8    53.3  ?      ?    1487.68 157.74       282.579  -22.2597    937.45    -22.2597     
1 1 1 11 34 27 o 0 320.5   59.3  ?      ?    2018.51 -6.40115     889.749  -6.40115    8.69623   -6.40115     
1 1 1 13 34 27 o 0 164.6   53.7  ?      ?    2153.43 -168.114     195.058  -168.114    720.783   11.8857      
1 1 1 15 34 27 o 0 190.5   61.8  ?      ?    1562.02 118.942      392.048  118.942     252.688   -61.0577     
1 1 1 17 34 27 o 0 114.6   71.2  ?      ?    1168.82 104.311      54.0859  104.311     402.91    -75.6887     
1 1 1 19 34 27 o 0 63.5    89.2  ?      ?    1040.2  -42.4557     48.409   137.544     444.951   137.544      
1 1 1 21 34 27 o 0 734.2   109.9 ?      ?    3379.12 108.446      1316.68  108.446     89.567    108.446      
1 1 1 23 34 27 o 0 623.9   137.4 ?      ?    3340.62 -162.43      1053.9   -162.43     101.668   17.5696      
1 1 1 25 34 27 f 1 27.6    158.4 ?      ?    1627.86 126.837      15.0304  -53.1631    542.751   -53.1631     
1 1 1 0  34 28 o 0 1068.2  100.5 ?      ?    2607.57 180          2064.9   180         880.791   -180         
1 1 1 2  34 28 o 0 74.5    49.7  ?      ?    2000.82 40.7302      234.687  -139.27     1137.85   -139.27      
1 1 1 4  34 28 o 0 701.3   57.3  ?      ?    3592.88 -80.5055     1510.77  -80.5055    95.5261   99.4945      
1 1 1 6  34 28 o 0 928.5   63.1  ?      ?    4114.26 125.417      1745.15  125.417     95.4474   -54.5831     
1 1 1 8  34 28 f 1 289.2   56    ?      ?    645.537 -56.6286     623.264  -56.6286    337.634   -56.6286     
1 1 1 10 34 28 o 0 544.6   66.4  ?      ?    1248.44 53.9681      1610.97  53.9681     1072.66   53.9681      
1 1 1 12 34 28 o 0 322.1   67.3  ?      ?    2664.71 -129.998     682.581  -129.998    439.26    50.0016      
1 1 1 14 34 28 o 0 1821.6  98    ?      ?    4864.21 57.6277      2715.2   57.6277     763.017   57.6277      
1 1 1 16 34 28 o 0 76.3    70.5  ?      ?    749.607 -151.216     29.1298  28.7838     324.442   28.7838      
1 1 1 18 34 28 o 0 575.6   93.5  ?      ?    2010.11 141.441      1424.21  141.441     660.568   141.441      
1 1 1 20 34 28 o 0 52.3    100.9 ?      ?    1231.6  -99.1755     72.8727  80.8245     519.685   80.8245      
1 1 1 22 34 28 f 1 442.4   138.8 ?      ?    1025.83 171.017      934.078  171.017     576.643   171.017      
1 1 1 24 34 28 o 0 715.8   180   ?      ?    1765.95 86.0554      1460.3   86.0554     888.528   86.0554      
1 1 1 1  34 29 o 0 200.8   66.4  ?      ?    1716.09 93.8759      451.445  93.8759     315.73    -86.1241     
1 1 1 3  34 29 o 0 714.6   64.3  ?      ?    2717.3  -91.3247     1798.51  -91.3247    592.43    -91.3247     
1 1 1 5  34 29 o 0 730.9   65.3  ?      ?    3514.62 143.686      1526.32  143.686     16.802    -36.3143     
1 1 1 7  34 29 o 0 1125.5  77    ?      ?    3574.95 58.0639      2260.93  58.0639     713.851   58.0639      
1 1 1 9  34 29 o 0 1688.5  97.3  ?      ?    4590.78 -95.5883     2711.79  -95.5883    760.712   -95.5883     
1 1 1 11 34 29 f 1 76.3    65.6  ?      ?    2448.57 65.2272      322.287  -114.773    1346.25   -114.773     
1 1 1 13 34 29 o 0 801.5   75.9  ?      ?    2903.02 -159.422     1758.18  -159.422    604.89    -159.422     
1 1 1 15 34 29 o 0 877.2   82.3  ?      ?    2683.08 32.1815      1936.88  32.1815     888.251   32.1815      
1 1 1 17 34 29 o 0 259.2   93.9  ?      ?    2161.34 98.802       473.404  98.802      343.06    -81.198      
1 1 1 19 34 29 o 0 -127.4  102.4 ?      ?    614.243 -95.1875     128.16   84.8125     350.283   84.8125      
1 1 1 21 34 29 o 0 94.5    147.7 ?      ?    1512.92 24.1369      95.6368  24.1369     428.209   -155.863     
1 1 1 23 34 29 o 0 36      209.3 ?      ?    603.286 -47.752      82.0931  -47.752     113.63    132.248      
1 1 1 0  34 30 o 0 1653.8  136.5 ?      ?    4666.55 180          2431.29  180         399.193   -180         
1 1 1 2  34 30 o 0 2198    102.7 ?      ?    5691.38 22.4084      3013.09  22.4084     546.074   22.4084      
1 1 1 4  34 30 o 0 2731.4  115.3 ?      ?    7094.7  115.111      3043.84  115.111     5.64838   -64.8892     
1 1 1 6  34 30 o 0 871.8   76.3  ?      ?    3216.75 -73.9908     1873.06  -73.9908    507.136   -73.9908     
1 1 1 8  34 30 o 0 441.6   69.9  ?      ?    3495.6  -138.451     755.075  -138.451    705.894   41.5493      
1 1 1 10 34 30 o 0 78.8    69.1  ?      ?    1797.66 -76.489      160.021  103.511     882.138   103.511      
1 1 1 12 34 30 o 0 745.3   86.7  ?      ?    2067.41 126.251      1866.1   126.251     1043.97   126.251      
1 1 1 14 34 30 o 0 40.1    75    ?      ?    1833.33 14.8784      265.793  -165.122    975.072   -165.122     
1 1 1 16 34 30 o 0 -51.4   86.5  ?      ?    1608.85 -130.988     342.122  49.0117     942.075   49.0117      
1 1 1 18 34 30 o 0 17      104.5 ?      ?    1666.18 161.426      180.627  -18.5744    779.869   -18.5744     
1 1 1 20 34 30 o 0 626.8   158.8 ?      ?    710.114 147.378      1084.29  147.378     843.158   147.378      
1 1 1 22 34 30 o 0 7.3     212.8 ?      ?    1418.57 -67.072      80.9197  -67.072     379.157   112.928      
1 1 1 1  34 31 o 0 681.5   90    ?      ?    2631.73 178.266      1650.29  178.266     539.271   178.266      
1 1 1 3  34 31 o 0 1554    91.7  ?      ?    4458.39 -36.7142     2536.2   -36.7142    665.041   -36.7142     
1 1 1 5  34 31 o 0 322.1   68.4  ?      ?    2993.48 112.338      568.099  112.338     651.379   -67.6624     
1 1 1 7  34 31 f 1 486.2   74.3  ?      ?    1477.87 80.2238      1346.53  80.2238     749.233   80.2238      
1 1 1 9  34 31 o 0 -50.3   74.4  ?      ?    3326.36 43.7621      911.748  -136.238    2243.26   -136.238     
1 1 1 11 34 31 o 0 -132.7  84.4  ?      ?    313.99  83.7666      83.0105  -96.2334    206.058   -96.2334     
1 1 1 13 34 31 o 0 200.8   92.5  ?      ?    1985.03 -78.9172     292.357  -78.9172    466.157   101.083      
1 1 1 15 34 31 o 0 -100.1  89.3  ?      ?    242.674 127.598      54.5279  -52.4023    144.114   -52.4023     
1 1 1 17 34 31 o 0 861.5   116.7 ?      ?    5018.93 87.9082      1016.95  87.9082     774.247   -92.0918     
1 1 1 19 34 31 o 0 121.5   153.6 ?      ?    1532.4  -40.8383     136.272  -40.8383    381.368   139.162      
1 1 1 21 34 31 o 0 423.8   209.2 ?      ?    1165.42 -21.8681     695.621  -21.8681    318.647   -21.8681     
1 1 1 0  34 32 o 0 -100.3  120   ?      ?    2228.62 -4.48035e-15 117.253  0           778.321   180          
1 1 1 2  34 32 o 0 135.1   76.8  ?      ?    325.701 -73.4253     57.8056  -73.4253    72.6646   106.575      
1 1 1 4  34 32 o 0 297.9   74.6  ?      ?    1648    151.733      777.755  151.733     113.513   151.733      
1 1 1 6  34 32 f 1 585.5   85.2  ?      ?    3087.45 -7.40991     1227.68  -7.40991    9.92657   172.59       
1 1 1 8  34 32 o 0 404.5   79.5  ?      ?    2316.93 -93.0647     970.773  -93.0647    61.0077   -93.0647     
1 1 1 10 34 32 o 0 459.4   90.3  ?      ?    1838.24 122.924      1185.49  122.924     477.23    122.924      
1 1 1 12 34 32 o 0 1068.7  113.8 ?      ?    2881.28 -64.4362     2109.63  -64.4362    1030.16   -64.4362     
1 1 1 14 34 32 o 0 390.9   113.4 ?      ?    2479.45 127.017      798.372  127.017     105.718   -52.9828     
1 1 1 16 34 32 o 0 1499.2  151.7 ?      ?    4237.46 16.7856      2192.92  16.7856     695.63    16.7856      
1 1 1 18 34 32 o 0 211.7   158.3 ?      ?    2470.05 -13.1446     214.184  -13.1446    613.941   166.855      
1 1 1 20 34 32 o 0 -74.9   202.6 ?      ?    1354.31 -177.473     32.1387  2.52705     468.047   2.52705      
1 1 1 1  34 33 o 0 478.1   105.3 ?      ?    1982.26 -117.648     1225.62  -117.648    444.175   -117.648     
1 1 1 3  34 33 o 0 118.3   90.3  ?      ?    1698.2  -89.7497     34.213   -89.7497    632.232   90.2503      
1 1 1 5  34 33 o 0 108.6   87.1  ?      ?    190.45  67.1725      17.5568  67.1725     56.5451   -112.827     
1 1 1 7  34 33 o 0 213.6   87.7  ?      ?    2927.22 123.582      121.452  123.582     997.571   -56.4179     
1 1 1 9  34 33 o 0 319.1   97    ?      ?    678.858 -110.916     533.413  -110.916    278.16    -110.916     
1 1 1 11 34 33 o 0 225     98.7  ?      ?    1687.91 110.774      388.498  110.774     233.218   -69.2261     
1 1 1 13 34 33 o 0 1684.2  149.9 ?      ?    3570.99 -108.316     2678.54  -108.316    1395.38   -108.316     
1 1 1 15 34 33 o 0 1036.9  184   ?      ?    3988.83 20.2597      1574.09  20.2597     204.639   20.2597      
1 1 1 17 34 33 o 0 1025.3  172.9 ?      ?    3872.58 -117.41      1539.92  -117.41     254.254   -117.41      
1 1 1 0  34 34 f 1 -1.1    175.9 ?      ?    265.051 -180         29.9307  180         71.2959   1.08977e-13  
1 1 1 2  34 34 o 0 56.8    120   ?      ?    1396.4  -12.7954     48.5704  167.205     577.971   167.205      
1 1 1 4  34 34 o 0 -127.6  101.7 ?      ?    1572.12 -143.597     360.486  36.403      952.985   36.403       
1 1 1 6  34 34 o 0 124.6   100.2 ?      ?    2309.41 55.8219      55.2641  -124.178    916.945   -124.178     
1 1 1 8  34 34 o 0 636.6   105.7 ?      ?    3692.43 38.848       1051.23  38.848      307.183   -141.152     
1 1 1 10 34 34 o 0 838.6   116.1 ?      ?    2857.3  -123.431     1668.66  -123.431    636.438   -123.431     
1 1 1 12 34 34 o 0 2025.3  197.8 ?      ?    3448    139.663      3057.12  139.663     1858.99   139.663      
1 1 1 14 34 34 o 0 610.9   208.6 ?      ?    3284.18 -49.8584     920.152  -49.8584    191.042   130.142      
1 1 1 16 34 34 o 0 -295.9  172.8 ?      ?    881.736 -33.5243     130.271  146.476     419.469   146.476      
1 1 1 0  1  35 o 0 170.5   16.7  ?      ?    1184.88 90           827.951  90          171.561   90           
1 1 1 0  3  35 o 0 -8.4    12.5  ?      ?    159.822 -90          2.62716  -90         86.3555   90           
1 1 1 0  5  35 o 0 -2.3    13.4  ?      ?    2831.04 -90          56.2596  -90         1505.53   90           
1 1 1 0  7  35 o 0 324.9   22.8  ?      ?    1665.92 -90          1345.17  -90         429.034   -90          
1 1 1 0  9  35 o 0 117.1   16.1  ?      ?    997.302 90           510.092  90          34.3624   -90          
1 1 1 0  11 35 o 0 221.7   19.6  ?      ?    1755.19 -90          1063.47  -90         116.195   -90          
1 1 1 0  13 35 o 0 18.2    16.9  ?      ?    2134.05 90           122.412  90          1011.43   -90          
1 1 1 0  15 35 o 0 166     20.7  ?      ?    1662.63 -90          824.675  -90         63.5958   90           
1 1 1 0  17 35 o 0 1799.1  83.2  ?      ?    6601.08 90           3142.58  90          300.381   -90          
1 1 1 0  19 35 f 1 4301.4  206.1 ?      ?    8774.23 -90          4714.43  -90         240.026   -90          
1 1 1 0  21 35 o 0 70.3    31.6  ?      ?    206.579 90           41.873   90          61.3491   -90          
1 1 1 0  23 35 o 0 2754.6  141.6 ?      ?    6296.13 90           3526.77  90          493.28    90           
1 1 1 0  25 35 o 0 206.3   46    ?      ?    1504.62 -90          692.196  -90         2.91577   90           
1 1 1 0  27 35 o 0 434.8   61.8  ?      ?    1604.17 90           1171.26  90          462.461   90           
1 1 1 0  29 35 o 0 83.8    67.9  ?      ?    529.917 -90          76.2047  -90         149.933   90           
1 1 1 0  31 35 o 0 434.8   133.4 ?      ?    1691.04 90           959.727  90          288.652   90           
1 1 1 0  33 35 o 0 10.9    170.3 ?      ?    1500.26 -90          160.575  -90         406.721   90           
1 1 1 0  35 1  o 0 86.2    14.3  ?      ?    1455.37 -90          566.223  -90         273.503   90           
1 1 1 1  4  35 o 0 379.9   16    ?      ?    2426.06 127.718      1454.65  127.718     105.141   127.718      
1 1 1 1  8  35 o 0 591.5   23.8  ?      ?    2499.38 -146.259     2142.34  -146.259    775.235   -146.259     
1 1 1 1  10 35 o 0 603.7   23.7  ?      ?    2200.75 93.5314      2290.3   93.5314     1097.87   93.5314      
1 1 1 1  12 35 o 0 121.6   12.2  ?      ?    1625.07 -86.898      385.775  -86.898     482.856   93.102       
1 1 1 1  14 35 o 0 118.3   13    ?      ?    997.118 -169.067     420.027  -169.067    103.602   10.9334      
1 1 1 1  16 35 o 0 1401.4  47.1  ?      ?    3957.04 20.0976      3361.41  20.0976     1276      20.0976      
1 1 1 1  18 35 o 0 525.4   28.4  ?      ?    2810.42 164.212      1674.14  164.212     230.954   164.212      
1 1 1 1  20 35 o 0 2302.4  82    ?      ?    6114.06 114.117      3649.23  114.117     602.547   114.117      
1 1 1 1  22 35 f 1 1451.7  58.6  ?      ?    4610.24 -30.4689     2804.2   -30.4689    531.836   -30.4689     
1 1 1 1  24 35 o 0 651.8   43.6  ?      ?    3079.07 -149.623     1703.52  -149.623    250.972   -149.623     
1 1 1 1  26 35 o 0 509.2   42.9  ?      ?    2180.35 -7.59809     1537.15  -7.59809    552.62    -7.59809     
1 1 1 1  28 35 o 0 568.3   53    ?      ?    3023.21 -96.9277     1316.99  -96.9277    4.47606   83.0723      
1 1 1 1  30 35 o 0 665.9   87.4  ?      ?    3924.71 68.5079      1140.15  68.5079     491.186   -111.492     
1 1 1 1  32 35 o 0 -92.5   102.6 ?      ?    1377.37 -148.486     285.714  31.5136     824.354   31.5136      
1 1 1 1  34 35 o 0 -116.1  136.1 ?      ?    2292.2  -109.582     394.892  70.4176     1236.26   70.4176      
1 1 1 1  35 2  o 0 283.4   13.8  ?      ?    2913.41 -162.286     835.489  -162.286    839.297   17.7142      
1 1 1 2  3  35 o 0 398.2   16.7  ?      ?    2876.59 -0.241498    1307.63  -0.241498   287.507   179.758      
1 1 1 2  5  35 f 1 497     19.3  ?      ?    3438.72 83.8188      1379.09  83.8188     520.016   -96.1812     
1 1 1 2  7  35 o 0 749.5   27.4  ?      ?    3478.19 156.346      2147.23  156.346     243.832   156.346      
1 1 1 2  11 35 o 0 1806.6  60.2  ?      ?    4343.91 -97.975      3960.17  -97.9751    1628.06   -97.9751     
1 1 1 2  13 35 o 0 729.2   27.2  ?      ?    3586.27 84.0633      1968.82  84.0633     73.3578   84.0633      
1 1 1 2  15 35 o 0 299.6   16.7  ?      ?    3451.06 -49.271      588.599  -49.271     1245.74   130.729      
1 1 1 2  17 35 o 0 610.4   28.3  ?      ?    2017.19 167.649      2271.64  167.649     1224.67   167.649      
1 1 1 2  19 35 o 0 3052.5  104.9 ?      ?    6551.29 16.1028      4520.36  16.1028     1213.53   16.1028      
1 1 1 2  21 35 o 0 83.3    21.9  ?      ?    1048.88 90.8438      49.8556  90.8438     472.035   -89.1562     
1 1 1 2  23 35 o 0 896.6   43.7  ?      ?    3503.84 -158.984     2150.21  -158.984    468.451   -158.984     
1 1 1 2  25 35 o 0 184.6   32.1  ?      ?    1714.19 -98.3208     484.4    -98.3208    304.9     81.6792      
1 1 1 2  27 35 o 0 501.5   45.4  ?      ?    3101.88 165.005      1170.89  165.005     195.806   -14.9952     
1 1 1 2  29 35 o 0 439.8   59.4  ?      ?    3218.88 31.6883      870.446  31.6883     500.015   -148.312     
1 1 1 2  31 35 o 0 334.1   96.7  ?      ?    2315.12 -98.4978     771.136  -98.4978    158.304   81.5022      
1 1 1 2  33 35 o 0 -40.8   123.6 ?      ?    964.368 96.8234      113.282  -83.1766    477.487   -83.1766     
1 1 1 0  35 3  o 0 142.5   15.1  ?      ?    1461.39 90           832.553  90          15.109    -90          
1 1 1 3  8  35 o 0 279.4   14.9  ?      ?    2264.12 -83.8886     1061.8   -83.8886    169.108   96.1114      
1 1 1 3  10 35 o 0 1147.1  39.7  ?      ?    4909.41 146.089      2375.85  146.089     267.443   -33.9112     
1 1 1 3  12 35 o 0 352.5   17.8  ?      ?    1786.92 43.2152      1526.46  43.2152     577.448   43.2152      
1 1 1 3  14 35 o 0 145.6   13.5  ?      ?    2811.24 -116.985     101.881  -116.985    1417.24   63.0149      
1 1 1 3  16 35 o 0 121.6   14.1  ?      ?    2020.05 141.102      217.071  141.102     840.764   -38.8984     
1 1 1 3  18 35 o 0 1078.9  41.7  ?      ?    4122.91 -46.672      2510.67  -46.672     406.575   -46.672      
1 1 1 3  20 35 f 1 -2.5    19.5  ?      ?    1327.83 -123.795     554.281  56.2052     1227.48   56.2052      
1 1 1 3  22 35 o 0 1196.9  50.2  ?      ?    3714.77 156.35       2725.47  156.35      915.019   156.35       
1 1 1 3  24 35 o 0 1098.4  50    ?      ?    5282.39 30.1026      1737.95  30.1026     737.155   -149.897     
1 1 1 3  26 35 o 0 662.5   46.2  ?      ?    3310.95 174.459      1540.05  174.459     52.3034   174.459      
1 1 1 3  28 35 o 0 2210.6  94.4  ?      ?    5947.53 73.2122      2937.18  73.2122     349.109   73.2122      
1 1 1 3  30 35 o 0 1120.6  81.9  ?      ?    5513.6  -103.515     1412.99  -103.515    869.526   76.4854      
1 1 1 3  32 35 o 0 130.1   87.4  ?      ?    2366.08 109.012      49.7699  -70.9885    971.741   -70.9885     
1 1 1 3  34 35 o 0 100.8   115   ?      ?    2191.98 165.403      60.9668  -14.597     863.023   -14.597      
1 1 1 1  35 4  o 0 466.4   19.2  ?      ?    3456.01 -51.6548     1322.31  -51.6548    670.628   128.345      
1 1 1 4  11 35 o 0 1063.9  37.6  ?      ?    3610.41 40.6318      2814.88  40.6318     890.987   40.6318      
1 1 1 4  13 35 f 1 210.6   15.2  ?      ?    1974.6  -126.921     800.608  -126.921    240.963   53.0794      
1 1 1 4  15 35 o 0 1274.6  45.2  ?      ?    4547.06 53.1507      2814.46  53.1507     416.022   53.1507      
1 1 1 4  17 35 o 0 180.6   16.4  ?      ?    1697.78 117.25       666.088  117.25      208.414   -62.7502     
1 1 1 4  19 35 o 0 97.3    18.3  ?      ?    837.062 -71.98       190.214  -71.98      229.138   108.02       
1 1 1 4  21 35 o 0 51      20.2  ?      ?    1540.69 -172.641     284.716  7.35857     1045.71   7.35857      
1 1 1 4  23 35 o 0 383     30.5  ?      ?    1601.77 104.228      1404.59  104.228     641.217   104.228      
1 1 1 4  25 35 o 0 252.7   30.1  ?      ?    1101.97 31.8694      784.327  31.8694     280.375   31.8694      
1 1 1 4  27 35 o 0 118.6   30    ?      ?    3209.52 -6.10491     301.817  173.895     1706.76   173.895      
1 1 1 4  29 35 o 0 76.3    35.8  ?      ?    1850.63 -169.664     214.952  10.3356     998.018   10.3356      
1 1 1 4  31 35 o 0 275.7   67.2  ?      ?    1958.81 39.3904      662.117  39.3904     119.707   -140.61      
1 1 1 4  33 35 o 0 55.4    94.7  ?      ?    1356.35 -130.902     100.105  49.098      609.557   49.098       
1 1 1 0  35 5  o 0 1016    49.7  ?      ?    2929.94 90           2576.07  90          891.946   90           
1 1 1 5  6  35 o 0 515.1   19.6  ?      ?    2713.1  146.198      1780.87  146.198     308.579   146.198      
1 1 1 5  12 35 o 0 917.3   33.6  ?      ?    3386.54 -80.5449     2543.66  -80.545     760.559   -80.545      
1 1 1 5  14 35 o 0 571.9   24.6  ?      ?    4148.6  -64.3726     1249.72  -64.3726    951.038   115.627      
1 1 1 5  16 35 o 0 232.8   17.6  ?      ?    1646.47 -3.50275     960.329  -3.50275    105.775   -3.50275     
1 1 1 5  18 35 o 0 345.6   21.1  ?      ?    1382.87 143.431      1469.59  143.431     770.126   143.431      
1 1 1 5  20 35 o 0 142.8   20.7  ?      ?    703.109 -4.93245     327.424  -4.93245    23.9093   175.068      
1 1 1 5  22 35 o 0 1097.3  52.4  ?      ?    3191.19 85.2903      2725.62  85.2903     1183.93   85.2903      
1 1 1 5  24 35 o 0 1541.6  70    ?      ?    5045.36 -105.516     2619.92  -105.516    276.165   -105.516     
1 1 1 5  26 35 o 0 213.6   50.8  ?      ?    1526.15 -16.0648     615.545  -16.0648    64.4637   163.935      
1 1 1 5  28 35 o 0 991     77.9  ?      ?    3072.61 -53.9553     2190.88  -53.9553    864.736   -53.9553     
1 1 1 5  30 35 o 0 79.6    85.7  ?      ?    1667.45 -133.503     96.9249  46.4973     768.169   46.4973      
1 1 1 5  32 35 o 0 11      72.2  ?      ?    1190.71 -113.464     207.118  66.5362     667.547   66.5362      
1 1 1 5  34 35 o 0 517.8   114   ?      ?    2903.4  3.37096      1013.34  3.37096     41.2162   -176.629     
1 1 1 3  35 6  o 0 333.4   15.1  ?      ?    3104.51 174.723      949.214  174.723     794.535   -5.27731     
1 1 1 6  9  35 o 0 844.2   30.9  ?      ?    3344.01 -26.0676     2415.99  -26.0676    629.293   -26.0676     
1 1 1 6  11 35 o 0 186.8   14.2  ?      ?    3582.23 -176.013     19.295   3.98725     1910.04   3.98725      
1 1 1 6  13 35 o 0 1008.8  37.2  ?      ?    3965.6  152.458      2535.65  152.458     402.527   152.458      
1 1 1 6  15 35 o 0 22      14.6  ?      ?    1103.12 106.494      376.383  -73.5056    952.421   -73.5056     
1 1 1 6  17 35 o 0 382.1   24.2  ?      ?    2874.25 -89.5959     1143.91  -89.5959    321.528   90.4041      
1 1 1 6  19 35 o 0 366     27.9  ?      ?    2568.95 -107.749     1176.53  -107.749    97.2932   72.251       
1 1 1 6  21 35 f 1 621.9   37    ?      ?    4423.75 47.5764      1083.73  47.5764     1091.1    -132.424     
1 1 1 6  23 35 o 0 58.7    36.1  ?      ?    1241.33 -133.89      144.036  46.1096     729.578   46.1096      
1 1 1 6  25 35 o 0 66.6    43.5  ?      ?    1789.92 15.9732      239.67   -164.027    1049.93   -164.027     
1 1 1 6  27 35 o 0 1064.1  69.3  ?      ?    5376.45 177.956      1459.61  177.956     902.644   -2.04419     
1 1 1 6  29 35 o 0 241.8   84.4  ?      ?    3094.31 -89.5923     209.346  -89.5923    1087.02   90.4077      
1 1 1 6  31 35 o 0 19.7    104.8 ?      ?    2770.3  126.32       444.271  -53.68      1539.25   -53.68       
1 1 1 6  33 35 f 1 186.7   82.9  ?      ?    1167.3  -63.4849     272.117  -63.4849    164.603   116.515      
1 1 1 0  35 7  o 0 93.2    15.4  ?      ?    1467.55 -90          567.348  -90         273.503   90           
1 1 1 7  10 35 o 0 560.9   24.6  ?      ?    3277.56 108.544      1621.02  108.544     110.917   -71.4557     
1 1 1 7  12 35 o 0 2140.7  74.5  ?      ?    5159.73 84.2026      3987.55  84.2026     1299.93   84.2026      
1 1 1 7  14 35 f 1 248.7   18    ?      ?    1769.54 -152.651     1017.88  -152.651    84.2991   -152.651     
1 1 1 7  16 35 f 1 139.5   18.7  ?      ?    2298.88 -58.4332     232.027  -58.4332    954.31    121.567      
1 1 1 7  18 35 o 0 422.7   31.2  ?      ?    2285.48 139.46       1498.86  139.46      356.164   139.46       
1 1 1 7  20 35 o 0 159.7   30.4  ?      ?    384.731 153.417      244.106  153.417     54.1025   153.417      
1 1 1 7  22 35 f 1 1410.5  63.1  ?      ?    4117.28 -3.19475     2878.21  -3.19475    901.371   -3.19475     
1 1 1 7  24 35 o 0 907.6   54.6  ?      ?    3459.63 -150.223     2078.26  -150.223    490.077   -150.223     
1 1 1 7  26 35 o 0 518     53.8  ?      ?    3080.29 66.9791      1220.91  66.9791     135.406   -113.021     
1 1 1 7  28 35 o 0 404     72.8  ?      ?    3073.5  66.9466      812.531  66.9466     498.405   -113.053     
1 1 1 7  30 35 o 0 129.7   100.6 ?      ?    960.181 60.9638      127.252  60.9638     254.76    -119.036     
1 1 1 7  32 35 f 1 107.6   124.4 ?      ?    2338.91 -2.8226      78.4394  177.177     972.879   177.177      
1 1 1 7  34 35 o 0 382.5   101.8 ?      ?    2058.69 -160.416     872.052  -160.416    132.894   -160.416     
1 1 1 3  35 8  o 0 156.7   13    ?      ?    2515.75 57.5985      312.094  57.5985     1093.6    -122.402     
1 1 1 5  35 8  o 0 330.7   17    ?      ?    2504.87 102.066      1197.55  102.066     178.679   -77.9342     
1 1 1 7  35 8  o 0 74.8    13.1  ?      ?    774.262 -108.862     120.94   -108.862    296.545   71.1382      
1 1 1 8  9  35 o 0 372.6   19    ?      ?    2056.73 -4.104       1502.47  -4.104      415.727   -4.104       
1 1 1 8  11 35 o 0 1822.1  62.9  ?      ?    6573.19 91.3812      2755.81  91.3812     673.491   -88.6188     
1 1 1 8  13 35 o 0 860.4   34.4  ?      ?    3353.97 -12.5187     2431.19  -12.5187    665.842   -12.5187     
1 1 1 8  15 35 f 1 1814.2  62.7  ?      ?    6282.18 -158.59      2886.44  -158.59     371.758   21.4099      
1 1 1 8  17 35 o 0 3656.8  124.1 ?      ?    6920.19 -3.51379     5069.22  -3.51379    1585.74   -3.51379     
1 1 1 8  19 35 o 0 1160.6  51.7  ?      ?    4807.44 109.978      2207.77  109.978     186.876   -70.0221     
1 1 1 8  21 35 o 0 742.3   43.5  ?      ?    2673.04 170.332      2136.47  170.332     846.919   170.332      
1 1 1 8  23 35 o 0 820     52    ?      ?    2903.04 -34.6757     2128.25  -34.6757    779.132   -34.6757     
1 1 1 8  25 35 o 0 507.1   51.4  ?      ?    1894.25 84.3605      1585.22  84.3605     739.26    84.3605      
1 1 1 8  27 35 o 0 1251.1  82.4  ?      ?    5751.38 -66.6757     1610.97  -66.6757    881.863   113.324      
1 1 1 8  29 35 o 0 855.4   91.4  ?      ?    4516.03 112.461      1305.88  112.461     560.472   -67.539      
1 1 1 8  31 35 o 0 741.9   107.4 ?      ?    2858.53 -57.212      1598.33  -57.212     483.803   -57.212      
1 1 1 8  33 35 o 0 -0.7    157.8 ?      ?    1599    177.84       54.9378  -2.16008    641.748   -2.16008     
1 1 1 0  35 9  o 0 189.3   20.1  ?      ?    2547.56 90           1076.99  90          371.678   -90          
1 1 1 2  35 9  o 0 1217.7  40.7  ?      ?    5251.82 -31.858      2450.16  -31.858     494.722   148.142      
1 1 1 4  35 9  o 0 1878.5  65.1  ?      ?    4867.52 32.507       3921.27  32.507      1234.91   32.507       
1 1 1 6  35 9  o 0 91.6    14.2  ?      ?    497.816 -54.1656     175.888  -54.1656    94.0102   125.834      
1 1 1 8  35 9  o 0 477.7   23.2  ?      ?    1577.68 176.019      2056.3   176.019     1217.75   176.019      
1 1 1 9  10 35 o 0 931.7   37.5  ?      ?    3884.71 -73.7248     2316.51  -73.7248    289.14    -73.7248     
1 1 1 9  12 35 o 0 219.8   17.7  ?      ?    1158.14 101.491      944.991  101.491     334.21    101.491      
1 1 1 9  14 35 o 0 96.1    15.6  ?      ?    1206.62 -31.2257     191.884  -31.2257    432.667   148.774      
1 1 1 9  16 35 o 0 1070.8  45.8  ?      ?    3763.36 9.76284      2637.84  9.76284     733.326   9.76284      
1 1 1 9  18 35 o 0 2470.3  96.9  ?      ?    6300.98 -158.613     3692.16  -158.613    531.342   -158.613     
1 1 1 9  20 35 o 0 1140.6  56.3  ?      ?    5021.63 7.78812      2017.83  7.78812     426.189   -172.212     
1 1 1 9  22 35 o 0 453.1   40.4  ?      ?    2928.04 104.17       1197.99  104.17      179.309   -75.83       
1 1 1 9  24 35 o 0 1814.8  83.5  ?      ?    5841.9  -91.3507     2627.4   -91.3507    14.158    88.6493      
1 1 1 9  26 35 o 0 495.5   57.4  ?      ?    1773.13 -23.2251     1491.85  -23.2251    712.276   -23.2251     
1 1 1 9  28 35 o 0 1181.1  91.6  ?      ?    3780.96 -158.023     2205.87  -158.023    617.907   -158.023     
1 1 1 9  30 35 o 0 578.9   111.6 ?      ?    2818.59 -101.815     1279.3   -101.815    160.381   -101.815     
1 1 1 9  32 35 o 0 1279.9  139.4 ?      ?    4602.07 168.771      1867.11  168.771     144.256   168.771      
1 1 1 9  34 35 o 0 482.3   185   ?      ?    2217.27 -14.6071     953.014  -14.6071    182.168   -14.6071     
1 1 1 1  35 10 o 0 1078.3  37.3  ?      ?    5736.94 -91.1221     1868.46  -91.1221    1354.56   88.8779      
1 1 1 3  35 10 o 0 1005.1  36.7  ?      ?    3967.17 -86.023      2597.81  -86.023     401.893   -86.023      
1 1 1 5  35 10 o 0 284.5   17.1  ?      ?    2658.64 32.9667      914.622  32.9667     532.508   -147.033     
1 1 1 7  35 10 o 0 18.8    13.4  ?      ?    453.865 -0.0752109   156.375  179.925     398.821   179.925      
1 1 1 9  35 10 o 0 261.6   17.3  ?      ?    1087.57 -140.252     1219.39  -140.252    650.516   -140.252     
1 1 1 10 11 35 o 0 693.5   30    ?      ?    2293.26 16.2524      2451.95  16.2523     1241.69   16.2523      
1 1 1 10 13 35 o 0 407.5   23.5  ?      ?    3056.19 162.99       1178.96  162.99      406.573   -17.0101     
1 1 1 10 15 35 o 0 268.2   22.1  ?      ?    1008.9  -79.1899     1112.23  -79.1899    599.649   -79.1899     
1 1 1 10 17 35 o 0 212.1   22.9  ?      ?    2153.67 -159.839     676.095  -159.839    391.389   20.1611      
1 1 1 10 19 35 o 0 1423.3  63.7  ?      ?    4811.2  118.886      2670.62  118.886     311.892   118.886      
1 1 1 10 21 35 o 0 2308.7  98.1  ?      ?    5494.07 -91.2173     3643.89  -91.2173    1036.2    -91.2173     
1 1 1 10 23 35 o 0 730.9   55.2  ?      ?    3590.59 85.7693      1619.12  85.7693     22.014    -94.2307     
1 1 1 10 25 35 o 0 1262    76.8  ?      ?    4317.21 -137.237     2308.63  -137.237    412.943   -137.237     
1 1 1 10 27 35 o 0 1048.2  87.4  ?      ?    4071.53 98.2716      1894.85  98.2716     160.172   98.2716      
1 1 1 10 29 35 o 0 1369.1  104.5 ?      ?    4884.24 81.7188      2043.46  81.7188     99.103    81.7188      
1 1 1 10 31 35 o 0 534.5   119.4 ?      ?    2777.79 167.541      1126.32  167.541     62.1537   167.541      
1 1 1 10 33 35 o 0 591.2   164.4 ?      ?    4012.94 13.9163      798.117  13.9163     648.69    -166.084     
1 1 1 0  35 11 o 0 1150.4  55    ?      ?    4127.47 90           2681.49  90          362.361   90           
1 1 1 2  35 11 o 0 770.2   28.2  ?      ?    3952.45 175.55       1993.77  175.55      196.856   -4.45025     
1 1 1 4  35 11 o 0 107.8   14.2  ?      ?    383.106 -144.719     203.585  -144.719    5.44164   35.2808      
1 1 1 6  35 11 o 0 1550.9  53.5  ?      ?    4468.59 -94.0584     3421.24  -94.0584    1025.95   -94.0584     
1 1 1 8  35 11 o 0 350.6   20.1  ?      ?    971.481 95.6112      1595.48  95.6112     1084.98   95.6112      
1 1 1 10 35 11 o 0 611.7   27.1  ?      ?    3624.22 75.7156      1617.03  75.7156     293.262   -104.284     
1 1 1 11 12 35 o 0 314.9   20.5  ?      ?    2488.02 -112.225     1059.94  -112.226    232.118   67.7745      
1 1 1 11 14 35 o 0 64.5    17.5  ?      ?    905.34  151.439      7.98801  -28.561     469.143   -28.561      
1 1 1 11 16 35 o 0 1722.8  66.7  ?      ?    6352.58 108.688      2614.94  108.688     546.957   -71.3118     
1 1 1 11 18 35 o 0 1816.4  77.6  ?      ?    6400.15 -16.3276     2608.83  -16.3276    547.187   163.672      
1 1 1 11 20 35 o 0 1128    60.7  ?      ?    4377.82 135.85       2245.82  135.85      152.369   135.85       
1 1 1 11 22 35 o 0 185.5   44.6  ?      ?    2105.9  -82.1557     403.526  -82.1557    567.855   97.8443      
1 1 1 11 24 35 o 0 1094    74.3  ?      ?    3212.64 126.255      2467.68  126.255     1041.6    126.255      
1 1 1 11 26 35 o 0 144.7   66.4  ?      ?    2050.06 78.8901      104.699  78.8901     779.805   -101.11      
1 1 1 11 28 35 o 0 1156.1  97.9  ?      ?    4736.36 7.8138       1760.1   7.8138      191.368   -172.186     
1 1 1 11 30 35 o 0 577.4   120.8 ?      ?    3166.37 81.9756      1129.28  81.9756     103.49    -98.0244     
1 1 1 11 32 35 o 0 590.2   152.9 ?      ?    1532.46 26.7788      1393.68  26.7788     831.161   26.7788      
1 1 1 11 34 35 f 1 513.6   200.6 ?      ?    1625.19 78.7268      1038.95  78.7268     481.95    78.7268      
1 1 1 1  35 12 o 0 27.4    13.4  ?      ?    353.027 70.7467      99.3213  -109.253    294.897   -109.253     
1 1 1 3  35 12 o 0 258.4   16.7  ?      ?    1435.38 103.445      1238.67  103.445     454.932   103.445      
1 1 1 5  35 12 o 0 483.2   22.3  ?      ?    2497.39 -115.56      1751.34  -115.56     410.187   -115.56      
1 1 1 7  35 12 o 0 207.8   16.3  ?      ?    1754.99 13.7513      864.946  13.7513     60.0336   -166.249     
1 1 1 9  35 12 o 0 -3      15.4  ?      ?    1143.72 107.864      512.785  -72.136     1118.2    -72.136      
1 1 1 11 35 12 o 0 134     16    ?      ?    967.096 -166.781     428.598  -166.781    71.3229   13.2189      
1 1 1 12 13 35 o 0 1015.1  41    ?      ?    5237.27 107.842      1830.16  107.842     840.852   -72.1577     
1 1 1 12 15 35 o 0 132.9   22.1  ?      ?    2844.34 -56.5504     19.2496  123.45      1438.94   123.45       
1 1 1 12 17 35 o 0 372.9   28.8  ?      ?    2335.13 -42.0589     1217.16  -42.0589    60.6282   -42.0589     
1 1 1 12 19 35 o 0 181.1   36.2  ?      ?    1983.57 177.222      482.51   177.222     471.706   -2.77751     
1 1 1 12 21 35 f 1 1906.5  86.7  ?      ?    4779.7  -49.3941     3295.44  -49.3941    1061.37   -49.3941     
1 1 1 12 23 35 o 0 1875.6  91    ?      ?    4729.72 99.4701      3161.57  99.4701     1042.57   99.4701      
1 1 1 12 25 35 f 1 587.5   68.3  ?      ?    4125.12 -107.9       930.685  -107.9      878.812   72.0999      
1 1 1 12 27 35 o 0 19.9    82.3  ?      ?    397.551 -34.8526     44.7372  145.147     210.616   145.147      
1 1 1 12 29 35 o 0 1555.3  119.9 ?      ?    5255.16 -77.6947     2157.18  -77.6947    81.598    -77.6947     
1 1 1 12 31 35 o 0 1109.4  144.7 ?      ?    2446.99 10.0662      2258.92  10.0662     1346.14   10.0662      
1 1 1 12 33 35 o 0 2262.2  201.6 ?      ?    2616.54 -176.282     3535.22  -176.282    2627.42   -176.282     
1 1 1 0  35 13 o 0 1374.2  64.8  ?      ?    3749.41 -90          2882.74  -90         810.439   -90          
1 1 1 2  35 13 o 0 655.8   26.3  ?      ?    2909.32 30.6835      2147.42  30.6835     560.513   30.6835      
1 1 1 4  35 13 f 1 809.1   32    ?      ?    3316.87 108.972      2340.6   108.972     548.96    108.972      
1 1 1 6  35 13 o 0 134.1   15.6  ?      ?    1834.21 -143.986     421.974  -143.986    580.612   36.0144      
1 1 1 8  35 13 o 0 571.3   24.8  ?      ?    3318.4  -99.8582     1647.9   -99.8582    113.225   80.1418      
1 1 1 10 35 13 o 0 153.7   17.3  ?      ?    1202.43 -12.1642     567.219  -12.1642    56.8192   167.836      
1 1 1 12 35 13 o 0 136.2   19.2  ?      ?    1025.28 -65.8374     438.397  -65.8374    80.4385   114.163      
1 1 1 13 14 35 o 0 489.1   29.5  ?      ?    2188.44 66.4485      1757.24  66.4485     663.379   66.4485      
1 1 1 13 16 35 o 0 1383.2  57.7  ?      ?    4429.46 -157.219     2810.83  -157.219    610.539   -157.219     
1 1 1 13 18 35 o 0 297.1   29.9  ?      ?    2370.31 -24.5895     891.254  -24.5895    254.149   155.411      
1 1 1 13 20 35 o 0 235     40.8  ?      ?    1378.31 -146.605     822.333  -146.605    176.852   -146.605     
1 1 1 13 22 35 o 0 81.1    48    ?      ?    633.188 104.024      2.62979  -75.9755    288.494   -75.9755     
1 1 1 13 24 35 o 0 115.1   56.2  ?      ?    950.386 70.9208      117.78   70.9208     294.903   -109.079     
1 1 1 13 26 35 o 0 1287.1  100.7 ?      ?    4076.97 139.114      2277.69  139.114     557.87    139.114      
1 1 1 13 28 35 o 0 350.3   101.8 ?      ?    1307.16 87.1213      903.522  87.1213     387.639   87.1213      
1 1 1 13 30 35 f 1 476.8   120.3 ?      ?    2467.12 -126.788     1043.95  -126.788    105.139   -126.788     
1 1 1 13 32 35 o 0 640.7   165.3 ?      ?    2634.74 -144.073     1302.18  -144.073    357.838   -144.073     
1 1 1 13 34 35 f 1 -58.7   211.5 ?      ?    2334.37 -65.5003     117.305  114.5       898.235   114.5        
1 1 1 1  35 14 o 0 641.1   26    ?      ?    3716.6  -169.169     1702.66  -169.169    318.73    10.8312      
1 1 1 3  35 14 o 0 612.7   25.3  ?      ?    2748.27 -9.08793     2129.73  -9.08793    603.3     -9.08793     
1 1 1 5  35 14 o 0 111.3   16.3  ?      ?    695.323 147.769      263.014  147.769     113.28    -32.2314     
1 1 1 7  35 14 f 1 521     24.4  ?      ?    3912.97 78.1098      1191.06  78.1098     899.303   -101.89      
1 1 1 9  35 14 o 0 431.2   23.3  ?      ?    2854.58 160.288      1357.14  160.288     127.686   -19.712      
1 1 1 11 35 14 o 0 657.3   30.1  ?      ?    3811.22 -46.7782     1602.68  -46.7782    333.179   133.222      
1 1 1 13 35 14 o 0 617.4   32.1  ?      ?    3487.1  -149.813     1593.39  -149.813    130.845   30.1873      
1 1 1 14 15 35 o 0 923.5   44.3  ?      ?    3734.54 32.2766      2187.15  32.2766     329.206   32.2766      
1 1 1 14 17 35 o 0 774.6   42.4  ?      ?    3525.17 100.621      1874.93  100.621     166.266   100.621      
1 1 1 14 19 35 o 0 740.9   46.1  ?      ?    2665.96 -61.2514     2082.5   -61.2514    828.267   -61.2514     
1 1 1 14 21 35 o 0 556.3   51.2  ?      ?    1954.56 144.431      1735.53  144.431     847.692   144.431      
1 1 1 14 23 35 f 1 263.2   58.8  ?      ?    1307.24 163.646      803.482  163.646     228.231   163.646      
1 1 1 14 25 35 o 0 2102.6  117.3 ?      ?    5669.47 54.3935      2841.29  54.3935     427.408   54.3935      
1 1 1 14 27 35 f 1 2142    130.3 ?      ?    3799.04 -79.6274     3467.54  -79.6274    1943.23   -79.6274     
1 1 1 14 29 35 o 0 869.9   122.9 ?      ?    2668.43 78.0003      1874.07  78.0003     846.434   78.0003      
1 1 1 14 31 35 o 0 114.8   147.6 ?      ?    1786.6  106.221      97.8734  106.221     551.634   -73.7793     
1 1 1 14 33 35 o 0 603.4   196.7 ?      ?    2030.71 84.8588      1207.15  84.8588     520.809   84.8588      
1 1 1 0  35 15 o 0 145.7   25.2  ?      ?    2341.44 90           871.934  90          427.859   -90          
1 1 1 2  35 15 o 0 852.6   31.8  ?      ?    3944.34 122.196      2219.4   122.196     57.1402   122.196      
1 1 1 4  35 15 o 0 469.7   24    ?      ?    1666.49 -165.53      2003.04  -165.53     1103.03   -165.53      
1 1 1 6  35 15 o 0 9.4     16.4  ?      ?    1546.72 -57.0512     630.765  122.949     1451.77   122.949      
1 1 1 8  35 15 f 1 1704.5  59.7  ?      ?    4623.68 -15.1437     3551.11  -15.1437    1131.14   -15.1437     
1 1 1 10 35 15 o 0 30.3    20    ?      ?    1180.29 146.078      322.093  -33.9217    922.794   -33.9217     
1 1 1 12 35 15 o 0 2431    83.7  ?      ?    6438.01 166.4        3664.35  166.4       469.621   166.4        
1 1 1 14 35 15 o 0 780.8   40.7  ?      ?    2689.74 35.0845      2263.02  35.0844     942.98    35.0844      
1 1 1 15 16 35 f 1 298.3   36.3  ?      ?    2913.05 -9.59528     686.551  -9.59528    735.646   170.405      
1 1 1 15 18 35 o 0 2322.4  98.2  ?      ?    5390.76 -50.2874     3688.48  -50.2874    1144.52   -50.2874     
1 1 1 15 20 35 o 0 852.3   56.3  ?      ?    3008.81 -147.457     2120.31  -147.457    747.312   -147.457     
1 1 1 15 22 35 o 0 924.2   65.4  ?      ?    4743.84 43.2517      1512.32  43.2517     576.187   -136.748     
1 1 1 15 24 35 o 0 158.1   67    ?      ?    2258.71 -96.6978     120.636  -96.6978    848.439   83.3022      
1 1 1 15 26 35 o 0 80.6    94.1  ?      ?    818.803 6.42804      28.9537  6.42804     307.431   -173.572     
1 1 1 15 28 35 f 1 95.9    116.4 ?      ?    2184.44 -93.7382     72.2082  86.2618     927.4     86.2618      
1 1 1 15 30 35 o 0 211.5   133.3 ?      ?    1291.17 -138.787     332.927  -138.787    142.332   41.2132      
1 1 1 15 32 35 f 1 223.4   181   ?      ?    1666.57 -6.56304     373.378  -6.56304    201.092   173.437      
1 1 1 1  35 16 o 0 511.6   25.9  ?      ?    3184.2  49.7888      1557.03  49.7888     179.088   -130.211     
1 1 1 3  35 16 o 0 162.6   21.7  ?      ?    354.951 -56.3687     307.742  -56.3687    116.8     -56.3687     
1 1 1 5  35 16 o 0 232.4   21.8  ?      ?    2825.13 68.7853      556.491  68.7853     939.293   -111.215     
1 1 1 7  35 16 f 1 -3.2    19.7  ?      ?    1905.31 -135.362     808.561  44.6376     1804.6    44.6376      
1 1 1 9  35 16 o 0 4755    153   ?      ?    7900.6  -96.509      5858.31  -96.509     1836.39   -96.509      
1 1 1 11 35 16 o 0 4870.3  158   ?      ?    8327.3  92.8644      5632.53  92.8644     1492.98   92.8644      
1 1 1 13 35 16 o 0 32.4    25.4  ?      ?    1507.45 109.458      409.89   -70.5418    1152.27   -70.5418     
1 1 1 15 35 16 f 1 174.8   30.9  ?      ?    1368.26 149.92       550.703  149.92      106.555   -30.0797     
1 1 1 16 17 35 o 0 1011.8  56.9  ?      ?    3911.55 -102.773     2188.31  -102.773    339.498   -102.773     
1 1 1 16 19 35 o 0 1789.2  83.6  ?      ?    4768.85 -163.765     3086.11  -163.765    903.311   -163.765     
1 1 1 16 21 35 o 0 650.8   58.9  ?      ?    2786.77 14.8156      1675.73  14.8156     443.26    14.8156      
1 1 1 16 23 35 o 0 708.8   57.8  ?      ?    2581.67 -88.6126     1782.77  -88.6126    668.43    -88.6126     
1 1 1 16 25 35 o 0 288     88.1  ?      ?    1193.67 -173.546     762.57   -173.546    268.461   -173.546     
1 1 1 16 27 35 o 0 -32.2   100.1 ?      ?    1263.45 -179.464     203.334  0.5362      699.684   0.5362       
1 1 1 16 29 35 o 0 -310.9  131.6 ?      ?    1185.22 174.403      281.564  -5.59697    722.505   -5.59697     
1 1 1 16 31 35 o 0 614     168.6 ?      ?    2653.79 19.0611      1223.91  19.0611     303.069   19.0611      
1 1 1 16 33 35 o 0 96.8    225.2 ?      ?    1923.53 -105.789     124.082  -105.789    506.424   74.2114      
1 1 1 0  35 17 o 0 180.5   28.5  ?      ?    1824.56 -90          910.168  -90         77.1204   90           
1 1 1 2  35 17 o 0 12.5    18.6  ?      ?    840.77  -152.782     320.573  27.2177     770.186   27.2177      
1 1 1 4  35 17 o 0 -1.3    21.2  ?      ?    1129.09 -83.4362     463.254  96.5638     1058.43   96.5638      
1 1 1 6  35 17 o 0 137.4   24.3  ?      ?    1011.24 65.1143      452.581  65.1143     71.5364   -114.886     
1 1 1 8  35 17 o 0 1431.2  55    ?      ?    4706.29 -176.254     2942.31  -176.254    550.18    -176.254     
1 1 1 10 35 17 o 0 487.5   31.3  ?      ?    2099.79 109.112      1773.06  109.112     729.267   109.112      
1 1 1 12 35 17 o 0 3221.9  113.8 ?      ?    6469.75 -21.8656     4520.46  -21.8656    1329.15   -21.8656     
1 1 1 14 35 17 o 0 377.3   34.6  ?      ?    3240.08 39.0685      843.719  39.0685     709.247   -140.932     
1 1 1 16 35 17 o 0 153.4   34.8  ?      ?    1853.74 15.7943      352.638  15.7943     507.415   -164.206     
1 1 1 17 18 35 o 0 5425.7  195.4 ?      ?    7416.36 124.864      5929.73  124.864     2530.02   124.864      
1 1 1 17 20 35 o 0 246.9   52.2  ?      ?    2176.97 -178.535     637.233  -178.535    328.404   1.46453      
1 1 1 17 22 35 o 0 -21.7   61.9  ?      ?    289.785 -81.556      72.4859  98.444      198.123   98.444       
1 1 1 17 24 35 f 1 440.4   58.1  ?      ?    3141.82 47.4896      873.379  47.4896     442.257   -132.51      
1 1 1 17 26 35 o 0 1659.3  111.5 ?      ?    5516.25 -169.04      2215.75  -169.04     32.5455   -169.04      
1 1 1 17 28 35 o 0 863.4   131.3 ?      ?    3295.62 11.4522      1617.62  11.4522     380.527   11.4522      
1 1 1 17 30 35 o 0 23.6    99.2  ?      ?    997.16  4.10914      82.9758  -175.891    438.455   -175.891     
1 1 1 17 32 35 o 0 88.7    146.1 ?      ?    2872.35 -90.7076     161.877  89.2924     1114.82   89.2924      
1 1 1 1  35 18 o 0 366.5   23.8  ?      ?    2384.59 -150.673     1337.07  -150.673    72.0948   -150.673     
1 1 1 3  35 18 o 0 185.7   23.3  ?      ?    1772.8  50.7777      686.275  50.7777     242.259   -129.222     
1 1 1 5  35 18 o 0 1191.4  50.3  ?      ?    3212.25 73.8243      3205.79  73.8243     1548.97   73.8243      
1 1 1 7  35 18 o 0 1156.3  49.7  ?      ?    3793.54 134.039      2811.4   134.039     889.667   134.039      
1 1 1 9  35 18 o 0 452.4   31.8  ?      ?    2501.23 3.78763      1457.6   3.78763     194.52    3.78763      
1 1 1 11 35 18 o 0 3025.6  107.2 ?      ?    7047.79 -89.8477     4001.99  -89.8477    526.358   -89.8477     
1 1 1 13 35 18 o 0 971.8   50.2  ?      ?    3028.85 -104.448     2512.46  -104.448    1058.53   -104.448     
1 1 1 15 35 18 o 0 43.2    36.6  ?      ?    2083.87 106.537      449.403  -73.4631    1419.56   -73.4631     
1 1 1 17 35 18 o 0 1249.2  64.4  ?      ?    3077.25 37.4162      2835.65  37.4162     1453.88   37.4162      
1 1 1 18 19 35 o 0 901.1   63.5  ?      ?    4417.7  -47.2577     1613     -47.2577    349.237   132.742      
1 1 1 18 21 35 o 0 295.3   61    ?      ?    2603.28 50.9628      636.437  50.9628     495.4     -129.037     
1 1 1 18 23 35 o 0 167.4   57.6  ?      ?    1924.45 -87.9244     246.643  -87.9244    558.12    92.0756      
1 1 1 18 25 35 o 0 626     77.2  ?      ?    2808.79 62.955       1398.58  62.955      295.372   62.955       
1 1 1 18 27 35 o 0 123.1   86.7  ?      ?    1960.7  57.8864      7.35378  57.8865     737.745   -122.114     
1 1 1 18 29 35 o 0 1920.8  150.1 ?      ?    5965.79 175.751      2173.3   175.751     27.8896   175.751      
1 1 1 18 31 35 o 0 -30     136.8 ?      ?    1475.54 -168.257     120.471  11.7429     615.049   11.7429      
1 1 1 0  35 19 f 1 148.3   33.8  ?      ?    413.321 -90          250.049  -90         31.8185   -90          
1 1 1 2  35 19 o 0 17.1    23.4  ?      ?    343.159 -6.58606     110.778  173.414     288.993   173.414      
1 1 1 4  35 19 o 0 94.1    22.6  ?      ?    1295.22 -10.4079     165.624  -10.4079    497.88    169.592      
1 1 1 6  35 19 o 0 183.6   27.1  ?      ?    1543.37 -29.738      694.043  -29.738     83.7031   150.262      
1 1 1 8  35 19 o 0 405.7   31.8  ?      ?    2278.63 -11.8624     1374.22  -11.8624    227.791   -11.8624     
1 1 1 10 35 19 o 0 65      28.2  ?      ?    1169.26 30.4615      102.981  -149.538    678.402   -149.538     
1 1 1 12 35 19 o 0 1034.3  52.7  ?      ?    4222.03 174.654      2133     174.654     107.076   174.654      
1 1 1 14 35 19 o 0 76.3    33.5  ?      ?    1358.67 70.5115      55.5381  -109.489    689.012   -109.489     
1 1 1 16 35 19 o 0 1084.8  63.7  ?      ?    3436.9  -104.645     2402.46  -104.645    853.742   -104.645     
1 1 1 18 35 19 o 0 1168.7  69.8  ?      ?    5455.11 -108.382     1662.18  -108.382    707.018   71.6184      
1 1 1 19 20 35 o 0 677.6   63    ?      ?    3890.74 -54.3957     1248.9   -54.3957    444.672   125.604      
1 1 1 19 22 35 o 0 602.1   69.2  ?      ?    3459.06 -156.266     1184.37  -156.266    265.912   23.734       
1 1 1 19 24 35 o 0 -98     70.4  ?      ?    1651.45 75.5941      470.636  -104.406    1121.91   -104.406     
1 1 1 19 26 35 o 0 228.2   90.8  ?      ?    1681.6  18.1837      440.18   18.1837     202.389   -161.816     
1 1 1 19 28 35 o 0 128.2   105.4 ?      ?    1344.94 129.627      97.5295  129.627     389.525   -50.3728     
1 1 1 19 30 35 f 1 1704    173.5 ?      ?    4643.77 43.3184      2248.17  43.3184     669.532   43.3184      
1 1 1 1  35 20 o 0 2446.7  84.6  ?      ?    6461.38 89.5682      3805.93  89.5682     486.157   89.5682      
1 1 1 3  35 20 f 1 365     29.3  ?      ?    4067.22 -176.629     472.571  -176.629    1640.96   3.37097      
1 1 1 5  35 20 o 0 930.9   41.5  ?      ?    3632.61 -55.2982     2303.2   -55.2982    453.566   -55.2982     
1 1 1 7  35 20 o 0 91.5    29.7  ?      ?    508.202 -170.353     76.8688  -170.353    177.391   9.64675      
1 1 1 9  35 20 o 0 301.1   30.6  ?      ?    2448.88 -44.7925     891.668  -44.7925    308.714   135.208      
1 1 1 11 35 20 o 0 1691.5  72.1  ?      ?    5872.64 142.098      2579.79  142.098     231.786   -37.9017     
1 1 1 13 35 20 o 0 734.9   48    ?      ?    4303.21 90.1769      1377.89  90.1769     627.546   -89.8231     
1 1 1 15 35 20 o 0 864.9   57    ?      ?    3748.62 -107.625     1836.6   -107.625    144.87    -107.625     
1 1 1 17 35 20 o 0 470.6   52.5  ?      ?    2828.47 144.832      1168.82  144.832     64.1019   -35.1676     
1 1 1 19 35 20 o 0 52      52.8  ?      ?    2264.9  162.808      418.876  -17.1919    1381.42   -17.1919     
1 1 1 20 21 35 o 0 602.3   70.7  ?      ?    3426.84 173.134      1197.07  173.134     241.023   -6.86604     
1 1 1 20 23 35 o 0 1165.3  84.6  ?      ?    4579.03 74.5608      1826.07  74.5608     16.0175   74.5608      
1 1 1 20 25 35 o 0 1387.8  113   ?      ?    4071.02 -94.0673     2273.23  -94.0673    711.72    -94.0673     
1 1 1 20 27 35 o 0 254.7   109.9 ?      ?    2212.23 121.29       399.841  121.29      405.499   -58.7101     
1 1 1 20 29 35 o 0 2211.9  185.7 ?      ?    5039.75 -79.3888     2717.42  -79.3888    1002.33   -79.3888     
1 1 1 20 31 35 o 0 -201.9  175.8 ?      ?    2068.1  -71.7863     281.049  108.214     947.457   108.214      
1 1 1 0  35 21 o 0 564     48.4  ?      ?    4414.77 90           1707.34  90          571.035   -90          
1 1 1 2  35 21 o 0 1656.4  62.6  ?      ?    4621.62 133.903      3300.78  133.903     939.115   133.903      
1 1 1 4  35 21 o 0 233.1   29.7  ?      ?    764.399 -132.602     742.331  -132.602    356.728   -132.602     
1 1 1 6  35 21 f 1 235.4   31.5  ?      ?    3629.14 -22.7588     125.54   -22.7588    1686.61   157.241      
1 1 1 8  35 21 o 0 129.1   33.7  ?      ?    1211.79 -93.8631     312.07   -93.8631    278.422   86.1369      
1 1 1 10 35 21 o 0 1065.5  52.2  ?      ?    5722.82 -162.771     1508.76  -162.771    1219.63   17.2289      
1 1 1 12 35 21 f 1 2513.4  100.5 ?      ?    5916.21 3.74886      3628.52  3.74886     866.576   3.74886      
1 1 1 14 35 21 o 0 1191.9  65.6  ?      ?    4292.6  99.8523      2259.73  99.8523     323.443   99.8523      
1 1 1 16 35 21 o 0 153.3   50.1  ?      ?    2276.17 -67.115      178.788  -67.115     814.971   112.885      
1 1 1 18 35 21 o 0 337.8   59.8  ?      ?    4608.01 102.065      38.4415  102.065     1927.42   -77.9345     
1 1 1 20 35 21 o 0 114.4   61.8  ?      ?    2347.35 30.7434      115.123  -149.257    1075.78   -149.257     
1 1 1 21 22 35 o 0 199.8   76.5  ?      ?    1301.65 102.572      369.124  102.572     145.731   -77.4278     
1 1 1 21 24 35 f 1 42.6    82.3  ?      ?    984.585 -176.561     95.8765  3.43899     476.441   3.43899      
1 1 1 21 26 35 f 1 827.5   118.7 ?      ?    2754.27 -170.219     1673.39  -170.219    661.545   -170.219     
1 1 1 21 28 35 o 0 416.6   180.2 ?      ?    3102.75 31.5241      587.126  31.5241     473.982   -148.476     
1 1 1 21 30 35 o 0 1461.6  203.6 ?      ?    4988.1  177.553      1717.7   177.553     100.088   177.553      
1 1 1 1  35 22 f 1 1398.4  57.4  ?      ?    3797.61 -8.55904     3165.39  -8.55904    1240.01   -8.55904     
1 1 1 3  35 22 o 0 407.5   35.4  ?      ?    1846.1  -178.934     1502.77  -178.934    582.166   -178.934     
1 1 1 5  35 22 o 0 370.7   33.2  ?      ?    1795.93 104.608      1364.01  104.608     480.862   104.608      
1 1 1 7  35 22 f 1 339.2   37.8  ?      ?    1779.04 114.662      1225.48  114.662     360.54    114.662      
1 1 1 9  35 22 o 0 11.3    36.4  ?      ?    1321.81 128.953      379.855  -51.0467    1006.17   -51.0467     
1 1 1 11 35 22 o 0 668     48.6  ?      ?    2031.63 -113.332     2043.96  -113.332    1104.93   -113.332     
1 1 1 13 35 22 o 0 2377.2  97.1  ?      ?    6671.1  -71.8459     3029.8   -71.8459    28.0493   -71.8459     
1 1 1 15 35 22 o 0 1510.8  75.9  ?      ?    5125.73 58.8313      2378.44  58.8313     141.592   58.8313      
1 1 1 17 35 22 o 0 718.3   66    ?      ?    4500.4  151.993      1080.03  151.993     843.233   -28.0072     
1 1 1 19 35 22 o 0 1547    96.5  ?      ?    5232.98 -32.5854     2175.47  -32.5854    25.1158   -32.5854     
1 1 1 21 35 22 o 0 -17     80    ?      ?    2346.56 176.159      501.453  -3.84146    1405.88   -3.84146     
1 1 1 22 23 35 o 0 20.2    85.1  ?      ?    2186.89 -108.829     358.12   71.1711     1198.89   71.1711      
1 1 1 22 25 35 o 0 2240.7  144   ?      ?    5751.59 20.6757      2644.95  20.6757     540.287   20.6757      
1 1 1 22 27 35 o 0 881.9   140.7 ?      ?    3686.04 -157.885     1435.98  -157.885    150.391   -157.885     
1 1 1 22 29 35 o 0 -0.8    170.2 ?      ?    1025.12 -50.4134     10.4684  -50.4134    323.492   129.587      
1 1 1 0  35 23 o 0 447.6   52.4  ?      ?    3073.39 -90          1455.11  -90         69.7294   90           
1 1 1 2  35 23 o 0 1274.1  55.8  ?      ?    5570.95 13.8678      2047.77  13.8678     692.094   -166.132     
1 1 1 4  35 23 o 0 111.7   36.5  ?      ?    2655.35 97.9981      137.556  -82.0019    1427.91   -82.0019     
1 1 1 6  35 23 o 0 2511.6  94.8  ?      ?    5728.04 -21.7601     3846.15  -21.7601    1104.47   -21.7601     
1 1 1 8  35 23 o 0 -5.3    39.9  ?      ?    841.126 -107.127     267.252  72.8726     661.966   72.8726      
1 1 1 10 35 23 o 0 38.2    38    ?      ?    1234.61 -133.903     266.986  46.0966     834.013   46.0966      
1 1 1 12 35 23 o 0 493.8   53.5  ?      ?    2656.04 134.114      1326.98  134.114     137.187   134.114      
1 1 1 14 35 23 f 1 1876.9  89.5  ?      ?    4912.66 -102.175     2986.92  -102.175    836.296   -102.175     
1 1 1 16 35 23 o 0 143.3   52.4  ?      ?    2141.48 -5.40893     90.6963  -5.40893    824.138   174.591      
1 1 1 18 35 23 o 0 550     74    ?      ?    1767.7  57.6155      1528.51  57.6155     800.732   57.6155      
1 1 1 20 35 23 o 0 2568.1  126.9 ?      ?    6489.19 -163.444     2889.1   -163.444    377.081   -163.444     
1 1 1 22 35 23 o 0 637.2   95.7  ?      ?    1927.73 -56.0157     1551.01  -56.0157    829.139   -56.0157     
1 1 1 23 24 35 o 0 1725.7  131.4 ?      ?    5226.9  -95.616      2225.66  -95.616     313.219   -95.616      
1 1 1 23 26 35 o 0 542.8   131   ?      ?    2557.8  -14.2033     1110.38  -14.2033    217.123   -14.2033     
1 1 1 23 28 35 o 0 876.7   176.1 ?      ?    3430.91 143.446      1400.06  143.446     279.299   143.446      
1 1 1 1  35 24 o 0 560.5   41.2  ?      ?    2811.61 -173.804     1603.62  -173.804    243.221   -173.804     
1 1 1 3  35 24 o 0 859.6   50.4  ?      ?    5770.8  8.35295      1038.78  8.35295     1721.89   -171.647     
1 1 1 5  35 24 o 0 1406.2  63.9  ?      ?    3212.42 -156.524     3214.17  -156.524    1697.47   -156.524     
1 1 1 7  35 24 o 0 2894.9  108.2 ?      ?    6859.75 -56.5841     3698.42  -56.5841    512.279   -56.5841     
1 1 1 9  35 24 o 0 836.8   54.7  ?      ?    3393.12 167.909      1934.09  167.909     388.748   167.909      
1 1 1 11 35 24 o 0 130.8   46.9  ?      ?    1551.58 107.752      184.59   107.752     505.947   -72.2477     
1 1 1 13 35 24 o 0 182     54.8  ?      ?    1632.56 66.8784      440.055  66.8784     267.411   -113.122     
1 1 1 15 35 24 o 0 1286.9  78.8  ?      ?    4560.21 163.978      2121.71  163.978     178.361   163.978      
1 1 1 17 35 24 f 1 954.8   85    ?      ?    3183.82 -75.5265     1974.24  -75.5265    656.323   -75.5265     
1 1 1 19 35 24 o 0 984.9   95.8  ?      ?    3728.99 116.887      1779.88  116.887     333.267   116.887      
1 1 1 21 35 24 f 1 147.1   94.7  ?      ?    2369.48 77.3155      12.8097  77.3155     883.676   -102.685     
1 1 1 23 35 24 o 0 978.2   132   ?      ?    2613.26 -147.671     1918.26  -147.671    986.999   -147.671     
1 1 1 24 25 35 o 0 2830.7  183.7 ?      ?    6032.39 149.059      3016.58  149.059     911.067   149.059      
1 1 1 24 27 35 o 0 618.3   171.9 ?      ?    2662.43 -20.1173     1137.63  -20.1173    267.146   -20.1173     
1 1 1 0  35 25 o 0 163.3   70.1  ?      ?    2568.33 90           661.43   90          556.143   -90          
1 1 1 2  35 25 o 0 860.3   52.9  ?      ?    3503.31 163.581      2007.33  163.581     359.016   163.581      
1 1 1 4  35 25 o 0 1155.5  60.5  ?      ?    4699.66 -68.0175     2088.21  -68.0175    98.7691   111.982      
1 1 1 6  35 25 o 0 895.1   55.8  ?      ?    4264.31 123.675      1718.78  123.675     237.322   -56.325      
1 1 1 8  35 25 o 0 571.9   49.4  ?      ?    1877.54 125.955      1783.54  125.955     937.394   125.955      
1 1 1 10 35 25 o 0 179     52.7  ?      ?    1336.85 147.122      454.562  147.122     135.333   -32.878      
1 1 1 12 35 25 f 1 542.9   62.1  ?      ?    2445.3  -62.1762     1435.04  -62.1762    361.686   -62.1762     
1 1 1 14 35 25 o 0 93.1    57.2  ?      ?    1673.04 -76.6356     77.3108  103.364     787.063   103.364      
1 1 1 16 35 25 o 0 421.8   73.7  ?      ?    2413.41 112.249      1036.61  112.249     45.543    112.249      
1 1 1 18 35 25 o 0 42.3    74.4  ?      ?    751.183 37.9891      80.348   -142.011    371.748   -142.011     
1 1 1 20 35 25 o 0 257.9   92.3  ?      ?    2107.46 -44.15       482.636  -44.15      312.156   135.85       
1 1 1 22 35 25 o 0 479.7   113.3 ?      ?    3622    59.3108      682.505  59.3108     614.745   -120.689     
1 1 1 24 35 25 o 0 219.5   139.3 ?      ?    2337.39 116.681      266.431  116.681     528.452   -63.3187     
1 1 1 25 26 35 f 1 611.8   165.6 ?      ?    3220.73 -0.56642     989.301  -0.56642    68.5901   179.434      
1 1 1 1  35 26 o 0 1622.9  75.8  ?      ?    4898.48 87.2259      2797.45  87.2259     536.487   87.2259      
1 1 1 3  35 26 o 0 223     47.5  ?      ?    2348.11 -103.853     507.099  -103.853    567.286   76.1471      
1 1 1 5  35 26 o 0 1866.5  80.8  ?      ?    5252.86 -43.8801     2958.93  -43.8801    584.654   -43.8801     
1 1 1 7  35 26 o 0 1254.6  68.7  ?      ?    3897.86 111.746      2498.97  111.746     764.509   111.746      
1 1 1 9  35 26 o 0 14      50    ?      ?    809.011 149.458      194.008  -30.5417    552.096   -30.5417     
1 1 1 11 35 26 o 0 -0.7    55.4  ?      ?    519.543 -126.137     125.345  53.8626     350.153   53.8626      
1 1 1 13 35 26 o 0 1429.5  88.6  ?      ?    4821.55 -158.402     2218.56  -158.402    186.635   -158.402     
1 1 1 15 35 26 o 0 313.6   69.9  ?      ?    1407.49 30.3183      870.925  30.3183     295.524   30.3183      
1 1 1 17 35 26 o 0 243.2   78    ?      ?    1904.87 60.3707      534.549  60.3707     212.675   -119.629     
1 1 1 19 35 26 o 0 -87     93.5  ?      ?    145.887 -61.712      29.9597  118.288     84.9884   118.288      
1 1 1 21 35 26 f 1 320.1   120.4 ?      ?    2187.4  -25.2694     587.079  -25.2694    202.938   154.731      
1 1 1 23 35 26 o 0 493.6   150.3 ?      ?    1516.3  99.2487      1111.91  99.2487     593.456   99.2487      
1 1 1 25 35 26 f 1 871.3   167.6 ?      ?    4380.58 12.2373      1097.73  12.2373     305.249   -167.763     
1 1 1 0  35 27 o 0 509.5   89.4  ?      ?    1360.09 -90          1251.31  -90         637.124   -90          
1 1 1 2  35 27 o 0 305.1   50.4  ?      ?    1014.99 -32.9392     934.388  -32.9392    478.91    -32.9392     
1 1 1 4  35 27 o 0 893.2   62.5  ?      ?    2358.69 158.285      2371.3   158.285     1323.31   158.285      
1 1 1 6  35 27 o 0 28.6    50.9  ?      ?    771.66  -47.5955     158.066  132.404     501.028   132.404      
1 1 1 8  35 27 o 0 198.8   60    ?      ?    1405.71 -2.83556     487.814  -2.83556    126.407   177.164      
1 1 1 10 35 27 o 0 39      61.1  ?      ?    1523.79 53.1143      254.105  -126.886    906.343   -126.886     
1 1 1 12 35 27 o 0 1268    83    ?      ?    4327.64 70.6721      2136.08  70.6721     328.22    70.6721      
1 1 1 14 35 27 f 1 517.5   74.3  ?      ?    2112.92 -175.528     1336.82  -175.528    491.008   -175.528     
1 1 1 16 35 27 o 0 277.2   81.8  ?      ?    980.916 -61.1403     609.666  -61.1403    226.564   -61.1403     
1 1 1 18 35 27 o 0 494.8   99.9  ?      ?    2706.61 -64.307      1052.36  -64.307     33.4879   -64.307      
1 1 1 20 35 27 o 0 622.3   120.1 ?      ?    3227.31 94.4398      1120.02  94.4398     39.5669   -85.5602     
1 1 1 22 35 27 o 0 17      140.9 ?      ?    1688.71 -135.236     68.8453  44.7644     648.032   44.7644      
1 1 1 24 35 27 o 0 299.6   164.9 ?      ?    2172.46 -57.324      458.515  -57.324     237.411   122.676      
1 1 1 1  35 28 o 0 917.9   67.7  ?      ?    5110.57 -73.2552     1303.25  -73.2552    971.217   106.745      
1 1 1 3  35 28 o 0 636.5   63.3  ?      ?    1889.06 -168.692     1844.57  -168.692    1010.14   -168.692     
1 1 1 5  35 28 o 0 264.9   56.3  ?      ?    1063.12 -84.2686     720.822  -84.2686    256.461   -84.2686     
1 1 1 7  35 28 o 0 320     62    ?      ?    1576.95 49.453       941.864  49.453      263.209   49.453       
1 1 1 9  35 28 o 0 530.9   67.4  ?      ?    3261.51 74.2629      1088.1   74.2629     289.824   -105.737     
1 1 1 11 35 28 o 0 1219.1  90.7  ?      ?    4856.21 -78.2751     1827.61  -78.2751    178.987   101.725      
1 1 1 13 35 28 o 0 2681.1  124.5 ?      ?    6366.42 102.495      3119.85  102.495     607.811   102.495      
1 1 1 15 35 28 f 1 230.3   83.2  ?      ?    2681.12 -102.625     269.117  -102.625    777.039   77.3748      
1 1 1 17 35 28 o 0 509.8   97.3  ?      ?    1498.2  -83.6888     1274.92  -83.6888    716.164   -83.6888     
1 1 1 19 35 28 o 0 5.4     105.4 ?      ?    354.181 56.938       30.6941  -123.062    157.724   -123.062     
1 1 1 21 35 28 o 0 487.2   141.9 ?      ?    2294.42 -66.4135     1014.39  -66.4135    239.754   -66.4135     
1 1 1 23 35 28 o 0 599.7   176   ?      ?    3374.11 98.4873      898.778  98.4873     185.833   -81.5127     
1 1 1 0  35 29 o 0 375.5   103.2 ?      ?    2457.24 90           1072.34  90          5.56868   90           
1 1 1 2  35 29 o 0 1046.2  77    ?      ?    4396.66 -130.79      1793.28  -130.79     106.04    49.2099      
1 1 1 4  35 29 o 0 134.2   65.1  ?      ?    677.026 -20.5445     132.582  -20.5445    157.324   159.456      
1 1 1 6  35 29 o 0 49.4    64.4  ?      ?    1649.7  -140.736     235.021  39.2639     932.62    39.2639      
1 1 1 8  35 29 o 0 1353.1  98.2  ?      ?    3926.59 35.1047      2407.37  35.1047     773.74    35.1047      
1 1 1 10 35 29 o 0 393.3   76.5  ?      ?    2829.56 119.934      821.372  119.934     309.612   -60.0662     
1 1 1 12 35 29 o 0 57.4    84.5  ?      ?    1573.59 138.284      142.413  -41.7158    764.792   -41.7158     
1 1 1 14 35 29 o 0 34.9    76    ?      ?    1214.62 30.1008      157.066  -149.899    624.233   -149.899     
1 1 1 16 35 29 o 0 867.9   107.6 ?      ?    3568.24 178.183      1538.68  178.183     216.452   178.183      
1 1 1 18 35 29 o 0 365.7   114.2 ?      ?    1965.35 60.1736      814.766  60.1736     112.721   60.1736      
1 1 1 20 35 29 o 0 365.2   146   ?      ?    2195.32 -123.47      679.184  -123.47     60.8607   56.5299      
1 1 1 22 35 29 o 0 965     194   ?      ?    3962.02 80.2948      1345.27  80.2948     70.2523   80.2948      
1 1 1 1  35 30 o 0 1146.3  90    ?      ?    3885.16 76.0161      2114.68  76.0161     477.756   76.0161      
1 1 1 3  35 30 o 0 2270.9  108.3 ?      ?    6530.43 -133.24      2659.01  -133.24     75.2884   46.7597      
1 1 1 5  35 30 o 0 439.9   76    ?      ?    2448.26 36.039       1075.68  36.039      81.0711   36.039       
1 1 1 7  35 30 o 0 390.7   78.2  ?      ?    658.287 -44.0041     773.151  -44.0041    509.426   -44.0041     
1 1 1 9  35 30 o 0 1324.7  100   ?      ?    4531.9  -64.2596     2111.01  -64.2596    303.421   -64.2596     
1 1 1 11 35 30 o 0 396.7   92.1  ?      ?    2583.44 38.9296      865.152  38.9296     143.193   -141.07      
1 1 1 13 35 30 f 1 30.2    96.7  ?      ?    821.973 -89.5597     72.4863  90.4403     385.353   90.4403      
1 1 1 15 35 30 o 0 -97.7   94.2  ?      ?    1979.2  -16.92       448.895  163.08      1175.95   163.08       
1 1 1 17 35 30 o 0 1168.3  132.5 ?      ?    2843.91 56.4925      2167.64  56.4925     1158.14   56.4925      
1 1 1 19 35 30 f 1 118.3   132.6 ?      ?    2310.14 128.995      8.65594  -51.0047    788.827   -51.0047     
1 1 1 21 35 30 o 0 24.5    168.2 ?      ?    2751.27 -40.1839     208.477  139.816     1092.78   139.816      
1 1 1 0  35 31 o 0 155.1   122.7 ?      ?    1872.08 90           362.67   90          389.225   -90          
1 1 1 2  35 31 o 0 -20.7   83.7  ?      ?    1167.53 -162.643     223.843  17.3566     697.382   17.3566      
1 1 1 4  35 31 o 0 174.7   79.9  ?      ?    1693.17 132.125      259.183  132.125     422.346   -47.8754     
1 1 1 6  35 31 o 0 -27.1   83.2  ?      ?    713.527 -28.5453     136.424  151.455     420.335   151.455      
1 1 1 8  35 31 o 0 181.8   89.1  ?      ?    3633.17 134.974      213.878  -45.0265    1637.36   -45.0265     
1 1 1 10 35 31 o 0 3089.3  158.8 ?      ?    6773.29 -74.5447     3280.29  -74.5447    677.411   -74.5447     
1 1 1 12 35 31 o 0 344.2   113.2 ?      ?    1989.1  98.7095      733.4    98.7095     9.53462   -81.2905     
1 1 1 14 35 31 o 0 546.2   125.2 ?      ?    3352.4  -145.743     932.014  -145.743    286.084   34.2566      
1 1 1 16 35 31 o 0 551.5   119.4 ?      ?    851.325 -132.567     1097.93  -132.567    803.226   -132.567     
1 1 1 18 35 31 o 0 1763.1  173.2 ?      ?    6816.09 -10.2352     1618.33  -10.2352    656.705   169.765      
1 1 1 20 35 31 o 0 229.3   201   ?      ?    1949.78 111.412      286.853  111.412     337.622   -68.5875     
1 1 1 1  35 32 o 0 131.4   111.3 ?      ?    2673.09 114.619      94.6108  -65.3807    1148.93   -65.3807     
1 1 1 3  35 32 o 0 -187.4  92.1  ?      ?    757.565 112.353      207.413  -67.6472    504.738   -67.6472     
1 1 1 5  35 32 o 0 300.7   92.5  ?      ?    841.023 -125.716     616.966  -125.716    289.848   -125.716     
1 1 1 7  35 32 f 1 1067.5  103.5 ?      ?    2891.28 -35.1341     2150.86  -35.1341    1040.2    -35.1341     
1 1 1 9  35 32 o 0 541.5   107.8 ?      ?    2642.23 -170.412     1162.21  -170.412    169.94    -170.412     
1 1 1 11 35 32 o 0 -93.9   112.4 ?      ?    1013.64 11.0367      176.8    -168.963    549.54    -168.963     
1 1 1 13 35 32 o 0 883.8   138.3 ?      ?    5675.77 76.0446      830.696  76.0446     1204.46   -103.955     
1 1 1 15 35 32 f 1 743.4   132.6 ?      ?    1915.19 -169.64      1623.89  -169.64     964.359   -169.64      
1 1 1 17 35 32 o 0 176.3   142   ?      ?    1529.6  -164.349     226.88   -164.349    279.389   15.6507      
1 1 1 0  35 33 o 0 -395.3  186.7 ?      ?    1561.66 90           70.3531  90          523.882   -90          
1 1 1 2  35 33 o 0 -54.2   111.1 ?      ?    1244.72 -57.1781     200.755  122.822     673.37    122.822      
1 1 1 4  35 33 o 0 -66.8   98.6  ?      ?    1036.9  -155.337     198.958  24.6631     590.167   24.6631      
1 1 1 6  35 33 f 1 257.4   103.7 ?      ?    1533.23 -144.314     505.034  -144.314    70.6402   35.6856      
1 1 1 8  35 33 o 0 437.5   113.3 ?      ?    2061.73 -53.7413     1018.63  -53.7413    259.996   -53.7413     
1 1 1 10 35 33 o 0 2879    182.3 ?      ?    7144.92 103.402      2780.28  103.402     199.777   103.402      
1 1 1 12 35 33 o 0 1645.1  161.5 ?      ?    5191    -51.0201     2084.98  -51.0201    282.49    -51.0201     
1 1 1 14 35 33 o 0 194.4   147.8 ?      ?    1671.31 131.022      278.814  131.021     286.003   -48.9785     
1 1 1 16 35 33 o 0 548.9   187.1 ?      ?    3553.29 -24.9381     656.688  -24.9381    506.833   155.062      
1 1 1 1  35 34 o 0 272.3   152.7 ?      ?    1080.55 -18.2203     481.152  -18.2203    83.3459   -18.2203     
1 1 1 3  35 34 o 0 107.3   126.5 ?      ?    1415.97 -115.726     82.6448  -115.726    436.776   64.2741      
1 1 1 5  35 34 o 0 153.7   116.7 ?      ?    2727.61 -174.85      21.2715  5.15035     1014.03   5.15035      
1 1 1 7  35 34 o 0 539.4   121.1 ?      ?    2963.1  75.7392      1035.97  75.7392     29.623    -104.261     
1 1 1 9  35 34 o 0 1234.3  147.6 ?      ?    4149.62 -50.7588     1875.91  -50.7588    431.609   -50.7588     
1 1 1 11 35 34 f 1 483.1   138.8 ?      ?    2864.62 -11.6911     875.101  -11.6911    107.365   168.309      
1 1 1 13 35 34 f 1 1999    186.5 ?      ?    4976.03 143.432      2427.3   143.432     762.262   143.432      
1 1 1 0  35 35 o 0 57.8    253.4 ?      ?    1704.87 -90          262.106  -90         334.738   90           
1 1 1 2  35 35 f 1 1059.5  157.6 ?      ?    2502.19 -149.057     2078.89  -149.057    1198.6    -149.057     
1 1 1 4  35 35 o 0 1049.5  151.8 ?      ?    4389.28 97.5956      1518.77  97.5956     8.9433    -82.4044     
1 1 1 6  35 35 o 0 47.9    135.8 ?      ?    1704.55 -84.5584     48.0452  95.4416     635.79    95.4416      
1 1 1 8  35 35 f 1 -114.3  135.3 ?      ?    1922.01 86.3637      291.916  -93.6363    949.383   -93.6363     
1 1 1 10 35 35 o 0 2350.7  201.6 ?      ?    5689.94 -116.428     2581.67  -116.428    680.483   -116.428     
1 1 1 0  36 0  f 1 977.2   73.5  ?      ?    2667.01 4.82278e-14  2388.88  0           915.342   -7.7638e-14  
1 1 1 0  2  36 o 0 275.3   21.4  ?      ?    1155.99 180          1060.22  180         448.231   -180         
1 1 1 0  4  36 o 0 94.2    15.9  ?      ?    819.02  -180         347.697  180         87.2266   3.07007e-13  
1 1 1 0  6  36 o 0 -4.5    15.6  ?      ?    512.434 -6.13464e-14 11.1491  0           260.694   180          
1 1 1 0  8  36 o 0 93.3    17.1  ?      ?    2029.88 1.69911e-14  610.704  0           460.642   -180         
1 1 1 0  10 36 o 0 -40.6   17.3  ?      ?    366.121 180          3.54064  180         187.913   -8.01317e-14 
1 1 1 0  12 36 f 1 97.1    18.3  ?      ?    2027.67 -3.99963e-15 635.996  0           453.62    180          
1 1 1 0  14 36 o 0 70.5    18.8  ?      ?    569.676 5.29315e-15  158.628  0           137.601   -180         
1 1 1 0  16 36 o 0 355.9   29    ?      ?    1373.24 180          1236.12  180         537.399   180          
1 1 1 0  18 36 o 0 3863.5  186.5 ?      ?    8432.75 -8.80641e-15 4370.94  0           189.933   1.93856e-13  
1 1 1 0  20 36 o 0 119.1   37.2  ?      ?    453.301 1.67456e-13  172.762  0           49.2092   -180         
1 1 1 0  22 36 o 0 -13.5   39.8  ?      ?    1128.13 -180         41.8987  180         491.978   1.96888e-14  
1 1 1 0  24 36 o 0 506.6   58.7  ?      ?    1380.66 -3.31297e-14 1279.94  0           652.001   3.19069e-14  
1 1 1 0  26 36 o 0 204.9   60.8  ?      ?    1279    180          563.764  180         6.15208   -180         
1 1 1 0  28 36 o 0 142.9   71.8  ?      ?    156.255 180          42.4504  180         23.4915   -1.21284e-12 
1 1 1 0  30 36 f 1 300.5   92.4  ?      ?    333.512 7.02742e-14  204.376  0           70.6809   -1.32925e-13 
1 1 1 0  32 36 o 0 319.3   170.9 ?      ?    1327.31 -180         488.991  180         9.57177   1.10496e-12  
1 1 1 0  34 36 o 0 135.1   263.4 ?      ?    1008.31 2.30298e-14  206.417  0           145.005   -180         
1 1 1 1  3  36 o 0 383.7   17.3  ?      ?    2624.93 -125.037     1312.81  -125.037    77.9524   54.9631      
1 1 1 1  9  36 o 0 177     13.1  ?      ?    1047.69 156.752      781.762  156.752     232.027   156.752      
1 1 1 1  11 36 o 0 96.5    13.4  ?      ?    1620.94 114.721      192.604  114.721     648.297   -65.2793     
1 1 1 1  13 36 o 0 370.4   18.8  ?      ?    3841.4  -40.0202     685.521  -40.0202    1327.13   139.98       
1 1 1 1  15 36 o 0 36.9    14.1  ?      ?    1087.04 -137.224     251.245  42.7755     809.733   42.7755      
1 1 1 1  17 36 o 0 469.3   25.4  ?      ?    1504.56 -135.511     1892.42  -135.511    1137.53   -135.511     
1 1 1 1  19 36 o 0 1182.1  49.6  ?      ?    2960.3  -167.055     3074.58  -167.055    1604.39   -167.055     
1 1 1 1  21 36 o 0 2202.1  83.9  ?      ?    5171.43 54.6343      3693.21  54.6343     1205.52   54.6343      
1 1 1 1  23 36 o 0 1956.6  80    ?      ?    4763.38 -54.0502     3379.71  -54.0502    1172.57   -54.0502     
1 1 1 1  25 36 o 0 476     45.2  ?      ?    2825.93 59.2289      1212.85  59.2289     45.1882   -120.771     
1 1 1 1  27 36 o 0 358.6   49.9  ?      ?    1017.55 142.901      1019.41  142.901     579.934   142.901      
1 1 1 1  29 36 o 0 2737.1  120.5 ?      ?    6123.7  -119.403     3343.01  -119.403    872.354   -119.403     
1 1 1 1  31 36 o 0 1153.2  116.1 ?      ?    4218.84 67.2121      1884.12  67.2121     246.654   67.2121      
1 1 1 1  33 36 o 0 286.5   152.9 ?      ?    866.321 -74.9731     460.552  -74.9731    144.25    -74.9731     
1 1 1 1  35 36 o 0 1087.3  205.6 ?      ?    2689.79 164.705      1961.18  164.705     1051.51   164.705      
1 1 1 0  36 2  o 0 904.8   44    ?      ?    3350.88 -5.53229e-14 2341.79  0           487.094   2.10652e-13  
1 1 1 2  36 2  f 1 360.3   16.8  ?      ?    1134    -121.549     1723.33  -121.549    1100.81   -121.549     
1 1 1 2  4  36 o 0 404.3   17.8  ?      ?    1136.56 79.8814      1844.45  79.8814     1242.88   79.8814      
1 1 1 2  6  36 o 0 405.4   17.8  ?      ?    1285.16 -7.39988     1841.28  -7.39988    1162.02   -7.39988     
1 1 1 2  8  36 o 0 319.5   16.7  ?      ?    4036.79 142.527      385.714  142.527     1736.37   -37.4731     
1 1 1 2  10 36 o 0 537.2   23.1  ?      ?    3083.28 7.55627      1613.69  7.55627     8.05887   7.55627      
1 1 1 2  12 36 o 0 526.4   23.6  ?      ?    2574.39 157.169      1824.08  157.169     467.403   157.169      
1 1 1 2  14 36 o 0 699.1   28.5  ?      ?    3186.79 49.1044      2042.2   49.1044     391.971   49.1044      
1 1 1 2  16 36 o 0 928.7   36.4  ?      ?    3118.28 -97.0847     2610.47  -97.0847    1030.21   -97.0847     
1 1 1 2  18 36 o 0 2727.3  92.1  ?      ?    5886.64 121.309      4320.1   121.309     1412.48   121.309      
1 1 1 2  20 36 o 0 2390.5  86.9  ?      ?    5256.85 -53.021      3973.71  -53.021     1408.48   -53.021      
1 1 1 2  22 36 o 0 313.1   31.5  ?      ?    2186.51 -168.727     991.648  -168.727    39.8905   11.2727      
1 1 1 2  24 36 o 0 814.6   48    ?      ?    3184.18 -8.08895     1959.97  -8.08895    515.66    -8.08895     
1 1 1 2  26 36 o 0 284.7   43.2  ?      ?    1984.49 -50.8805     784.707  -50.8805    90.5387   129.119      
1 1 1 2  28 36 o 0 1144.5  73.4  ?      ?    2841.12 115.98       2493.84  115.98      1296.95   115.98       
1 1 1 2  30 36 o 0 961     89.1  ?      ?    3460.59 -0.602372    1880.09  -0.602372   502.375   -0.602372    
1 1 1 2  32 36 o 0 51.6    124.2 ?      ?    1407.72 -137.041     47.3414  42.9595     575.71    42.9595      
1 1 1 2  34 36 o 0 480.9   157.8 ?      ?    2164.76 147.955      1003.05  147.955     248.761   147.955      
1 1 1 3  36 3  o 0 342.3   16.3  ?      ?    1438.12 43.6373      1611.74  43.6373     831.054   43.6373      
1 1 1 3  5  36 o 0 284     15.6  ?      ?    1600.33 -142.204     1280.28  -142.204    435.598   -142.204     
1 1 1 3  7  36 o 0 664.9   25.1  ?      ?    3289.92 40.2131      1919.71  40.2132     189.507   40.2132      
1 1 1 3  9  36 o 0 231.9   15.1  ?      ?    695.245 136.415      930.9    136.415     568.02    136.415      
1 1 1 3  11 36 o 0 124.6   13.7  ?      ?    431.554 -16.7584     287.907  -16.7584    57.307    -16.7584     
1 1 1 3  13 36 o 0 454.5   23    ?      ?    2820.16 -55.6852     1457.03  -55.6852    12.4013   124.315      
1 1 1 3  15 36 o 0 364     19.9  ?      ?    3582.84 -125.575     763.472  -125.575    1067.18   54.4248      
1 1 1 3  17 36 o 0 2221.1  72.3  ?      ?    5980.21 67.9899      3599.94  67.9899     615.601   67.9899      
1 1 1 3  19 36 o 0 1219.3  50.9  ?      ?    4565.02 -68.1611     2420.19  -68.1611    164.809   -68.1611     
1 1 1 3  21 36 o 0 126.8   26.1  ?      ?    1778.1  109.881      227.297  109.881     623.823   -70.1192     
1 1 1 3  23 36 o 0 238.8   31.5  ?      ?    1286.56 80.3132      757.762  80.3132     164.394   80.3132      
1 1 1 3  25 36 o 0 2940.5  108.6 ?      ?    7068.8  -141.578     3493.76  -141.578    360.416   -141.578     
1 1 1 3  27 36 o 0 865.8   59.4  ?      ?    2800.38 1.83833      2039.56  1.83833     834.799   1.83833      
1 1 1 3  29 36 o 0 -29.8   55.2  ?      ?    972.653 32.5746      266.818  -147.425    657.866   -147.425     
1 1 1 3  31 36 o 0 -59.6   77.6  ?      ?    2007.42 -34.5552     492.145  145.445     1268.88   145.445      
1 1 1 3  33 36 o 0 485.2   123.6 ?      ?    3015.61 147.228      894.903  147.228     203.194   -32.7724     
1 1 1 3  35 36 o 0 337.4   153.9 ?      ?    2081.17 -14.3558     603.269  -14.3559    99.0052   165.644      
1 1 1 0  36 4  o 0 58.9    16    ?      ?    1221.89 5.60801e-14  314.344  0           364.178   -180         
1 1 1 2  36 4  o 0 415.7   18.4  ?      ?    1687.97 -152.969     1857.19  -152.969    932.812   -152.969     
1 1 1 4  36 4  o 0 215.3   13.8  ?      ?    1401.13 -84.43       1008.58  -84.43      253.347   -84.43       
1 1 1 4  6  36 o 0 335.3   16.6  ?      ?    2882.78 68.7685      998.136  68.7685     516.578   -111.231     
1 1 1 4  8  36 o 0 857.4   31.2  ?      ?    3525.03 -58.9501     2310.1   -58.9501    468.623   -58.9501     
1 1 1 4  10 36 o 0 27.6    12.9  ?      ?    789.861 63.9885      211.742  -116.011    620.377   -116.011     
1 1 1 4  12 36 o 0 127.2   14.8  ?      ?    1794.26 111.735      319.944  111.735     619.256   -68.2651     
1 1 1 4  14 36 o 0 256     18.9  ?      ?    2742.97 176.526      687.805  176.526     722.909   -3.47405     
1 1 1 4  16 36 o 0 806.2   32.9  ?      ?    4052.81 -81.4047     1871.75  -81.4047    168.064   98.5953      
1 1 1 4  18 36 o 0 51.5    18.3  ?      ?    1101.35 111.258      176.237  -68.7417    726.139   -68.7417     
1 1 1 4  20 36 o 0 165.5   24.4  ?      ?    1148.39 -147.482     510.258  -147.482    46.413    32.5185      
1 1 1 4  22 36 o 0 495.6   34.6  ?      ?    2419.4  20.9852      1513.15  20.9852     379.098   20.9852      
1 1 1 4  24 36 o 0 132.1   29.6  ?      ?    2269.79 -43.8185     77.9852  -43.8185    945.169   136.181      
1 1 1 4  26 36 o 0 252.7   55.9  ?      ?    3773.92 137.093      66.9143  137.093     1587.66   -42.9068     
1 1 1 4  28 36 o 0 212.9   31.2  ?      ?    2351.13 -27.6362     389.467  -27.6362    595.423   152.364      
1 1 1 4  30 36 o 0 1126.9  77.7  ?      ?    3955.43 175.839      1992.81  175.839     426.444   175.839      
1 1 1 4  32 36 o 0 585.1   96.9  ?      ?    3761.41 -10.194      932.306  -10.194     472.476   169.806      
1 1 1 4  34 36 f 1 453.7   138.9 ?      ?    2337.37 61.8435      946.299  61.8435     131.039   61.8435      
1 1 1 3  36 5  o 0 183.7   13.5  ?      ?    2145.04 71.9133      619.444  71.9133     546.308   -108.087     
1 1 1 5  36 5  f 1 113.4   12.5  ?      ?    1837.48 -145         263.512  -145        723.938   34.9998      
1 1 1 5  9  36 o 0 703.1   28.3  ?      ?    3259.67 -112.359     2011.39  -112.359    322.793   -112.359     
1 1 1 5  11 36 o 0 374.1   19.5  ?      ?    2130.36 -20.9804     1485.22  -20.9804    355.743   -20.9804     
1 1 1 5  13 36 o 0 2554.8  84.6  ?      ?    5654.17 53.3753      4388.73  53.3753     1466.26   53.3753      
1 1 1 5  15 36 o 0 1480.7  52.7  ?      ?    4409.29 -157.751     3169.06  -157.751    934.48    -157.751     
1 1 1 5  17 36 o 0 257.7   21.9  ?      ?    3209.42 -76.7282     474.426  -76.7282    1114.06   103.272      
1 1 1 5  19 36 o 0 406.5   29.5  ?      ?    3476.18 52.0502      864.31   52.0502     839.058   -127.95      
1 1 1 5  21 36 o 0 303.5   36.4  ?      ?    1507.22 46.6609      1115.27  46.6609     399.67    46.6609      
1 1 1 5  23 36 f 1 305.8   42.1  ?      ?    1442.24 -123.074     1021.06  -123.074    357.477   -123.074     
1 1 1 5  25 36 o 0 473.1   52.5  ?      ?    2360.23 -10.8112     1338.83  -10.8112    300.812   -10.8112     
1 1 1 5  27 36 o 0 -81.7   58.9  ?      ?    283.155 108.249      88.878   -71.7506    209.765   -71.7506     
1 1 1 5  29 36 o 0 1496    111.5 ?      ?    3923.51 54.2971      2582.3   54.2971     1016.56   54.2971      
1 1 1 5  31 36 o 0 237.2   43.8  ?      ?    1767.65 -169.29      536.912  -169.29     142.159   10.7096      
1 1 1 5  33 36 o 0 -4.3    93.3  ?      ?    1132.85 1.38969      153.189  -178.61     562.864   -178.61      
1 1 1 5  35 36 o 0 53.3    142.6 ?      ?    997.791 -20.0513     24.0131  -20.0513    310.459   159.949      
1 1 1 0  36 6  o 0 -5.1    15.8  ?      ?    614.827 180          13.8803  180         327.205   -7.97494e-14 
1 1 1 2  36 6  o 0 193.9   13.6  ?      ?    1146.89 26.05        920.84   26.05       293.351   26.05        
1 1 1 6  8  36 o 0 489.4   21    ?      ?    2134.5  -124.065     1857.89  -124.065    752.17    -124.065     
1 1 1 6  10 36 o 0 1048    38.2  ?      ?    3673.85 91.0503      2738.45  91.0503     787.276   91.0503      
1 1 1 6  12 36 o 0 1958.6  65.9  ?      ?    5108.59 -93.6699     3751.06  -93.6699    1101.28   -93.6699     
1 1 1 6  14 36 o 0 279.2   19.6  ?      ?    3336.88 53.5455      527.509  53.5455     1172.64   -126.454     
1 1 1 6  16 36 o 0 364.6   24.8  ?      ?    2320.19 161.274      1273.49  161.274     116.809   161.274      
1 1 1 6  18 36 o 0 273.5   24.1  ?      ?    1530.92 -119.157     1035.06  -119.157    278.023   -119.157     
1 1 1 6  20 36 o 0 0.5     31.1  ?      ?    429.001 49.4234      142.468  -130.577    348.414   -130.577     
1 1 1 6  22 36 o 0 764.2   50.7  ?      ?    3103.93 -59.9464     1917.03  -59.9464    478.32    -59.9464     
1 1 1 6  24 36 o 0 2749.1  108.8 ?      ?    6542.63 169.968      3520.44  169.968     599.526   169.968      
1 1 1 6  26 36 o 0 384.4   58.2  ?      ?    2062.45 -51.6381     1086.72  -51.6381    191.083   -51.6381     
1 1 1 6  28 36 o 0 78.7    67.4  ?      ?    1628.44 -11.1917     113.672  168.808     789.427   168.808      
1 1 1 6  30 36 o 0 -118.7  106.4 ?      ?    812.193 58.1905      169.404  -121.809    488.068   -121.809     
1 1 1 6  32 36 o 0 257.5   134   ?      ?    2202.98 -86.583      395.42   -86.583     419.886   93.417       
1 1 1 6  34 36 o 0 -72.8   113.5 ?      ?    468.875 -120.246     66.6394  59.7544     227.82    59.7544      
1 1 1 1  36 7  o 0 139.7   13    ?      ?    1324.29 99.3757      580.835  99.3757     147.441   -80.6243     
1 1 1 3  36 7  o 0 457.1   20    ?      ?    1524    -125.739     2037.39  -125.739    1211.62   -125.739     
1 1 1 5  36 7  o 0 1109.9  38.1  ?      ?    3655.38 -25.1954     2897.33  -25.1954    949.825   -25.1954     
1 1 1 7  36 7  f 1 917.9   32.5  ?      ?    1786.5  116.133      3206.57  116.133     2267.39   116.133      
1 1 1 7  9  36 o 0 91.9    13.7  ?      ?    1065.01 -172.41      242.581  -172.41     323.272   7.59         
1 1 1 7  11 36 o 0 1145.7  43.6  ?      ?    3051.08 33.9426      3206.07  33.9426     1620.14   33.9426      
1 1 1 7  13 36 o 0 3055    103.7 ?      ?    6147.92 -78.8262     4781.82  -78.8262    1637.27   -78.8262     
1 1 1 7  15 36 o 0 1104.6  42.4  ?      ?    4771.96 2.52791      2217.37  2.52791     175.103   -177.472     
1 1 1 7  17 36 o 0 708.6   34.9  ?      ?    4484.66 135.208      1323.08  135.208     911.278   -44.7921     
1 1 1 7  19 36 o 0 1075.1  53.8  ?      ?    3955.53 171.323      2357.22  171.323     440.461   171.323      
1 1 1 7  21 36 o 0 910.1   49.1  ?      ?    3103.85 -86.7889     2295.51  -86.7889    838.359   -86.7889     
1 1 1 7  23 36 o 0 -85     40.6  ?      ?    1594.91 -147.383     612.798  32.617      1334.29   32.617       
1 1 1 7  25 36 f 1 91.6    50.3  ?      ?    2576.72 89.8369      293.368  -90.1631    1420.15   -90.1631     
1 1 1 7  27 36 o 0 938.2   77.8  ?      ?    4290.09 145.309      1591.8   145.309     219.16    -34.6907     
1 1 1 7  29 36 o 0 474.3   98.1  ?      ?    2922.61 -25.1654     992.761  -25.1654    160.494   154.835      
1 1 1 7  31 36 o 0 38.6    122   ?      ?    1237.74 151.457      59.6386  -28.5435    527.472   -28.5435     
1 1 1 7  33 36 f 1 52.4    167.9 ?      ?    3508.94 -85.2747     355.927  94.7253     1617.98   94.7253      
1 1 1 7  35 36 o 0 207.7   143.4 ?      ?    1517.24 -121.671     269.561  -121.671    233.493   58.3291      
1 1 1 0  36 8  o 0 -8.3    16    ?      ?    1172.65 -1.00057e-14 23.7709  0           623.348   180          
1 1 1 2  36 8  o 0 202.5   15.4  ?      ?    1779.95 70.7164      856.443  70.7164     112.434   -109.284     
1 1 1 4  36 8  o 0 264.7   16.4  ?      ?    2409.83 -136.798     918.397  -136.798    372.782   43.2016      
1 1 1 6  36 8  o 0 519.2   23.1  ?      ?    2692.32 -97.6068     1750.61  -97.6068    333.662   -97.6068     
1 1 1 8  36 8  o 0 14.4    14.2  ?      ?    1582.94 -1.91589     585.883  178.084     1402.35   178.084      
1 1 1 8  10 36 o 0 38.7    15.6  ?      ?    1475.8  -121.168     350.501  58.8321     1118.22   58.8321      
1 1 1 8  12 36 f 1 629.4   29.6  ?      ?    3811.72 9.20157      1527.22  9.20157     438.292   -170.798     
1 1 1 8  14 36 o 0 530.7   27.4  ?      ?    2632.08 -178.806     1732.08  -178.806    406.89    -178.806     
1 1 1 8  16 36 o 0 199.2   22.9  ?      ?    1606.45 87.2638      751.512  87.2638     39.6137   -92.7362     
1 1 1 8  18 36 o 0 51.5    28.6  ?      ?    1232.39 -36.696      203.003  143.304     804.847   143.304      
1 1 1 8  20 36 o 0 94.9    36.6  ?      ?    739.109 137.29       89.0339  137.29      261.296   -42.7102     
1 1 1 8  22 36 o 0 317.8   41.1  ?      ?    2100.44 10.4212      961.053  10.4212     0.0525111 -169.579     
1 1 1 8  24 36 o 0 1239.8  71.2  ?      ?    3192.82 68.952       2721.7   68.952      1314.72   68.952       
1 1 1 8  26 36 o 0 508.6   64    ?      ?    2182.33 87.1753      1396.88  87.1753     461.529   87.1753      
1 1 1 8  28 36 o 0 132.1   86.1  ?      ?    551.917 -127.107     84.7803  -127.107    136.771   52.8929      
1 1 1 8  30 36 o 0 154.9   112.9 ?      ?    607.57  -73.5196     142.715  -73.5196    92.5443   106.48       
1 1 1 8  32 36 o 0 854.4   150.3 ?      ?    4219.86 87.4192      1263.13  87.4192     278.177   -92.5808     
1 1 1 8  34 36 o 0 110     201   ?      ?    964.25  -128.753     183.52   -128.753    143.626   51.2466      
1 1 1 1  36 9  o 0 845.1   31.2  ?      ?    4415.34 -55.1973     1929.39  -55.1973    481.029   124.803      
1 1 1 3  36 9  o 0 170.6   15.5  ?      ?    1413.92 118.271      750.998  118.271     9.65379   -61.7286     
1 1 1 5  36 9  o 0 757.5   31.3  ?      ?    2754.96 -156.076     2437.98  -156.076    980.561   -156.076     
1 1 1 7  36 9  o 0 146.9   16.2  ?      ?    1516.9  14.7957      583.534  14.7957     231.915   -165.204     
1 1 1 9  36 9  o 0 399.4   22.9  ?      ?    3358.65 35.287       1016.96  35.287      733.33    -144.713     
1 1 1 9  11 36 o 0 1519.5  57.7  ?      ?    4456.49 -107.916     3258.97  -107.916    971.302   -107.916     
1 1 1 9  13 36 o 0 1049.9  42.2  ?      ?    4082.97 54.475       2438.19  54.475      376.744   54.475       
1 1 1 9  15 36 o 0 350     24.5  ?      ?    3487.65 96.6717      728.249  96.6717     997.044   -83.3283     
1 1 1 9  17 36 o 0 1314.9  57.7  ?      ?    3482.65 -87.5982     3076.6   -87.5982    1365.22   -87.5982     
1 1 1 9  19 36 o 0 1201.3  59.2  ?      ?    3490.69 8.83639      2774.13  8.83639     1106.32   8.83639      
1 1 1 9  21 36 o 0 567.2   47.5  ?      ?    4003.86 117.422      1051.09  117.422     798.963   -62.5782     
1 1 1 9  23 36 o 0 484.8   50.7  ?      ?    3427.73 -5.52921     1014.28  -5.52921    513.809   174.471      
1 1 1 9  25 36 o 0 861.7   72.1  ?      ?    2375.19 -85.1627     2184.33  -85.1627    1152.57   -85.1627     
1 1 1 9  27 36 o 0 -2.8    73.9  ?      ?    987.809 -70.2537     182.906  109.746     593.69    109.746      
1 1 1 9  29 36 o 0 445.5   106.2 ?      ?    1516.01 55.0778      1186.47  55.0778     589.29    55.0778      
1 1 1 9  31 36 o 0 186.1   141.1 ?      ?    2473.21 -61.5576     124.939  -61.5576    795.788   118.442      
1 1 1 9  33 36 o 0 256.1   194.4 ?      ?    1294.58 101.002      456.362  101.002     7.8338    101.002      
1 1 1 0  36 10 o 0 -26     20.1  ?      ?    139.465 180          2.42576  180         73.7973   -2.83673e-15 
1 1 1 2  36 10 o 0 230.1   17.2  ?      ?    1926.23 -151.338     945.548  -151.338    93.1801   28.6615      
1 1 1 4  36 10 o 0 385.7   21.1  ?      ?    2970.17 53.6083      1166.99  53.6083     409.857   -126.392     
1 1 1 6  36 10 o 0 -4.7    14.9  ?      ?    240.074 125.142      108.584  -54.8584    238.251   -54.8584     
1 1 1 8  36 10 o 0 5.8     16.3  ?      ?    519.887 -174.119     213.603  5.88089     486.152   5.88089      
1 1 1 10 36 10 o 0 443.1   23.7  ?      ?    2931.72 -87.4652     1345.39  -87.4652    156.971   92.5348      
1 1 1 10 12 36 o 0 389.7   24.5  ?      ?    1851.21 -105.718     1543.64  -105.718    607.644   -105.718     
1 1 1 10 14 36 o 0 329.2   23.9  ?      ?    2873.65 -64.9327     914.467  -64.9327    511.465   115.067      
1 1 1 10 16 36 o 0 1672    65.1  ?      ?    5761.83 -11.9117     2680.57  -11.9117    164.278   168.088      
1 1 1 10 18 36 f 1 3476.6  134.7 ?      ?    6209.22 -172.32      4803.99  -172.32     1801.27   -172.32      
1 1 1 10 20 36 o 0 475.2   43.4  ?      ?    2627.78 -10.2153     1368.26  -10.2153    142.269   -10.2153     
1 1 1 10 22 36 o 0 1015.4  65.4  ?      ?    4245.19 49.3372      1938.38  49.3372     27.0167   49.3372      
1 1 1 10 24 36 o 0 242.2   58.3  ?      ?    2141.75 -170.879     605.552  -170.879    322.845   9.12143      
1 1 1 10 26 36 o 0 1410.4  92.2  ?      ?    4738.08 -133.836     2220.46  -133.836    223.365   -133.836     
1 1 1 10 28 36 o 0 142     100.7 ?      ?    1178.24 162.013      166.956  162.013     298.076   -17.987      
1 1 1 10 30 36 o 0 568     125.1 ?      ?    2547.4  -59.0838     1243.78  -59.0838    279.028   -59.0838     
1 1 1 10 32 36 o 0 126.1   175.6 ?      ?    682.626 -117.767     161.407  -117.767    83.6553   62.2325      
1 1 1 10 34 36 f 1 516.7   234.8 ?      ?    1243.09 -13.9512     912.865  -13.9512    496.046   -13.9512     
1 1 1 1  36 11 o 0 264.9   18.4  ?      ?    2266.59 -157.022     985.672  -157.022    237.345   22.9776      
1 1 1 3  36 11 o 0 437.2   22.8  ?      ?    3544.19 -24.9673     1125.76  -24.9673    826.565   155.033      
1 1 1 5  36 11 o 0 89.9    16.8  ?      ?    1407.47 -8.32309     193.029  -8.32308    569.498   171.677      
1 1 1 7  36 11 o 0 396.4   22.1  ?      ?    1299.85 169.767      1738     169.767     1053.62   169.767      
1 1 1 9  36 11 o 0 3339    109.3 ?      ?    6239.47 -173.761     5139.65  -173.761    1924.13   -173.761     
1 1 1 11 36 11 o 0 595.7   29    ?      ?    3620.01 -45.6632     1497.97  -45.6632    322.988   134.337      
1 1 1 11 13 36 o 0 450.2   27.8  ?      ?    2683.33 112.516      1430.69  112.516     96.954    112.516      
1 1 1 11 15 36 o 0 1083    48.3  ?      ?    4288.78 147.335      2275.68  147.335     151.14    147.335      
1 1 1 11 17 36 o 0 605.6   38.3  ?      ?    2061.33 62.6557      1999.85  62.6557     1003.71   62.6557      
1 1 1 11 19 36 o 0 128.5   38.9  ?      ?    1550.71 -117.222     268.099  -117.222    460.177   62.7782      
1 1 1 11 21 36 f 1 2127.3  94.1  ?      ?    3652.4  -159.437     3999.45  -159.437    2331.93   -159.437     
1 1 1 11 23 36 o 0 767.5   66.2  ?      ?    5307.95 -42.8536     938.19   -42.8536    1385.82   137.146      
1 1 1 11 25 36 o 0 2478.7  115.2 ?      ?    6937.08 131.377      2793.08  131.377     165.45    -48.6225     
1 1 1 11 27 36 f 1 2632.7  139.4 ?      ?    4998.7  33.9162      3605.13  33.9162     1594.09   33.9162      
1 1 1 11 29 36 o 0 978.8   122.3 ?      ?    3305.88 -96.5192     1884.52  -96.5192    606.762   -96.5192     
1 1 1 11 31 36 o 0 471.1   150.7 ?      ?    3007.28 144.932      794.395  144.932     303.84    -35.0684     
1 1 1 11 33 36 o 0 312.9   204.7 ?      ?    2125.87 -39.8864     522.851  -39.8864    199.515   140.114      
1 1 1 0  36 12 f 1 163.4   22.6  ?      ?    675.12  180          521.522  180         142.604   -180         
1 1 1 2  36 12 o 0 -9.8    15.4  ?      ?    1488.77 126.549      711.471  -53.4506    1523.76   -53.4506     
1 1 1 4  36 12 o 0 98.1    17.6  ?      ?    1509.35 -109.1       174.317  -109.1      636.656   70.8998      
1 1 1 6  36 12 o 0 494.9   25.7  ?      ?    2143.38 116.446      1893.1   116.446     761.627   116.446      
1 1 1 8  36 12 f 1 449.2   24    ?      ?    873.268 -83.746      1808.05  -83.746     1353.68   -83.746      
1 1 1 10 36 12 o 0 914.1   37.3  ?      ?    3235.85 153.384      2518.1   153.384     881.599   153.384      
1 1 1 12 36 12 o 0 87.7    21.5  ?      ?    527.103 -65.1715     102.844  -65.1715    156.952   114.829      
1 1 1 12 14 36 o 0 869.6   39.9  ?      ?    5949.36 38.9997      1026.1   38.9997     1926.57   -141         
1 1 1 12 16 36 o 0 1102.6  52.4  ?      ?    2209.4  88.9458      3127.53  88.9458     2056.12   88.9458      
1 1 1 12 18 36 f 1 1142.2  54.2  ?      ?    4173.1  -64.8456     2325.8   -64.8456    344.825   -64.8456     
1 1 1 12 20 36 o 0 1497.8  77.1  ?      ?    5647.47 63.8603      2242.63  63.8603     338.547   -116.14      
1 1 1 12 22 36 o 0 1032    71.1  ?      ?    4009.25 -168.129     2028.04  -168.129    257.886   -168.129     
1 1 1 12 24 36 o 0 714.8   69.6  ?      ?    2132.4  -23.0888     1920.56  -23.0888    1001.94   -23.0888     
1 1 1 12 26 36 o 0 337.3   72.9  ?      ?    3195.14 5.24476      542.085  5.24476     777.439   -174.755     
1 1 1 12 28 36 o 0 1281.7  125.5 ?      ?    4164.48 -73.4078     2122.25  -73.4078    490.763   -73.4078     
1 1 1 12 30 36 o 0 212     131   ?      ?    2058.63 53.3503      277.559  53.3503     485.784   -126.65      
1 1 1 12 32 36 f 1 516.1   191.3 ?      ?    1996.12 119.277      1052.06  119.277     358.248   119.277      
1 1 1 1  36 13 o 0 1163.7  41.7  ?      ?    4196.76 129.014      2838.59  129.014     552.909   129.014      
1 1 1 3  36 13 o 0 401.1   23.3  ?      ?    4079.02 -61.7197     704.39   -61.7197    1486.38   118.28       
1 1 1 5  36 13 o 0 339.9   21.2  ?      ?    2050.11 51.1473      1350.19  51.1473     266.975   51.1473      
1 1 1 7  36 13 o 0 260.9   20.5  ?      ?    1319.73 -33.382      1136.97  -33.382     452.635   -33.382      
1 1 1 9  36 13 o 0 347.4   23.2  ?      ?    3562.61 78.8812      702.972  78.8812     1105.34   -101.119     
1 1 1 11 36 13 o 0 375.7   25.2  ?      ?    2121.83 -164.93      1376.75  -164.93     325.52    -164.93      
1 1 1 13 36 13 o 0 -18.9   22.4  ?      ?    1755.05 -14.5207     736.08   165.479     1597.07   165.479      
1 1 1 13 15 36 o 0 221     29.6  ?      ?    2703.24 -82.8235     446.386  -82.8235    867.15    97.1765      
1 1 1 13 17 36 o 0 429.7   36.8  ?      ?    2999.72 -142.957     1104.65  -142.957    316.408   37.0431      
1 1 1 13 19 36 o 0 461.9   39.3  ?      ?    2579.3  -78.9854     1297.78  -78.9854    112.8     -78.9854     
1 1 1 13 21 36 o 0 293.7   55.5  ?      ?    2946.98 58.8045      573.5    58.8045     736.497   -121.195     
1 1 1 13 23 36 o 0 531.4   66.4  ?      ?    3902.96 33.729       880.098  33.729      815.46    -146.271     
1 1 1 13 25 36 o 0 2405    124.6 ?      ?    7286.17 -110.214     2498.63  -110.214    540.832   69.786       
1 1 1 13 27 36 o 0 1594.6  118.7 ?      ?    5020.03 -175.809     2309.74  -175.809    319.865   -175.809     
1 1 1 13 29 36 f 1 308.5   124.9 ?      ?    455.743 -33.1436     322.421  -33.1436    150.178   -33.1436     
1 1 1 13 31 36 o 0 1485.8  169.1 ?      ?    2924.77 -20.3945     2587.2   -20.3945    1543.77   -20.3945     
1 1 1 13 33 36 o 0 -365.7  232.2 ?      ?    497.191 -120.313     37.6853  59.6875     202.668   59.6875      
1 1 1 0  36 14 o 0 -18.5   25.2  ?      ?    180.483 -180         4.45419  180         93.4688   1.02747e-13  
1 1 1 2  36 14 o 0 166.5   18.9  ?      ?    1554.1  112.768      636.195  112.768     196.585   -67.2324     
1 1 1 4  36 14 o 0 14      19.2  ?      ?    376.55  94.3106      137.031  -85.6894    335.816   -85.6894     
1 1 1 6  36 14 o 0 852.6   33.6  ?      ?    3068.47 -117.103     2506.55  -117.103    914.636   -117.103     
1 1 1 8  36 14 o 0 60.5    20.1  ?      ?    1205.74 -20.2186     91.0513  159.781     704.22    159.781      
1 1 1 10 36 14 o 0 22      22    ?      ?    2116.17 9.33431      682.972  -170.666    1734.95   -170.666     
1 1 1 12 36 14 o 0 132.6   22.9  ?      ?    2349.67 115.523      109.214  115.523     1049.3    -64.4766     
1 1 1 14 36 14 o 0 403.3   33.8  ?      ?    2822.55 -172.8       1099.56  -172.8      252.015   7.19962      
1 1 1 14 16 36 o 0 16      33.2  ?      ?    2998.34 162.413      971.451  -17.5867    2394.83   -17.5867     
1 1 1 14 18 36 o 0 1132.4  57.7  ?      ?    3322.56 -157.689     2598.73  -157.689    1066.7    -157.689     
1 1 1 14 20 36 o 0 192.7   49.8  ?      ?    1602.15 -128.991     513.39   -128.991    202.518   51.009       
1 1 1 14 22 36 o 0 553.2   62.3  ?      ?    1961.49 -55.3551     1600.49  -55.3551    742.554   -55.3551     
1 1 1 14 24 36 o 0 1394.9  92.2  ?      ?    4135.69 157.259      2425.06  157.259     685.294   157.259      
1 1 1 14 26 36 o 0 626.6   98.5  ?      ?    3331.14 103.482      1230.42  103.482     85.5967   -76.5184     
1 1 1 14 28 36 o 0 239     118.9 ?      ?    1790.56 81.0936      445.13   81.0936     239.149   -98.9064     
1 1 1 14 30 36 o 0 258.6   154.7 ?      ?    2256.29 155.496      391.315  155.496     424.433   -24.5039     
1 1 1 14 32 36 o 0 -315.1  205.1 ?      ?    998.617 -161.162     102.699  18.8383     439.087   18.8383      
1 1 1 1  36 15 o 0 1626.3  56.1  ?      ?    5087.77 8.92521      3274.59  8.92521     559.904   8.92521      
1 1 1 3  36 15 o 0 276.5   21    ?      ?    1086.77 60.4379      1210.4   60.4379     638.264   60.4379      
1 1 1 5  36 15 o 0 533.7   28    ?      ?    3192.87 -37.7775     1546.71  -37.7775    107.581   142.222      
1 1 1 7  36 15 o 0 686.1   31.1  ?      ?    2992.22 139.423      2055.01  139.423     533.17    139.423      
1 1 1 9  36 15 o 0 16.4    21.5  ?      ?    1533.8  -159.486     512.732  20.5138     1276.42   20.5138      
1 1 1 11 36 15 o 0 2448.3  82.1  ?      ?    5683.66 -37.9617     3908.55  -37.9617    1097.26   -37.9617     
1 1 1 13 36 15 o 0 862.4   40.6  ?      ?    3570.16 98.5024      2049.49  98.5023     331.449   98.5023      
1 1 1 15 36 15 o 0 576.3   40.2  ?      ?    2206.97 -40.6659     1805.38  -40.6659    775.879   -40.6659     
1 1 1 15 17 36 o 0 1361.1  63.2  ?      ?    3168.04 63.8379      3084.86  63.8379     1620.99   63.8379      
1 1 1 15 19 36 o 0 826.6   54.8  ?      ?    3062.32 133.313      2008.04  133.313     634.664   133.313      
1 1 1 15 21 36 f 1 209.5   53.6  ?      ?    2037.91 -104.958     492.622  -104.958    396.089   75.0418      
1 1 1 15 23 36 o 0 1353.6  89.3  ?      ?    4586.96 -142.179     2202.63  -142.179    259.964   -142.179     
1 1 1 15 25 36 o 0 3422.5  161.2 ?      ?    6844.89 37.768       3704.35  37.768      977.568   37.768       
1 1 1 15 27 36 o 0 355.8   123.7 ?      ?    2947.28 62.3286      566.085  62.3286     571.485   -117.671     
1 1 1 15 29 36 o 0 128.8   139.2 ?      ?    397.214 -41.9748     72.9416  -41.9748    72.337    138.025      
1 1 1 15 31 36 o 0 -168.2  190.9 ?      ?    918.062 6.15822      56.417   -173.842    369.778   -173.842     
1 1 1 0  36 16 o 0 -47.2   29.6  ?      ?    379.98  -180         7.28758  180         194.161   1.27828e-13  
1 1 1 2  36 16 o 0 308.7   24.2  ?      ?    1662.44 -58.6008     1319.48  -58.6008    448.408   -58.6008     
1 1 1 4  36 16 o 0 41.3    21.5  ?      ?    1680.12 -147.927     385.527  32.0733     1253.25   32.0733      
1 1 1 6  36 16 o 0 585.8   33.2  ?      ?    2311.09 106.08       2042.24  106.08      868.818   106.08       
1 1 1 8  36 16 o 0 76.8    23.6  ?      ?    2200.34 -27.223      186.797  152.777     1282.13   152.777      
1 1 1 10 36 16 o 0 315.3   29.7  ?      ?    2503.91 -131.307     937.372  -131.307    302.805   48.6928      
1 1 1 12 36 16 o 0 7       29.9  ?      ?    1173.08 -73.4473     385.761  106.553     952.001   106.553      
1 1 1 14 36 16 o 0 564     40.9  ?      ?    2742.83 20.7085      1589.6   20.7085     303.827   20.7085      
1 1 1 16 36 16 o 0 696.5   47.3  ?      ?    2454.15 -146.034     1945.94  -146.034    834.651   -146.034     
1 1 1 16 18 36 o 0 1979.3  93.7  ?      ?    5059.61 2.85344      3180.26  2.85344     906.408   2.85344      
1 1 1 16 20 36 o 0 110.3   55.7  ?      ?    1306.74 43.514       85.448   43.514      483.248   -136.486     
1 1 1 16 22 36 o 0 138.4   65.1  ?      ?    1945.09 121.08       95.5412  121.08      732.47    -58.9199     
1 1 1 16 24 36 o 0 570     82.7  ?      ?    3938.81 -133.111     899.035  -133.111    712.509   46.8886      
1 1 1 16 26 36 o 0 -15.9   115   ?      ?    1577.7  -66.175      192.608  113.825     806.578   113.825      
1 1 1 16 28 36 o 0 24.8    133.3 ?      ?    1422.21 -18.6006     67.8654  161.399     593.147   161.399      
1 1 1 16 30 36 o 0 550.3   186.3 ?      ?    2367.73 100.158      1083.26  100.158     265.83    100.158      
1 1 1 16 32 36 o 0 922.6   231.3 ?      ?    2983.95 -125.658     1466.19  -125.658    490.906   -125.658     
1 1 1 1  36 17 o 0 943.7   41.7  ?      ?    5021.59 153.432      1805.47  153.432     807.729   -26.5684     
1 1 1 3  36 17 o 0 392.5   29    ?      ?    2490.69 -118.189     1350.56  -118.189    70.8385   -118.189     
1 1 1 5  36 17 o 0 313.5   28.3  ?      ?    1820.49 -28.3388     1254.22  -28.3388    333.219   -28.3388     
1 1 1 7  36 17 o 0 432     31.8  ?      ?    3212.84 -53.6592     1095.85  -53.6592    528.534   126.341      
1 1 1 9  36 17 o 0 494.4   33.9  ?      ?    2787.3  -117.365     1451.07  -117.365    71.2019   -117.365     
1 1 1 11 36 17 o 0 292.1   31    ?      ?    1481.27 84.487       1092.57  84.487      376.729   84.487       
1 1 1 13 36 17 o 0 185.5   35.1  ?      ?    2080.96 173.418      468.18   173.418     510.222   -6.58194     
1 1 1 15 36 17 o 0 792     50.4  ?      ?    5018.76 74.3218      1161.91  74.3218     1121.94   -105.678     
1 1 1 17 36 17 f 1 2029.5  91.5  ?      ?    4150.43 -76.9704     3539.94  -76.9704    1706.34   -76.9704     
1 1 1 17 19 36 o 0 498.4   60    ?      ?    2144.51 -107.367     1457.41  -107.367    522.255   -107.367     
1 1 1 17 21 36 f 1 43.3    62.3  ?      ?    1274.25 9.75475      187.271  -170.245    734.679   -170.245     
1 1 1 17 23 36 f 1 464.8   61.2  ?      ?    3745.92 88.2565      712.669  88.2565     836.324   -91.7435     
1 1 1 17 25 36 o 0 973.9   82.9  ?      ?    3245.71 -111.877     1945.47  -111.877    674.133   -111.877     
1 1 1 17 27 36 o 0 -162.3  117.2 ?      ?    1076.04 145.425      225.393  -34.575     626.035   -34.575      
1 1 1 17 29 36 o 0 91      179   ?      ?    1223.18 97.7181      164.982  97.7181     268.488   -82.2819     
1 1 1 17 31 36 o 0 264.1   218.9 ?      ?    3503.28 37.18        88.9914  37.18       1068.92   -142.82      
1 1 1 0  36 18 o 0 9.2     34.1  ?      ?    1784.37 180          98.4879  180         821.665   -1.16274e-14 
1 1 1 2  36 18 o 0 718.6   37.7  ?      ?    3143.96 62.4994      2082.35  62.4994     478.674   62.4994      
1 1 1 4  36 18 o 0 1971.8  74.4  ?      ?    7094.59 -165.139     2621.48  -165.139    1011.1    14.8607      
1 1 1 6  36 18 o 0 445.6   32.9  ?      ?    2887.86 -24.1538     1275.3   -24.1538    178.993   155.846      
1 1 1 8  36 18 o 0 -6.8    29    ?      ?    1457.47 105.497      544.553  -74.5033    1264.38   -74.5033     
1 1 1 10 36 18 f 1 1760.5  68.5  ?      ?    3642.35 -12.1059     3715.38  -12.1059    1946.5    -12.1059     
1 1 1 12 36 18 f 1 1056.4  54.5  ?      ?    4704.46 -133.989     1913.9   -133.989    312.804   46.0109      
1 1 1 14 36 18 o 0 202.4   38.9  ?      ?    656.66  -101.191     432.352  -101.191    132.649   -101.191     
1 1 1 16 36 18 o 0 253     44.7  ?      ?    1813.39 23.2157      741.821  23.2157     58.8218   -156.784     
1 1 1 18 36 18 o 0 301.6   51.1  ?      ?    3549.46 97.1823      362.475  97.1823     1147.06   -82.8177     
1 1 1 18 20 36 o 0 1116.6  76    ?      ?    4294.23 161.009      1944.39  161.009     106.597   161.009      
1 1 1 18 22 36 o 0 147.6   74.9  ?      ?    2556.24 133.574      17.7716  -46.4257    1072.38   -46.4257     
1 1 1 18 24 36 o 0 241     74.9  ?      ?    2230.08 -56.4105     471.44   -56.4105    406.294   123.59       
1 1 1 18 26 36 o 0 768     101   ?      ?    2119.14 42.4808      1777.29  42.4808     983.273   42.4808      
1 1 1 18 28 36 o 0 695.6   115.4 ?      ?    1603.92 -64.4844     1623.2   -64.4844    1050.33   -64.4844     
1 1 1 18 30 36 o 0 664.7   140.3 ?      ?    3971.84 -35.3126     934.465  -35.3126    390.694   144.687      
1 1 1 1  36 19 o 0 2654.8  88.3  ?      ?    6134.85 -12.4877     4132.87  -12.4877    978.198   -12.4877     
1 1 1 3  36 19 o 0 920.7   43.6  ?      ?    3485.55 93.2487      2340.45  93.2487     569.412   93.2487      
1 1 1 5  36 19 o 0 334.1   32.8  ?      ?    2610.61 43.4445      979.339  43.4445     327.533   -136.556     
1 1 1 7  36 19 o 0 200.4   35.3  ?      ?    2812.54 79.9211      307.922  79.9211     1075.2    -100.079     
1 1 1 9  36 19 o 0 2532.6  93.3  ?      ?    5171.24 -120.522     4154.22  -120.522    1663.48   -120.522     
1 1 1 11 36 19 o 0 394.4   37.1  ?      ?    1719.21 53.8599      1401.87  53.8599     593.42    53.8599      
1 1 1 13 36 19 o 0 709.3   49.9  ?      ?    2289.24 -101.85      2046.58  -101.85     1000.74   -101.85      
1 1 1 15 36 19 o 0 910.8   60.1  ?      ?    3465.9  99.2815      2006.94  99.2815     472.124   99.2815      
1 1 1 17 36 19 o 0 1878.9  93.8  ?      ?    4674.52 8.83822      3041.41  8.83822     1043.11   8.83822      
1 1 1 19 36 19 o 0 32.3    55.5  ?      ?    818.245 -167.211     140.565  12.7891     481.392   12.7891      
1 1 1 19 21 36 o 0 -82.1   69.6  ?      ?    2813.59 -31.3509     838.765  148.649     2001.45   148.649      
1 1 1 19 23 36 o 0 298.9   70.9  ?      ?    1136.41 -179.507     725.499  -179.507    282.784   -179.507     
1 1 1 19 25 36 o 0 532.6   95.2  ?      ?    2441.54 134.735      1220.68  134.735     296.989   134.735      
1 1 1 19 27 36 o 0 394.2   119.8 ?      ?    1988.25 -56.9439     888.36   -56.9439    173.882   -56.9439     
1 1 1 19 29 36 f 1 868.1   158   ?      ?    2880.55 153.441      1590.57  153.441     616.716   153.441      
1 1 1 0  36 20 o 0 -33.6   41.8  ?      ?    889.465 -1.62039e-14 29.1029  0           422.879   180          
1 1 1 2  36 20 o 0 222.6   31.7  ?      ?    1440.19 -117.12      822.87   -117.12     98.2919   -117.12      
1 1 1 4  36 20 o 0 1106.2  50.3  ?      ?    3815.95 28.4698      2545.38  28.4698     650.416   28.4698      
1 1 1 6  36 20 o 0 683.1   44.7  ?      ?    3830.98 -29.3203     1523.42  -29.3203    348.726   150.68       
1 1 1 8  36 20 o 0 813.8   48.1  ?      ?    3646.18 -153.931     1895.51  -153.931    147.335   -153.931     
1 1 1 10 36 20 o 0 396.9   38    ?      ?    2763.34 -157.338     1077.91  -157.338    217.872   22.6616      
1 1 1 12 36 20 o 0 589.9   49.7  ?      ?    2309    119.751      1735.59  119.751     681.77    119.751      
1 1 1 14 36 20 o 0 1173.3  64    ?      ?    4642.69 3.26445      2043.88  3.26445     14.0346   -176.736     
1 1 1 16 36 20 o 0 88.4    49.5  ?      ?    1191.12 73.8118      10.1665  -106.188    520.919   -106.188     
1 1 1 18 36 20 o 0 560.3   68.4  ?      ?    3064.47 -100.854     1221.23  -100.854    62.0729   79.1457      
1 1 1 20 36 20 o 0 451.2   74.4  ?      ?    2490.07 153.085      1071.2   153.085     71.4638   153.085      
1 1 1 20 22 36 o 0 874.1   91.5  ?      ?    3648.21 -35.4022     1620.35  -35.4022    197.132   -35.4022     
1 1 1 20 24 36 o 0 378.3   84.2  ?      ?    2051.72 102.007      918.88   102.007     140.45    102.007      
1 1 1 20 26 36 o 0 6.2     108.6 ?      ?    1974.81 179.157      246.585  -0.843294   959.301   -0.843294    
1 1 1 20 28 36 f 1 107.4   152.8 ?      ?    2553.47 -7.55231     42.5402  172.448     910.841   172.448      
1 1 1 1  36 21 o 0 265.3   36.6  ?      ?    1990.39 -132.149     903.25   -132.149    85.9735   47.8508      
1 1 1 3  36 21 o 0 833.5   45.1  ?      ?    2673.88 52.3583      2400.63  52.3583     1086.33   52.3583      
1 1 1 5  36 21 o 0 1054.9  53.1  ?      ?    3285.69 -147.821     2606.53  -147.821    1014.26   -147.821     
1 1 1 7  36 21 o 0 174.7   37    ?      ?    2030.83 -40.2495     432.164  -40.2495    535.135   139.751      
1 1 1 9  36 21 o 0 341.5   43.3  ?      ?    2478.25 -6.70259     950.967  -6.70259    203.833   173.297      
1 1 1 11 36 21 f 1 34.3    41.1  ?      ?    3282.66 122.642      922.206  -57.3579    2424.38   -57.3579     
1 1 1 13 36 21 o 0 712.9   56    ?      ?    3127.44 135.038      1703.25  135.038     318.444   135.038      
1 1 1 15 36 21 f 1 724.1   57.3  ?      ?    3653.09 -72.3869     1471.56  -72.3868    105.303   107.613      
1 1 1 17 36 21 f 1 1006.9  77.1  ?      ?    3390.81 -144.397     2042.39  -144.397    609.828   -144.397     
1 1 1 19 36 21 o 0 146.6   66    ?      ?    2091.82 28.3366      96.8373  28.3366     747.703   -151.663     
1 1 1 21 36 21 o 0 -1.5    75.4  ?      ?    895.822 61.4504      154.929  -118.55     493.967   -118.55      
1 1 1 21 23 36 o 0 822.5   112.1 ?      ?    2812.04 126.997      1726.64  126.997     658.588   126.997      
1 1 1 21 25 36 f 1 370     109.4 ?      ?    2191.61 -77.8369     792.961  -77.8369    4.48855   102.163      
1 1 1 21 27 36 f 1 2133    182.6 ?      ?    5386.81 128.113      2509.62  128.113     670.504   128.113      
1 1 1 21 29 36 o 0 418.8   189.6 ?      ?    3678.3  -76.013      312.939  -76.013     873.867   103.987      
1 1 1 0  36 22 o 0 11.6    43.8  ?      ?    666.163 180          41.4813  180         284.771   -2.51445e-14 
1 1 1 2  36 22 o 0 254.2   36.7  ?      ?    3197.03 -18.3992     395.933  -18.3992    1155.91   161.601      
1 1 1 4  36 22 o 0 342.5   39.4  ?      ?    2675.42 125.995      943.815  125.995     339.087   -54.0046     
1 1 1 6  36 22 o 0 4296.8  150.2 ?      ?    8002.81 -137.217     4773.24  -137.217    1000.05   -137.217     
1 1 1 8  36 22 o 0 802.4   52.7  ?      ?    3600.08 -10.9839     1804.7   -10.9839    138.591   -10.9839     
1 1 1 10 36 22 o 0 276.4   44.3  ?      ?    1800.9  59.6239      857.994  59.6239     42.5887   59.6239      
1 1 1 12 36 22 o 0 761.2   57.8  ?      ?    3178.62 44.7169      1789.96  44.7169     386.818   44.7169      
1 1 1 14 36 22 o 0 214.7   53.8  ?      ?    1996.75 179.599      487.254  179.599     380.79    -0.401354    
1 1 1 16 36 22 o 0 140.5   59.6  ?      ?    1149.91 137.595      190.827  137.595     292.787   -42.4046     
1 1 1 18 36 22 o 0 799.6   80.1  ?      ?    2327.22 15.9338      1923.88  15.9338     981.113   15.9338      
1 1 1 20 36 22 o 0 265.5   82.4  ?      ?    1244.87 177.898      611.682  177.898     137.776   177.898      
1 1 1 22 36 22 o 0 -115.2  94.1  ?      ?    1268.74 -21.1695     283.897  158.831     750.856   158.831      
1 1 1 22 24 36 o 0 1080    118.6 ?      ?    3734.93 90.4091      1803.82  90.4091     451.446   90.4091      
1 1 1 22 26 36 o 0 574.8   144.2 ?      ?    1540.16 -3.78714     1297.43  -3.78714    773.413   -3.78714     
1 1 1 22 28 36 o 0 1098.1  185.6 ?      ?    3526.57 63.2498      1667.8   63.2498     525.786   63.2498      
1 1 1 1  36 23 o 0 288.8   41.7  ?      ?    2570.14 169.206      740.87   169.206     486.272   -10.7937     
1 1 1 3  36 23 o 0 374.5   42    ?      ?    2318.07 -60.8553     1134.74  -60.8553    39.0366   -60.8553     
1 1 1 5  36 23 f 1 1049.8  55.8  ?      ?    3739.32 44.789       2285.75  44.789      531.924   44.789       
1 1 1 7  36 23 o 0 793.7   54.5  ?      ?    3940.73 157.863      1628.77  157.863     178.754   -22.1369     
1 1 1 9  36 23 o 0 413     50.1  ?      ?    1859.21 -65.4345     1320.37  -65.4345    484.476   -65.4345     
1 1 1 11 36 23 o 0 799     60.7  ?      ?    4185.59 -62.6444     1471.42  -62.6444    366.804   117.356      
1 1 1 13 36 23 o 0 277.6   53.7  ?      ?    1512.47 39.8607      803.379  39.8607     147.913   39.8607      
1 1 1 15 36 23 o 0 -51.1   63.2  ?      ?    1188.65 -28.3347     329.022  151.665     828.423   151.665      
1 1 1 17 36 23 f 1 1636.1  100.3 ?      ?    3214.84 -149.033     3005.81  -149.033    1694.5    -149.033     
1 1 1 19 36 23 o 0 675.4   91.3  ?      ?    2136.38 -97.9175     1633.16  -97.9175    816.926   -97.9175     
1 1 1 21 36 23 o 0 1646.5  126   ?      ?    5642.13 29.371       2002.75  29.371      86.6724   -150.629     
1 1 1 23 36 23 o 0 308.3   120.8 ?      ?    2565.34 -159.78      465.495  -159.78     433.874   20.2202      
1 1 1 23 25 36 f 1 477.6   144.6 ?      ?    3925.94 60.3976      569.213  60.3976     774.553   -119.602     
1 1 1 23 27 36 o 0 1537.6  183.8 ?      ?    4552    -74.6268     1975.91  -74.6268    499.182   -74.6268     
1 1 1 0  36 24 o 0 -31.3   57.4  ?      ?    1498.45 -3.68816e-15 62.2191  0           640.767   180          
1 1 1 2  36 24 o 0 207.9   46.3  ?      ?    1164.03 -174.3       610.246  -174.3      68.3814   -174.3       
1 1 1 4  36 24 o 0 336     43.5  ?      ?    2801.67 28.8543      807.323  28.8543     482.273   -151.146     
1 1 1 6  36 24 o 0 1715.2  79.4  ?      ?    4617.04 2.72493      3011.64  2.72493     917.335   2.72493      
1 1 1 8  36 24 o 0 217.4   50.8  ?      ?    1249.42 -143.223     631.472  -143.223    74.8593   -143.223     
1 1 1 10 36 24 o 0 1472.5  85.9  ?      ?    4667.44 -119.338     2496.76  -119.338    461.625   -119.338     
1 1 1 12 36 24 o 0 275.4   61.5  ?      ?    2877.83 170.333      469.171  170.333     771.542   -9.66663     
1 1 1 14 36 24 o 0 -68.8   63    ?      ?    1507.97 -72.7494     443.199  107.251     1074.79   107.251      
1 1 1 16 36 24 o 0 823.1   76.3  ?      ?    2353.91 141.638      1965.2   141.638     1011.33   141.638      
1 1 1 18 36 24 o 0 72.7    83.2  ?      ?    435.697 34.3836      5.95305  -145.616    174.895   -145.616     
1 1 1 20 36 24 o 0 475.3   103.1 ?      ?    1522.12 173.832      1198.51  173.832     632.635   173.832      
1 1 1 22 36 24 o 0 877.1   131.1 ?      ?    2132.91 -61.3327     1845.07  -61.3327    1092.41   -61.3327     
1 1 1 24 36 24 o 0 235.1   128.1 ?      ?    1724    -6.64962     377.859  -6.64962    190.01    173.35       
1 1 1 24 26 36 o 0 78.1    182.3 ?      ?    1056.13 75.8677      108.607  75.8677     233.99    -104.132     
1 1 1 1  36 25 o 0 1711.9  77.5  ?      ?    3839.46 24.7537      3357.4   24.7537     1601.67   24.7537      
1 1 1 3  36 25 o 0 837.8   59.5  ?      ?    3166.14 -85.6772     2014.34  -85.6772    579.467   -85.6772     
1 1 1 5  36 25 o 0 76.2    49.3  ?      ?    1491.23 170.135      113.316  -9.86519    780.732   -9.86519     
1 1 1 7  36 25 f 1 1489.7  77.7  ?      ?    5380.34 -98.8645     2245.15  -98.8645    138.101   81.1355      
1 1 1 9  36 25 o 0 528.3   60.5  ?      ?    1833.77 136.913      1564.06  136.913     760.913   136.913      
1 1 1 11 36 25 o 0 361.2   70.7  ?      ?    1552.89 73.2504      1070.85  73.2504     406.233   73.2504      
1 1 1 13 36 25 o 0 289.1   68.8  ?      ?    2665.41 168.754      562.371  168.754     548.17    -11.246      
1 1 1 15 36 25 o 0 25.1    71.1  ?      ?    1562.26 -51.5825     265.327  128.418     883.941   128.418      
1 1 1 17 36 25 o 0 -83     88.4  ?      ?    2055.7  34.8902      491.05   -145.11     1287.53   -145.11      
1 1 1 19 36 25 o 0 414.9   103.4 ?      ?    2801.47 -45.6779     807.423  -45.6779    235.781   134.322      
1 1 1 21 36 25 f 1 592.9   121.7 ?      ?    2954.72 136.003      1115.32  136.003     62.3738   136.003      
1 1 1 23 36 25 f 1 175.5   150.9 ?      ?    2839.49 -39.5062     50.5384  -39.5062    896.555   140.494      
1 1 1 25 36 25 o 0 1458.6  184.2 ?      ?    4961.15 -18.3038     1706.14  -18.3038    148.793   -18.3038     
1 1 1 0  36 26 o 0 -73     91.4  ?      ?    1531.83 180          82.7945  180         603.483   -3.47673e-14 
1 1 1 2  36 26 o 0 40.7    55.5  ?      ?    842.579 -71.9608     138.949  108.039     519.177   108.039      
1 1 1 4  36 26 o 0 411.8   55.3  ?      ?    1311.65 -120.63      1290.49  -120.63     704.616   -120.63      
1 1 1 6  36 26 o 0 1081.1  67.2  ?      ?    2908.71 145.469      2470.89  145.469     1189.48   145.469      
1 1 1 8  36 26 o 0 200.2   54.8  ?      ?    1244.73 -45.976      489.744  -45.976     49.1625   134.024      
1 1 1 10 36 26 o 0 544.4   69.3  ?      ?    3200.07 123.199      1148.08  123.199     208.6     -56.8009     
1 1 1 12 36 26 o 0 563.3   75    ?      ?    3456.38 -32.2946     1072.88  -32.2946    356.633   147.705      
1 1 1 14 36 26 o 0 2242.1  120.1 ?      ?    6136.8  131.956      2707.06  131.956     289.675   131.956      
1 1 1 16 36 26 o 0 627.6   89.9  ?      ?    4931.69 -88.6591     659.202  -88.6591    1245.94   91.3409      
1 1 1 18 36 26 o 0 166.5   96.8  ?      ?    1222.08 146.659      199.963  146.659     252.544   -33.3407     
1 1 1 20 36 26 o 0 321.6   122.7 ?      ?    2205.41 -3.77359     591.216  -3.77359    191.787   176.226      
1 1 1 22 36 26 o 0 94.4    141.7 ?      ?    2416.28 -44.7291     50.7176  135.271     855.774   135.271      
1 1 1 24 36 26 o 0 969.6   179   ?      ?    3172.99 163.483      1556.57  163.483     553.236   163.483      
1 1 1 1  36 27 o 0 114.6   62    ?      ?    990.19  -77.4423     88.712   -77.4423    348.979   102.558      
1 1 1 3  36 27 o 0 712.7   68.6  ?      ?    2657.13 86.8303      1791.06  86.8303     625.701   86.8303      
1 1 1 5  36 27 o 0 422.3   61.4  ?      ?    2752.35 -104.435     997.449  -104.435    195.82    75.5651      
1 1 1 7  36 27 o 0 397.5   67.5  ?      ?    2690.31 75.0848      924.779  75.0848     224.002   -104.915     
1 1 1 9  36 27 o 0 86.6    66.3  ?      ?    887.124 -68.1107     1.93002  111.889     373.658   111.889      
1 1 1 11 36 27 f 1 1835.5  111.3 ?      ?    4831.45 -173.259     2730.37  -173.259    779.447   -173.259     
1 1 1 13 36 27 o 0 2338.5  127.2 ?      ?    6244.5  1.97755      2794.12  1.97755     319.57    1.97755      
1 1 1 15 36 27 o 0 215.8   91.9  ?      ?    2366.76 32.5864      280.016  32.5864     629.585   -147.414     
1 1 1 17 36 27 o 0 1322.4  119.1 ?      ?    4666.03 142.492      1895.44  142.492     172.562   142.492      
1 1 1 19 36 27 o 0 278.2   120.9 ?      ?    1230.53 159.165      523.23   159.165     86.5027   159.165      
1 1 1 21 36 27 f 1 1809.5  166.7 ?      ?    5952.76 -106.138     1943.39  -106.138    55.5823   73.8622      
1 1 1 23 36 27 o 0 1768.8  203.1 ?      ?    5759.46 31.8484      1829.6   31.8484     0.584817  -148.152     
1 1 1 0  36 28 o 0 48.3    114.5 ?      ?    1729.95 -1.25608e-14 204.319  0           542.654   180          
1 1 1 2  36 28 o 0 220.7   69.1  ?      ?    1109.75 -108.053     542.443  -108.053    65.7849   -108.053     
1 1 1 4  36 28 o 0 306.3   66.7  ?      ?    2033.94 72.5614      809.077  72.5614     56.5863   -107.439     
1 1 1 6  36 28 o 0 521.9   69.1  ?      ?    1086.74 -170.08      1471.75  -170.08     1015.16   -170.08      
1 1 1 8  36 28 o 0 196.7   77    ?      ?    874.891 -153.31      314.646  -153.31     39.6968   26.6902      
1 1 1 10 36 28 o 0 -112.9  79.3  ?      ?    554.284 -139.244     148.629  40.7565     368.581   40.7565      
1 1 1 12 36 28 o 0 548.4   94.2  ?      ?    1545.89 -74.8211     1459.2   -74.8212    852.453   -74.8212     
1 1 1 14 36 28 o 0 167.5   86.3  ?      ?    3022.25 -36.955      72.2333  143.045     1225.24   143.045      
1 1 1 16 36 28 o 0 461     111.1 ?      ?    3556.89 73.6283      676.945  73.6283     629.796   -106.372     
1 1 1 18 36 28 o 0 128.7   123.3 ?      ?    1745.59 -13.1671     100.285  -13.1671    517.621   166.833      
1 1 1 20 36 28 f 1 372.4   156.7 ?      ?    2997.85 141.97       494.376  141.97      512.226   -38.0305     
1 1 1 22 36 28 o 0 109.7   186.4 ?      ?    1341.34 -169.226     136.871  -169.226    290.456   10.7743      
1 1 1 1  36 29 o 0 264.3   77.6  ?      ?    1194.59 65.3723      647.738  65.3723     156.538   65.3723      
1 1 1 3  36 29 o 0 108.1   79.9  ?      ?    856.77  -62.6447     47.3242  -62.6447    302.646   117.355      
1 1 1 5  36 29 o 0 89      73.2  ?      ?    306.041 106.748      3.77756  106.748     119.926   -73.2522     
1 1 1 7  36 29 o 0 516.5   75.6  ?      ?    3528.87 165.941      927.453  165.941     478.617   -14.059      
1 1 1 9  36 29 o 0 -20.4   86.5  ?      ?    118.761 -16.9217     20.0964  163.078     67.1889   163.078      
1 1 1 11 36 29 o 0 33.8    84.5  ?      ?    455.422 -179.384     43.312   0.615564    219.956   0.615564     
1 1 1 13 36 29 f 1 310.4   109.1 ?      ?    2835.22 -32.6931     433.701  -32.6931    638.235   147.307      
1 1 1 15 36 29 o 0 20.8    103.2 ?      ?    1008.02 111.388      88.224   -68.6116    455.867   -68.6116     
1 1 1 17 36 29 o 0 432.7   138   ?      ?    2383.55 -115.629     865.112  -115.629    25.4864   -115.629     
1 1 1 19 36 29 f 1 456.4   149.6 ?      ?    1687.69 38.4208      951.407  38.4208     386.073   38.4208      
1 1 1 21 36 29 o 0 1732.5  208   ?      ?    4759.41 -174.769     2062.32  -174.769    545.723   -174.769     
1 1 1 0  36 30 f 1 315.7   157.5 ?      ?    716.342 180          352.627  180         60.2499   -180         
1 1 1 2  36 30 o 0 206.8   85.3  ?      ?    1819.77 46.2389      376.284  46.2389     359.389   -133.761     
1 1 1 4  36 30 o 0 68.8    80.7  ?      ?    787.428 -49.0952     32.0269  130.905     347.824   130.905      
1 1 1 6  36 30 o 0 64      82.5  ?      ?    2209.6  145.104      260.306  -34.8965    1135.95   -34.8965     
1 1 1 8  36 30 o 0 1133    107.6 ?      ?    4473.66 6.30796      1775.49  6.30796     30.5046   6.30796      
1 1 1 10 36 30 o 0 374.4   102   ?      ?    3134.31 153.76       608.094  153.76      584.445   -26.2396     
1 1 1 12 36 30 o 0 44.1    106.1 ?      ?    962.857 -39.9063     50.0906  140.094     407.809   140.094      
1 1 1 14 36 30 o 0 362.2   116.3 ?      ?    1910    155.681      789.514  155.681     99.5151   155.681      
1 1 1 16 36 30 o 0 13.7    123   ?      ?    669.346 152.811      26.2021  -27.1889    256.468   -27.1889     
1 1 1 18 36 30 o 0 1094.8  170.4 ?      ?    3253.77 -105.582     1821.18  -105.582    742.44    -105.582     
1 1 1 1  36 31 o 0 193.8   111.5 ?      ?    2715.35 -6.05943     107.242  -6.05943    961.777   173.941      
1 1 1 3  36 31 o 0 262.4   94    ?      ?    1418.73 160.503      583.919  160.503     28.3484   160.503      
1 1 1 5  36 31 o 0 157.9   93.3  ?      ?    1258.87 137.971      200.806  137.971     287.542   -42.029      
1 1 1 7  36 31 o 0 123.1   97.8  ?      ?    1522.49 -92.8391     50.387   -92.8391    529.403   87.1609      
1 1 1 9  36 31 o 0 996.2   114.4 ?      ?    3126.9  -1.46281     1915.27  -1.46281    745.066   -1.46281     
1 1 1 11 36 31 o 0 419.3   120.1 ?      ?    2647.71 -150.588     830.902  -150.588    138.901   29.4117      
1 1 1 13 36 31 o 0 676.9   137.7 ?      ?    2846.81 14.4091      1339.11  14.4091     322.797   14.4091      
1 1 1 15 36 31 o 0 596.8   133.9 ?      ?    2479.2  166.961      1223.03  166.961     378.17    166.961      
1 1 1 17 36 31 o 0 669.1   157.9 ?      ?    3009.84 31.3433      1168     31.3433     177.088   31.3433      
1 1 1 0  36 32 o 0 284.1   186.1 ?      ?    2805    -1.46566e-14 626.279  0           440.649   180          
1 1 1 2  36 32 o 0 337.5   112.3 ?      ?    1816.67 120.984      745.297  120.984     56.0658   120.984      
1 1 1 4  36 32 o 0 165.1   108.5 ?      ?    911.803 1.7211       181.723  1.7211      161.87    -178.279     
1 1 1 6  36 32 o 0 -17.1   110.3 ?      ?    1382.65 23.8314      177.489  -156.169    692.861   -156.169     
1 1 1 8  36 32 o 0 507.1   122.5 ?      ?    3092.53 -144.252     930.937  -144.252    204.632   35.7479      
1 1 1 10 36 32 o 0 36.5    131.1 ?      ?    1938.19 38.8936      104.968  -141.106    803.21    -141.106     
1 1 1 12 36 32 f 1 2090.4  177.1 ?      ?    5084.82 -146.742     2614.11  -146.742    843.788   -146.742     
1 1 1 14 36 32 o 0 862.7   171.9 ?      ?    3963.4  -1.72984     1277.3   -1.72984    57.5256   178.27       
1 1 1 16 36 32 o 0 765.6   167.6 ?      ?    3807.97 -162.061     1076.71  -162.061    165.339   17.9388      
1 1 1 1  36 33 o 0 660.5   150.4 ?      ?    2404.4  -10.951      1435.92  -10.951     550.163   -10.951      
1 1 1 3  36 33 o 0 360.5   129   ?      ?    1230.57 -38.3246     780.622  -38.3246    329.117   -38.3246     
1 1 1 5  36 33 o 0 218.8   116.7 ?      ?    920.228 159.757      328.725  159.757     6.13197   -20.2431     
1 1 1 7  36 33 f 1 374.1   129.1 ?      ?    1384.73 0.530393     835.827  0.530393    335.368   0.530393     
1 1 1 9  36 33 o 0 829.6   145.8 ?      ?    3664.06 -136.783     1375.77  -136.783    101.886   -136.783     
1 1 1 11 36 33 o 0 622.9   159.4 ?      ?    4476.79 44.5853      700.318  44.5853     824.049   -135.415     
1 1 1 13 36 33 o 0 -98.3   160.8 ?      ?    1562.28 50.8333      148.43   -129.167    667.194   -129.167     
1 1 1 0  36 34 o 0 660     237   ?      ?    3824.26 1.42931e-14  1156.55  0           185.073   -180         
1 1 1 2  36 34 o 0 456.8   141.5 ?      ?    2868.34 175.873      844.755  175.873     160.346   -4.12687     
1 1 1 4  36 34 f 1 209.6   144.9 ?      ?    1233.6  -24.2957     327.385  -24.2957    104.924   155.704      
1 1 1 6  36 34 o 0 -195    142.4 ?      ?    1692.09 -159.412     292.488  20.5882     876.38    20.5882      
1 1 1 8  36 34 o 0 337.3   146.3 ?      ?    561.402 -167.13      397.655  -167.13     206.636   -167.13      
1 1 1 10 36 34 f 1 -86.3   231.5 ?      ?    1181.41 171.538      36.4447  171.538     360.466   -8.46157     
1 1 1 1  36 35 o 0 696.8   213   ?      ?    3249.85 -60.5228     1101.75  -60.5228    0.768096  119.477      
1 1 1 3  36 35 o 0 433     170.1 ?      ?    973.952 152          773.633  152         444.107   152          
1 1 1 5  36 35 o 0 -50.7   162.7 ?      ?    1290.85 50.1659      66.2675  -129.834    499.928   -129.834     
1 1 1 7  36 35 o 0 -370.2  152.7 ?      ?    1866.47 152.431      386.918  -27.5691    1006.83   -27.5691     
1 1 1 0  1  37 o 0 3065.5  134.4 ?      ?    6811.85 -90          3947.92  -90         491.236   -90          
1 1 1 0  3  37 o 0 861.1   44.6  ?      ?    3641.79 90           2106.21  90          248.656   90           
1 1 1 0  5  37 o 0 35.5    16.9  ?      ?    1630.39 90           193.185  90          639.347   -90          
1 1 1 0  7  37 o 0 -3.6    19.2  ?      ?    624.985 90           17.0399  90          301.156   -90          
1 1 1 0  9  37 o 0 1988.7  98.3  ?      ?    5878.93 -90          3282.88  -90         234.452   -90          
1 1 1 0  11 37 o 0 479.2   31.1  ?      ?    2530.77 90           1589.49  90          291.802   90           
1 1 1 0  13 37 o 0 63.7    22    ?      ?    1552.55 -90          315.655  -90         468.315   90           
1 1 1 0  15 37 o 0 957.2   52.3  ?      ?    3422.65 -90          2176.83  -90         481.888   -90          
1 1 1 0  17 37 f 1 1338.6  71.8  ?      ?    6735.57 90           2513.45  90          820.751   -90          
1 1 1 0  19 37 o 0 591.8   51.2  ?      ?    2072.77 90           1607.2   90          614.838   90           
1 1 1 0  21 37 o 0 -8.3    44.8  ?      ?    1030.91 -90          41.3173  -90         436.046   90           
1 1 1 0  23 37 o 0 42.5    53.2  ?      ?    463.793 90           42.109   90          165.064   -90          
1 1 1 0  25 37 o 0 2009.8  128.9 ?      ?    4137.35 -90          2683.74  -90         883.485   -90          
1 1 1 0  27 37 o 0 204.9   81.7  ?      ?    2344.61 90           645.332  90          330.865   -90          
1 1 1 0  29 37 o 0 2256.1  159.7 ?      ?    5141.37 -90          2623.64  -90         597.133   -90          
1 1 1 0  31 37 o 0 -60.2   119.4 ?      ?    1331.4  -90          76.1214  -90         419.488   90           
1 1 1 0  33 37 o 0 756.5   239.1 ?      ?    3821.89 90           1256.42  90          66.5849   -90          
1 1 1 0  37 1  o 0 2522.5  122.1 ?      ?    6316.66 -90          3756.97  -90         393.712   -90          
1 1 1 1  2  37 o 0 561.4   22.5  ?      ?    2392.58 100.23       1948.67  100.23      731.531   100.23       
1 1 1 1  4  37 o 0 76.6    12.5  ?      ?    1108.84 -158.145     118.981  -158.145    446.733   21.8554      
1 1 1 1  6  37 o 0 432.6   20.3  ?      ?    2724.71 -12.4555     1395.34  -12.4555    6.781     -12.4555     
1 1 1 1  8  37 o 0 1174.2  43.6  ?      ?    4388.52 -140.479     2636.55  -140.479    332.197   -140.479     
1 1 1 1  10 37 o 0 1235.8  43.4  ?      ?    4659.93 95.9922      2614.7   95.9922     213.557   95.9922      
1 1 1 1  12 37 o 0 1416.8  48.4  ?      ?    4731.52 -9.01974     2905.03  -9.01974    499.162   -9.01974     
1 1 1 1  14 37 o 0 379.6   22.5  ?      ?    2434.31 -95.1663     1289.71  -95.1663    73.2459   -95.1663     
1 1 1 1  16 37 o 0 252.6   21.5  ?      ?    2718.08 -163.802     648.768  -163.802    680.648   16.1978      
1 1 1 1  18 37 o 0 1344.5  50.1  ?      ?    4413.28 -20.1152     2683.86  -20.1152    542.474   -20.1152     
1 1 1 1  20 37 o 0 1343.2  58.4  ?      ?    4640.46 -165.411     2502.27  -165.411    316.442   -165.411     
1 1 1 1  22 37 f 1 1669.9  71.2  ?      ?    4383.34 2.06554      3038.34  2.06554     1033.84   2.06554      
1 1 1 1  24 37 o 0 191.2   41.4  ?      ?    842.294 37.6024      442.674  37.6024     73.8594   37.6024      
1 1 1 1  26 37 o 0 -103.7  48.2  ?      ?    1116.03 -137.568     396.015  42.4319     871.181   42.4319      
1 1 1 1  28 37 o 0 127.5   60.6  ?      ?    659.005 -16.757      81.9674  -16.757     180.719   163.243      
1 1 1 1  30 37 f 1 1819.6  113.2 ?      ?    6676.42 168.259      1918.9   168.259     661.479   -11.7411     
1 1 1 1  32 37 o 0 4.1     129.1 ?      ?    1288.49 2.81164      77.7257  -177.188    544.579   -177.188     
1 1 1 1  34 37 o 0 73.1    196.5 ?      ?    2219.92 -22.2403     49.1009  -22.2403    697.588   157.76       
1 1 1 1  37 2  o 0 637.4   25.3  ?      ?    2776.91 154.799      2095.74  154.799     622.058   154.799      
1 1 1 2  3  37 o 0 243.9   15.9  ?      ?    1901.65 7.51867      966.492  7.51867     1.48268   -172.481     
1 1 1 2  5  37 o 0 77.6    13.6  ?      ?    967.614 -93.9557     133.849  -93.9557    359.014   86.0443      
1 1 1 2  7  37 o 0 123.3   15.1  ?      ?    1317.02 -124.833     431.151  -124.833    237.474   55.1669      
1 1 1 2  9  37 o 0 232.9   16.6  ?      ?    2300.43 70.103       758.3    70.103      430.902   -109.897     
1 1 1 2  11 37 o 0 445.3   22.6  ?      ?    3295.79 -26.782      1189.09  -26.782     495.497   153.218      
1 1 1 2  13 37 o 0 989.5   38.2  ?      ?    4334.39 175.796      2178.45  175.796     3.24837   -4.20403     
1 1 1 2  15 37 o 0 105.6   17.9  ?      ?    1169.27 -168.507     247.397  -168.507    329.845   11.4935      
1 1 1 2  17 37 o 0 17.7    18.7  ?      ?    1262.09 59.2681      438.236  -120.732    1057.66   -120.732     
1 1 1 2  19 37 o 0 76.9    26    ?      ?    1325.27 -104.013     40.3346  75.9867     673.115   75.9867      
1 1 1 2  21 37 o 0 -30.6   29.3  ?      ?    15.5698 -147.835     6.02095  32.1654     13.2134   32.1654      
1 1 1 2  23 37 o 0 194.6   36.6  ?      ?    1244.52 -149.517     538.284  -149.517    16.5143   30.4826      
1 1 1 2  25 37 o 0 392.3   47.4  ?      ?    2427.31 91.9804      1018.15  91.9804     36.3259   -88.0196     
1 1 1 2  27 37 o 0 1156.3  74.2  ?      ?    4481.02 -56.3567     1886.13  -56.3567    22.6166   -56.3567     
1 1 1 2  29 37 o 0 5391.5  202.2 ?      ?    8632.68 108.811      4631.27  108.811     1231.06   108.811      
1 1 1 2  31 37 o 0 1100.3  118.3 ?      ?    5004.8  -67.9523     1457.29  -67.9523    405.288   112.048      
1 1 1 2  33 37 o 0 292     172.9 ?      ?    1621.43 165.408      544.258  165.408     17.1646   -14.5918     
1 1 1 0  37 3  o 0 610.8   34.9  ?      ?    2255.28 90           1859.61  90          652.26    90           
1 1 1 2  37 3  o 0 184.5   14.3  ?      ?    1357.81 -163.911     825.95   -163.911    108.889   -163.911     
1 1 1 3  4  37 o 0 571.4   23.5  ?      ?    3775.8  -22.5151     1360.9   -22.5151    558.696   157.485      
1 1 1 3  6  37 o 0 581.2   24.4  ?      ?    2008.61 164.469      2152.32  164.469     1132.71   164.469      
1 1 1 3  8  37 o 0 200     15.6  ?      ?    781.678 22.5668      828.2    22.5668     419.493   22.5668      
1 1 1 3  10 37 o 0 117.5   15.5  ?      ?    2231.71 178.937      114.746  178.937     1030.06   -1.06321     
1 1 1 3  12 37 o 0 168.9   18    ?      ?    2067.56 69.2368      487.572  69.2368     558.911   -110.763     
1 1 1 3  14 37 o 0 171.1   18.6  ?      ?    1836.44 -55.9795     557.473  -55.9795    355.988   124.02       
1 1 1 3  16 37 o 0 499.6   28.1  ?      ?    2833.28 -171.831     1451.65  -171.831    47.7388   -171.831     
1 1 1 3  18 37 o 0 1205.1  50.2  ?      ?    4396.2  66.8212      2415.39  66.8212     291.738   66.8212      
1 1 1 3  20 37 o 0 1740.1  69.8  ?      ?    5627.51 179.268      2715.87  179.268     76.3189   179.268      
1 1 1 3  22 37 o 0 2494    97.5  ?      ?    7371.43 20.5919      2892.99  20.5919     445.725   -159.408     
1 1 1 3  24 37 o 0 2926.5  109.5 ?      ?    6502.99 -115.84      3657.03  -115.84     820.017   -115.84      
1 1 1 3  26 37 o 0 3.7     41.7  ?      ?    583.072 -133.449     159.816  46.5508     407.241   46.5508      
1 1 1 3  28 37 o 0 579.1   64.4  ?      ?    1772.44 -64.7105     1553.76  -64.7105    849.334   -64.7105     
1 1 1 3  30 37 o 0 -119.7  71.2  ?      ?    1323.3  -11.0502     375.712  168.95      882.979   168.95       
1 1 1 3  32 37 o 0 854.7   120.1 ?      ?    4224.85 -168.202     1277.1   -168.202    250.357   11.7981      
1 1 1 3  34 37 f 1 916.1   174.3 ?      ?    2698.69 9.67088      1696.37  9.67088     785.111   9.67088      
1 1 1 1  37 4  o 0 216.3   15.6  ?      ?    1648.85 0.791397     949      0.791397    71.0308   0.791397     
1 1 1 3  37 4  o 0 160     14.5  ?      ?    1838.51 144.25       567.372  144.25      397.284   -35.7498     
1 1 1 4  5  37 o 0 598.1   24    ?      ?    2299.42 103.349      2088.26  103.349     922.77    103.349      
1 1 1 4  7  37 o 0 1058.8  37.7  ?      ?    4797.01 -72.0966     2169.89  -72.0966    338.932   107.903      
1 1 1 4  9  37 o 0 1393.5  48.6  ?      ?    5093.21 103.392      2714.86  103.392     96.7427   103.392      
1 1 1 4  11 37 o 0 228.3   18.4  ?      ?    2145.37 -163.267     777.464  -163.267    312.695   16.7327      
1 1 1 4  13 37 o 0 421.8   24    ?      ?    3187.67 -63.79       1130.32  -63.79      464.583   116.21       
1 1 1 4  15 37 o 0 1758.4  62.4  ?      ?    5200.06 74.2811      3183.49  74.2811     631.859   74.2811      
1 1 1 4  17 37 o 0 86.4    20.2  ?      ?    2418.72 -153.314     228.934  26.6858     1408.87   26.6858      
1 1 1 4  19 37 o 0 64.4    23.3  ?      ?    612.845 24.0615      32.2093  -155.938    323.089   -155.938     
1 1 1 4  21 37 o 0 1524.1  64.1  ?      ?    3869.38 21.7177      3060.94  21.7177     1283.84   21.7177      
1 1 1 4  23 37 o 0 743.9   49.2  ?      ?    2585.85 -81.6652     1971.65  -81.6652    825.34    -81.6652     
1 1 1 4  25 37 o 0 446.5   45.4  ?      ?    2589.71 -151.269     1123.87  -151.269    4.86314   -151.269     
1 1 1 4  27 37 o 0 807.3   79.4  ?      ?    3785.14 162.587      1492.01  162.587     74.1191   -17.413      
1 1 1 4  29 37 o 0 2103    99.4  ?      ?    5258.04 -53.4664     2860.72  -53.4664    799.599   -53.4664     
1 1 1 4  31 37 o 0 115.1   83.7  ?      ?    2151.32 92.7802      75.3609  -87.2198    872.422   -87.2198     
1 1 1 4  33 37 o 0 42.8    120.5 ?      ?    1402.08 140.733      54.7952  -39.2666    538.265   -39.2666     
1 1 1 0  37 5  o 0 228     22.8  ?      ?    1865.67 -90          1085.21  -90         85.1976   -90          
1 1 1 2  37 5  o 0 350.6   18.7  ?      ?    1539.59 71.11        1582.43  71.11       768.333   71.11        
1 1 1 4  37 5  o 0 187.7   15.6  ?      ?    2092.06 -77.0017     634.772  -77.0017    454.124   102.998      
1 1 1 5  6  37 o 0 401.9   20.9  ?      ?    3886.52 -141.589     776.411  -141.589    1254      38.4114      
1 1 1 5  8  37 o 0 224.3   16.9  ?      ?    3097.17 29.5593      384.808  29.5593     1208.3    -150.441     
1 1 1 5  10 37 f 1 1152.2  42.1  ?      ?    3323.76 -35.6537     3026.31  -35.6537    1323.66   -35.6537     
1 1 1 5  12 37 o 0 1948.9  66.4  ?      ?    5255.72 120.135      3547.37  120.135     906.46    120.135      
1 1 1 5  14 37 o 0 1043.1  42    ?      ?    4447.59 -61.8674     2202.62  -61.8674    6.70978   -61.8674     
1 1 1 5  16 37 o 0 160.4   21    ?      ?    2515.35 132.831      215.247  132.831     1021.8    -47.1687     
1 1 1 5  18 37 o 0 46.6    22.2  ?      ?    858.013 87.3028      151.997  -92.6972    563.359   -92.6972     
1 1 1 5  20 37 o 0 872.5   45    ?      ?    3387.33 -82.9957     2080.37  -82.9957    503.438   -82.9957     
1 1 1 5  22 37 o 0 229.8   44.9  ?      ?    875.661 -77.0534     612.087  -77.0534    218.406   -77.0534     
1 1 1 5  24 37 o 0 242.4   54.9  ?      ?    2227.07 142.501      585.974  142.501     378.571   -37.4987     
1 1 1 5  26 37 o 0 449.7   67.4  ?      ?    3092.2  129.027      929.224  129.027     373.655   -50.9731     
1 1 1 5  28 37 o 0 302.8   75.5  ?      ?    1818.7  -163.929     762.603  -163.929    44.7585   -163.929     
1 1 1 5  30 37 o 0 -225.1  112   ?      ?    1715.34 24.4252      431.892  -155.575    1081.77   -155.575     
1 1 1 5  32 37 o 0 237.1   56.3  ?      ?    615.994 107.574      329.915  107.574     108.631   107.574      
1 1 1 5  34 37 o 0 -156.4  135   ?      ?    974.542 3.98951      149.356  -176.01     474.572   -176.01      
1 1 1 1  37 6  o 0 297.7   17    ?      ?    2384.96 137.369      1071.33  137.369     197.541   -42.6305     
1 1 1 3  37 6  o 0 17.6    12.6  ?      ?    954.676 -130.502     338.119  49.4977     838.646   49.4977      
1 1 1 5  37 6  o 0 1082.1  37.1  ?      ?    3108.47 -32.7402     3105.13  -32.7402    1445.55   -32.7402     
1 1 1 6  7  37 o 0 2.2     14.7  ?      ?    1406.48 171.86       599.539  -8.13958    1322.49   -8.13958     
1 1 1 6  9  37 o 0 281.8   19.1  ?      ?    2630.18 -176.445     843.6    -176.445    497.555   3.55538      
1 1 1 6  11 37 o 0 -10.2   16    ?      ?    1549.29 -39.3715     680.401  140.629     1461.07   140.629      
1 1 1 6  13 37 f 1 66      18.2  ?      ?    2243    -131.406     296.209  48.5941     1415.05   48.5941      
1 1 1 6  15 37 o 0 129.2   20.2  ?      ?    1860.42 -110.387     232.794  -110.387    688.092   69.6131      
1 1 1 6  17 37 o 0 265.7   29.7  ?      ?    696.577 -107.421     795.661  -107.421    458.895   -107.421     
1 1 1 6  19 37 o 0 3200.6  116   ?      ?    6433.35 83.2322      4305.12  83.2322     1279.21   83.2322      
1 1 1 6  21 37 o 0 1590    70.9  ?      ?    4976.14 -118.818     2673.96  -118.818    409.252   -118.818     
1 1 1 6  23 37 o 0 48.2    45.6  ?      ?    719.204 -176.226     102.156  3.77442     418.099   3.77442      
1 1 1 6  25 37 o 0 336.3   62    ?      ?    1209.79 -108.533     980.021  -108.533    461.956   -108.533     
1 1 1 6  27 37 o 0 1457    97.7  ?      ?    4056.95 67.1478      2482.85  67.1478     819.118   67.1478      
1 1 1 6  29 37 f 1 30.5    91    ?      ?    2200.25 -87.2339     321.642  92.7661     1181.44   92.7661      
1 1 1 6  31 37 o 0 348.8   132.3 ?      ?    3006.31 27.7313      481.78   27.7313     622.522   -152.269     
1 1 1 6  33 37 o 0 769.6   204   ?      ?    3026.98 -90.0655     1359.42  -90.0655    324.393   -90.0655     
1 1 1 0  37 7  o 0 832.3   45.5  ?      ?    2563.47 90           2168.97  90          799.078   90           
1 1 1 2  37 7  o 0 12.8    14.3  ?      ?    881.2   -69.3015     333.04   110.698     797.657   110.698      
1 1 1 4  37 7  o 0 196.5   15.6  ?      ?    1819.77 71.6494      800.454  71.6494     177.744   -108.351     
1 1 1 6  37 7  o 0 348.9   19.8  ?      ?    2568.45 -137.01      1174.54  -137.01     168.401   42.9903      
1 1 1 7  8  37 o 0 748.8   30.1  ?      ?    2760.47 161.438      2329.67  161.438     922.564   161.438      
1 1 1 7  10 37 o 0 676.7   30.4  ?      ?    2857.42 2.78354      2070.47  2.78354     628.669   2.78354      
1 1 1 7  12 37 o 0 643.1   31.1  ?      ?    2881.57 91.8721      1938.56  91.8721     504.796   91.8721      
1 1 1 7  14 37 o 0 187.7   22.9  ?      ?    1113.24 -121.905     710.398  -121.905    166.302   -121.905     
1 1 1 7  16 37 o 0 365.4   27.6  ?      ?    1770.37 -178.47      1337.65  -178.47     475.972   -178.47      
1 1 1 7  18 37 o 0 819     44.4  ?      ?    3925.47 -36.8775     1768.69  -36.8775    93.554    143.122      
1 1 1 7  20 37 o 0 217.8   40.4  ?      ?    2284.95 40.2472      508.172  40.2472     542.677   -139.753     
1 1 1 7  22 37 o 0 556.2   50    ?      ?    3751.1  152.863      1082.25  152.863     586.114   -27.1368     
1 1 1 7  24 37 o 0 -26.2   57.8  ?      ?    1351.77 167.455      376.292  -12.5453    963.502   -12.5453     
1 1 1 7  26 37 o 0 70.5    64.2  ?      ?    1944.99 20.8886      219.917  -159.111    1030.63   -159.111     
1 1 1 7  28 37 o 0 1250    98.6  ?      ?    4189.89 -50.7918     2101.14  -50.7918    443.063   -50.7918     
1 1 1 7  30 37 o 0 -70.7   128.7 ?      ?    623.733 -172.548     77.5633  7.45241     311.361   7.45241      
1 1 1 7  32 37 o 0 144.2   177.3 ?      ?    1782.57 -82.94       218.722  -82.94      404.502   97.06        
1 1 1 7  34 37 o 0 170     221.5 ?      ?    1274.37 -117.772     246.75   -117.772    174.088   62.2285      
1 1 1 1  37 8  o 0 441.9   20.7  ?      ?    2159.65 -93.3902     1784.91  -93.3902    600.965   -93.3902     
1 1 1 3  37 8  o 0 529.3   25.2  ?      ?    3620.06 10.9679      1386.57  10.9679     569.43    -169.032     
1 1 1 5  37 8  o 0 1531.9  53.4  ?      ?    4820.97 -140.375     3185.15  -140.375    648.341   -140.375     
1 1 1 7  37 8  o 0 1001.9  38.7  ?      ?    3034.11 93.1392      2869.4   93.1392     1303.21   93.1392      
1 1 1 8  9  37 f 1 75.9    17.6  ?      ?    3189.59 -24.1361     585.496  155.864     2203.99   155.864      
1 1 1 8  11 37 o 0 445.9   26.3  ?      ?    3411.36 29.3838      1109.72  29.3838     590.521   -150.616     
1 1 1 8  13 37 f 1 607.6   32.4  ?      ?    2635.61 -120.532     1905.29  -120.532    605.424   -120.532     
1 1 1 8  15 37 o 0 259.6   24.8  ?      ?    2653.33 157.28       643.227  157.28      654.904   -22.7197     
1 1 1 8  17 37 o 0 370.2   33.1  ?      ?    1807.28 72.5076      1320.6   72.5076     457.236   72.5076      
1 1 1 8  19 37 f 1 23      35.2  ?      ?    1595.34 -179.923     419.706  0.0771442   1165.17   0.0771442    
1 1 1 8  21 37 o 0 539.6   48.5  ?      ?    3058.48 93.3883      1316.82  93.3883     58.0221   -86.6117     
1 1 1 8  23 37 o 0 637.1   59.7  ?      ?    2379.84 3.31781      1739.98  3.31781     707.514   3.31781      
1 1 1 8  25 37 o 0 60.1    62.4  ?      ?    1236.16 3.98103      125.932  -176.019    648.664   -176.019     
1 1 1 8  27 37 o 0 421.8   81    ?      ?    3479.77 97.7846      685.776  97.7846     695.354   -82.2154     
1 1 1 8  29 37 o 0 713     116.2 ?      ?    1859.33 -109.191     1751.46  -109.191    1038.07   -109.191     
1 1 1 8  31 37 o 0 565.8   155.9 ?      ?    2964.84 157.859      1061.34  157.859     14.009    -22.1406     
1 1 1 8  33 37 o 0 849.1   213.8 ?      ?    3009.31 21.0121      1479.28  21.0121     463.243   21.0121      
1 1 1 0  37 9  o 0 621.9   38.3  ?      ?    3155.58 90           1926.94  90          209.977   90           
1 1 1 2  37 9  o 0 2504.2  80.3  ?      ?    7310.05 -145.537     3621.07  -145.537    304.283   34.4634      
1 1 1 4  37 9  o 0 81.8    16.7  ?      ?    552.423 -13.9612     88.6175  -13.9612    203.441   166.039      
1 1 1 6  37 9  o 0 232.9   20.8  ?      ?    2939.44 93.3707      499.216  93.3707     1027.19   -86.6293     
1 1 1 8  37 9  f 1 18.1    17.1  ?      ?    2017.19 -106.414     729.539  73.586      1761.63   73.586       
1 1 1 9  10 37 o 0 759.7   34.3  ?      ?    3587.61 -91.5658     1947     -91.5658    158.375   -91.5658     
1 1 1 9  12 37 o 0 576.6   30.7  ?      ?    3892.44 -121.536     1286.4   -121.536    626.316   58.4635      
1 1 1 9  14 37 o 0 74.2    21.3  ?      ?    1477.35 136.868      69.4212  -43.1318    794.871   -43.1318     
1 1 1 9  16 37 o 0 1070.2  50.1  ?      ?    4461.29 -21.5741     2103.21  -21.5741    39.5647   158.426      
1 1 1 9  18 37 o 0 1614.5  69    ?      ?    4701.35 129.981      2920.12  129.981     719.923   129.981      
1 1 1 9  20 37 o 0 565.2   53.1  ?      ?    2649.22 -14.7804     1545.29  -14.7804    343.709   -14.7804     
1 1 1 9  22 37 o 0 1000.5  68.8  ?      ?    4540.67 -62.3535     1739.76  -62.3535    251.46    117.647      
1 1 1 9  24 37 o 0 91.3    58.9  ?      ?    1668.01 16.1672      84.7336  -163.833    799.017   -163.833     
1 1 1 9  26 37 o 0 67      71.9  ?      ?    972.919 175.015      50.717   -4.98522    450.421   -4.98522     
1 1 1 9  28 37 o 0 184.7   97.8  ?      ?    2112.81 84.8083      214.463  84.8083     609.524   -95.1917     
1 1 1 9  30 37 o 0 -49.2   128   ?      ?    2254.16 40.1171      339.639  -139.883    1172.25   -139.883     
1 1 1 9  32 37 f 1 -131.2  194.4 ?      ?    1868.74 -65.3442     138.626  114.656     786.044   114.656      
1 1 1 1  37 10 o 0 2250.4  73    ?      ?    6818.65 90.5723      3488.36  90.5723     179.217   -89.4277     
1 1 1 3  37 10 o 0 1160.2  44.5  ?      ?    5699.78 146.891      1999.74  146.891     1022.69   -33.1093     
1 1 1 5  37 10 f 1 36.5    18.5  ?      ?    802.827 15.6628      186.177  -164.337    607.228   -164.337     
1 1 1 7  37 10 o 0 1326.5  50.8  ?      ?    3822.9  -17.8507     3177.1   -17.8507    1221.17   -17.8507     
1 1 1 9  37 10 o 0 1219    47.8  ?      ?    3463.96 171.838      3057.07  171.838     1322.95   171.838      
1 1 1 10 11 37 o 0 310.2   26.1  ?      ?    2036.19 177.653      1142.75  177.653     141.61    177.653      
1 1 1 10 13 37 o 0 557.8   31.2  ?      ?    3207.01 26.4819      1461.18  26.4819     117.123   -153.518     
1 1 1 10 15 37 o 0 562.6   34.3  ?      ?    2765.95 -172.002     1623.09  -172.002    289.404   -172.002     
1 1 1 10 17 37 o 0 1902.4  77.6  ?      ?    6094.08 -23.7305     2762.67  -23.7305    105.318   156.27       
1 1 1 10 19 37 o 0 1031    58.7  ?      ?    3855.59 -150.493     2162.41  -150.493    400.817   -150.493     
1 1 1 10 21 37 o 0 493.4   56    ?      ?    2022.21 -164.837     1500.14  -164.837    605.251   -164.837     
1 1 1 10 23 37 f 1 684     69.4  ?      ?    3057.81 -130.158     1558.53  -130.158    227.344   -130.158     
1 1 1 10 25 37 f 1 1844.6  102.4 ?      ?    5777.95 63.3002      2389.11  63.3002     28.4402   -116.7       
1 1 1 10 27 37 f 1 1301.9  102.7 ?      ?    3025.45 -94.4733     2570.9   -94.4733    1367.03   -94.4733     
1 1 1 10 29 37 o 0 -72     129.1 ?      ?    1521.23 -41.4215     221.832  138.578     792.966   138.578      
1 1 1 10 31 37 o 0 1094.4  176.7 ?      ?    3658.32 -5.71493     1803.65  -5.71493    498.865   -5.71493     
1 1 1 10 33 37 o 0 1154.3  227.8 ?      ?    4075.09 -166.836     1591.47  -166.836    238.658   -166.836     
1 1 1 0  37 11 o 0 106     25.2  ?      ?    1076.66 90           429.691  90          149.275   -90          
1 1 1 2  37 11 o 0 1681.9  56.9  ?      ?    6001.78 36.3025      2895.98  36.3025     290.406   -143.698     
1 1 1 4  37 11 o 0 75.7    19.4  ?      ?    1082.67 146.84       54.2653  146.84      511.8     -33.1603     
1 1 1 6  37 11 o 0 974.5   38.1  ?      ?    3226.56 -90.9412     2705.42  -90.9412    1048.17   -90.9412     
1 1 1 8  37 11 o 0 219.2   22.5  ?      ?    3746.44 -95.3005     61.8124  -95.3005    1823.66   84.6995      
1 1 1 10 37 11 o 0 2931.7  98.9  ?      ?    6811.53 82.0696      4126.48  82.0696     776.998   82.0696      
1 1 1 11 12 37 o 0 451.2   29.7  ?      ?    1606.1  -90.7655     1686.55  -90.7655    895.5     -90.7655     
1 1 1 11 14 37 o 0 351.2   29.5  ?      ?    2640.41 164.115      998.567  164.115     277.671   -15.885      
1 1 1 11 16 37 o 0 745.6   44.8  ?      ?    3018.21 -127.89      1965.99  -127.89     539.775   -127.89      
1 1 1 11 18 37 o 0 242.8   34.1  ?      ?    2703.33 -57.0489     485.237  -57.0489    757.006   122.951      
1 1 1 11 20 37 o 0 830.9   60.8  ?      ?    3294.07 89.857       1916.34  89.857      447.744   89.857       
1 1 1 11 22 37 o 0 358     57.4  ?      ?    2071.9  69.4045      1038.9   69.4045     146.132   69.4045      
1 1 1 11 24 37 o 0 554.5   73.7  ?      ?    3760.89 -104.921     959.224  -104.921    622.677   75.0786      
1 1 1 11 26 37 o 0 185.2   76.7  ?      ?    665.059 95.1667      227.629  95.1667     35.3377   -84.8333     
1 1 1 11 28 37 o 0 404.9   117.7 ?      ?    2766.01 84.2642      803.078  84.2642     255.872   -95.7358     
1 1 1 11 30 37 o 0 3214.2  211.3 ?      ?    6803.7  -123.34      3200.62  -123.34     734.226   -123.34      
1 1 1 11 32 37 o 0 80.9    204.2 ?      ?    2005.54 0.538205     113.085  0.538205    564.843   -179.462     
1 1 1 1  37 12 o 0 22.4    18.5  ?      ?    1073.43 -20.6711     356.792  159.329     926.282   159.329      
1 1 1 3  37 12 o 0 3001.5  98.6  ?      ?    7052.41 -74.1432     4361.38  -74.1432    671.325   -74.1432     
1 1 1 5  37 12 o 0 699.1   32.9  ?      ?    2561.3  50.875       2299.41  50.875      981.046   50.875       
1 1 1 7  37 12 o 0 2223.4  76.1  ?      ?    7394.5  147.732      2950.07  147.732     784.515   -32.268      
1 1 1 9  37 12 o 0 180.5   23.8  ?      ?    2557.61 78.9576      366.626  78.9576     897.361   -101.042     
1 1 1 11 37 12 o 0 248.3   25    ?      ?    1786.13 -62.9351     871.628  -62.9351    4.85039   117.065      
1 1 1 12 13 37 o 0 115.2   26.3  ?      ?    1506.35 122.415      204.205  122.415     524.587   -57.5848     
1 1 1 12 15 37 o 0 167.2   29.2  ?      ?    1331.15 13.6988      509.628  13.6988     121.008   -166.301     
1 1 1 12 17 37 o 0 2442.7  97.4  ?      ?    5955.18 142.182      3521.89  142.182     769.719   142.182      
1 1 1 12 19 37 o 0 180.9   33.9  ?      ?    1038.81 -121.302     458.976  -121.302    6.87239   58.6979      
1 1 1 12 21 37 o 0 1957.7  96    ?      ?    6219.8  -6.30897     2560.17  -6.30897    140.087   173.691      
1 1 1 12 23 37 o 0 530.6   71.6  ?      ?    3824.61 -152.3       884.756  -152.3      738.811   27.7         
1 1 1 12 25 37 o 0 252     85.1  ?      ?    998.748 -151.501     515.571  -151.501    116.33    -151.501     
1 1 1 12 27 37 o 0 985.2   111.1 ?      ?    4043.51 13.4688      1660.2   13.4688     92.4651   13.4688      
1 1 1 12 29 37 o 0 416.2   132.6 ?      ?    3326.83 151.671      578.194  151.671     645.295   -28.3289     
1 1 1 12 31 37 o 0 2005.2  208.8 ?      ?    4092.3  163.106      2794.57  163.106     1388.7    163.106      
1 1 1 0  37 13 o 0 -23.6   26.2  ?      ?    1747.32 -90          39.4737  -90         885.025   90           
1 1 1 2  37 13 o 0 277     21.5  ?      ?    1606.61 85.6488      1186.88  85.6488     347.208   85.6488      
1 1 1 4  37 13 o 0 1185.5  47.5  ?      ?    3293.41 -164.37      3151.46  -164.37     1455.72   -164.37      
1 1 1 6  37 13 f 1 573     28.9  ?      ?    2381.64 57.6356      1965.22  57.6356     753.457   57.6356      
1 1 1 8  37 13 f 1 322.9   24.1  ?      ?    2533.62 80.0209      1020.21  80.0209     243.058   -99.9791     
1 1 1 10 37 13 o 0 399.2   27.3  ?      ?    2180.92 -94.3911     1358.64  -94.3911    283.296   -94.3911     
1 1 1 12 37 13 o 0 366.7   28.5  ?      ?    2971.45 134.728      919.021  134.728     508.092   -45.2721     
1 1 1 13 14 37 o 0 253.4   30.3  ?      ?    2910.26 14.2614      499.031  14.2614     881.211   -165.739     
1 1 1 13 16 37 o 0 2615.7  103   ?      ?    5134.71 34.9445      4117.13  34.9445     1737.79   34.9445      
1 1 1 13 18 37 f 1 22.3    35.3  ?      ?    1208.73 -24.9449     323.567  155.055     871.011   155.055      
1 1 1 13 20 37 o 0 966.1   68.3  ?      ?    3000.17 149.216      2260.86  149.216     950.673   149.216      
1 1 1 13 22 37 o 0 833.2   73    ?      ?    3490.41 -162.559     1710.36  -162.559    217.463   -162.559     
1 1 1 13 24 37 o 0 1690.2  110.1 ?      ?    5138.07 22.2851      2412.68  22.2851     297.856   22.2851      
1 1 1 13 26 37 f 1 459     97.5  ?      ?    3742.26 -70.2264     671.202  -70.2264    803.881   109.774      
1 1 1 13 28 37 o 0 770.7   135.5 ?      ?    4082.79 -158.608     1168.9   -158.608    351.609   21.3919      
1 1 1 13 30 37 o 0 1077.3  172.2 ?      ?    3436.52 51.3849      1833.13  51.3849     615.583   51.3849      
1 1 1 13 32 37 o 0 515.2   225.4 ?      ?    4028.68 32.0336      403.276  32.0336     927.225   -147.966     
1 1 1 1  37 14 o 0 134.8   21.5  ?      ?    688.113 -103.832     367.623  -103.832    9.12164   -103.832     
1 1 1 3  37 14 o 0 363.1   26.2  ?      ?    2813.8  31.7746      1106.41  31.7746     340.1     -148.225     
1 1 1 5  37 14 o 0 319.4   25.7  ?      ?    2991.3  130.707      842.178  130.707     671.107   -49.2929     
1 1 1 7  37 14 o 0 414.2   28    ?      ?    2371.22 -4.7059      1428.08  -4.7059     250.766   -4.7059      
1 1 1 9  37 14 o 0 154.7   24.6  ?      ?    1527.42 -98.6039     447.188  -98.6039    308.159   81.3961      
1 1 1 11 37 14 o 0 666.7   36.2  ?      ?    2162.7  179.976      2129.14  179.976     1085.65   179.976      
1 1 1 13 37 14 o 0 34.4    29.9  ?      ?    880.058 -75.2649     197.04   104.735     609.94    104.735      
1 1 1 14 15 37 o 0 247.2   35.9  ?      ?    922.189 173.211      804.782  173.211     376.964   173.211      
1 1 1 14 17 37 o 0 753.1   49.5  ?      ?    4821.36 -27.712      1147.34  -27.712     1029.93   152.288      
1 1 1 14 19 37 o 0 269.2   42.7  ?      ?    2404.06 -11.7285     658.572  -11.7285    395.815   168.272      
1 1 1 14 21 37 o 0 2465.9  121.4 ?      ?    5746.7  132.776      3291.93  132.776     819.449   132.776      
1 1 1 14 23 37 o 0 146.4   79    ?      ?    1436.91 -86.1621     193.925  -86.1621    401.966   93.8379      
1 1 1 14 25 37 o 0 278.5   88.6  ?      ?    2527.49 -146.203     528.648  -146.203    471.118   33.797       
1 1 1 14 27 37 f 1 189.9   122.4 ?      ?    564.3   -161.918     176.739  -161.918    36.9      18.0824      
1 1 1 14 29 37 o 0 551.7   158.7 ?      ?    2860.75 95.5902      1050.97  95.5902     24.6901   95.5902      
1 1 1 14 31 37 o 0 1189.6  217.9 ?      ?    5439.22 -55.6913     1283.11  -55.6913    538.884   124.309      
1 1 1 0  37 15 o 0 -47.6   32.8  ?      ?    1379.15 90           30.0593  90          684.684   -90          
1 1 1 2  37 15 o 0 126.7   22.1  ?      ?    2462.83 -46.934      91.7273  -46.934     1169.85   133.066      
1 1 1 4  37 15 o 0 611.1   32    ?      ?    3337.43 -4.42479     1676.19  -4.42479    8.86831   175.575      
1 1 1 6  37 15 o 0 582.4   31.6  ?      ?    3949.97 87.1941      1238.9   87.1941     756.186   -92.8059     
1 1 1 8  37 15 o 0 1406    53.4  ?      ?    4396.68 -97.2063     2860.05  -97.2063    683.364   -97.2063     
1 1 1 10 37 15 o 0 2155    75.3  ?      ?    5413.25 78.0538      3535.74  78.0538     916.715   78.0538      
1 1 1 12 37 15 o 0 1208.1  50.4  ?      ?    3281.04 -61.415      2838.41  -61.415     1292.1    -61.415      
1 1 1 14 37 15 o 0 829.4   48.1  ?      ?    3876.86 -160.827     1748.4   -160.827    25.0603   19.1731      
1 1 1 15 16 37 o 0 391.2   42.3  ?      ?    2068.34 131.364      1210.61  131.364     275.483   131.364      
1 1 1 15 18 37 o 0 618.2   51    ?      ?    2603.83 -90.3032     1650.54  -90.3032    505.436   -90.3032     
1 1 1 15 20 37 o 0 120.2   50.2  ?      ?    1946.1  -155.775     11.6947  -155.775    829.187   24.2252      
1 1 1 15 22 37 o 0 965.3   82.1  ?      ?    3904.42 -4.59129     1767.24  -4.59129    138.57    -4.59129     
1 1 1 15 24 37 o 0 2343.7  126.4 ?      ?    6365.13 161.018      2732.48  161.018     229.573   161.018      
1 1 1 15 26 37 o 0 1724.4  130.8 ?      ?    4782.19 91.3671      2472.87  91.3671     646.933   91.3671      
1 1 1 15 28 37 o 0 2168.1  188   ?      ?    4618.17 -23.758      2905.04  -23.758     1230.5    -23.758      
1 1 1 15 30 37 o 0 181     177.8 ?      ?    1787.87 -19.5702     266.978  -19.5702    339.343   160.43       
1 1 1 1  37 16 o 0 892.2   38    ?      ?    4278.61 -116.519     2001.31  -116.519    177.99    63.4814      
1 1 1 3  37 16 o 0 312.6   27.2  ?      ?    2495.03 -177.647     961.847  -177.647    315.162   2.35255      
1 1 1 5  37 16 o 0 1577.3  60.1  ?      ?    4199.78 -12.7193     3314.53  -12.7193    1198.25   -12.7193     
1 1 1 7  37 16 o 0 375.1   29.3  ?      ?    2476.38 88.3848      1172.11  88.3848     52.9512   -91.6152     
1 1 1 9  37 16 o 0 830.6   40.4  ?      ?    3269.99 -153.824     2116.51  -153.824    533.068   -153.824     
1 1 1 11 37 16 o 0 182.9   29.9  ?      ?    1580.49 -23.9653     567.927  -23.9653    178.86    156.035      
1 1 1 13 37 16 o 0 529.9   40    ?      ?    3338.12 129.525      1233.42  129.525     300.364   -50.4751     
1 1 1 15 37 16 o 0 1095.2  58.7  ?      ?    4148.4  -36.8321     2108.7   -36.8321    264.885   -36.8321     
1 1 1 16 17 37 o 0 592.7   58.9  ?      ?    3437.93 -173.227     1284.4   -173.227    229.22    6.77345      
1 1 1 16 19 37 o 0 28.8    59.4  ?      ?    1352.83 -119.597     254.429  60.4025     840.519   60.4025      
1 1 1 16 21 37 o 0 45.7    66.6  ?      ?    538.391 -137.127     56.4204  42.8731     281.946   42.8731      
1 1 1 16 23 37 o 0 447.9   61.1  ?      ?    2421.65 61.1559      1085.16  61.1559     127.427   61.1559      
1 1 1 16 25 37 f 1 0.4     25.1  ?      ?    3271.75 -6.87795     1049.77  173.122     2315.28   173.122      
1 1 1 16 27 37 o 0 22.7    155.8 ?      ?    1510.65 48.4581      23.9254  -131.542    576.588   -131.542     
1 1 1 16 29 37 o 0 1366.3  204.5 ?      ?    4083.78 168.518      2009.67  168.518     610.08    168.518      
1 1 1 16 31 37 o 0 -42.2   240.4 ?      ?    2047.01 -74.603      19.0773  105.397     684.696   105.397      
1 1 1 0  37 17 f 1 1553.6  87.2  ?      ?    3824.67 90           2827.85  90          849.728   90           
1 1 1 2  37 17 o 0 477     32.9  ?      ?    2219.81 34.717       1654.46  34.717      525.18    34.717       
1 1 1 4  37 17 o 0 397.4   32.7  ?      ?    2419.48 143.883      1289.51  143.883     75.6148   143.883      
1 1 1 6  37 17 o 0 2387.1  88.4  ?      ?    5775.13 -60.3944     3767.56  -60.3944    918.273   -60.3944     
1 1 1 8  37 17 o 0 3847    129.4 ?      ?    7521.35 92.9789      4649.79  92.9789     1011.47   92.9789      
1 1 1 10 37 17 o 0 895     45.5  ?      ?    3529.72 -83.0388     2103.32  -83.0388    434.411   -83.0388     
1 1 1 12 37 17 o 0 1297.7  57.9  ?      ?    5065.02 -177.51      2181.76  -177.51     151.244   2.4902       
1 1 1 14 37 17 o 0 627.8   49.9  ?      ?    1676.13 27.8329      1949.85  27.8329     1201.58   27.8329      
1 1 1 16 37 17 o 0 51.4    48.5  ?      ?    2361.44 9.36413      444.585  -170.636    1463.83   -170.636     
1 1 1 17 18 37 o 0 279.3   59.4  ?      ?    1595.42 170.27       801.639  170.27      109.745   170.27       
1 1 1 17 20 37 o 0 176.4   68.9  ?      ?    1311.55 38.0458      339.054  38.0458     211.734   -141.954     
1 1 1 17 22 37 o 0 204.1   76.7  ?      ?    2501.17 3.76908      229.005  3.76908     764.208   -176.231     
1 1 1 17 24 37 o 0 511.8   78.2  ?      ?    3154.29 -38.1725     1003.79  -38.1725    216.246   141.828      
1 1 1 17 26 37 o 0 -194.4  120   ?      ?    2117.9  -117.602     482.909  62.3977     1263.3    62.3977      
1 1 1 17 28 37 o 0 227.3   174.8 ?      ?    1355.48 119.721      399.061  119.721     69.5626   -60.279      
1 1 1 17 30 37 o 0 -172    244.2 ?      ?    833.423 40.6986      11.5834  40.6986     262.23    -139.301     
1 1 1 1  37 18 o 0 708.4   38.8  ?      ?    3137.11 -28.2263     1951.14  -28.2263    368.376   -28.2263     
1 1 1 3  37 18 o 0 853.1   45.8  ?      ?    2737.73 90.7171      2455.44  90.7171     1090.68   90.7171      
1 1 1 5  37 18 o 0 252.4   33.1  ?      ?    3046.65 -90.6728     455.802  -90.6728    1040.3    89.3272      
1 1 1 7  37 18 o 0 427.6   37.6  ?      ?    3802.29 -117.563     778.879  -117.563    1054.92   62.4375      
1 1 1 9  37 18 o 0 98.9    34.5  ?      ?    1433.09 40.9155      83.2259  40.9155     593.498   -139.084     
1 1 1 11 37 18 o 0 278.9   36.7  ?      ?    2038.5  -65.7815     834.871  -65.7815    103.162   114.219      
1 1 1 13 37 18 f 1 68.2    42.2  ?      ?    1548.7  124.514      177.735  -55.4864    874.705   -55.4864     
1 1 1 15 37 18 o 0 384.2   50.6  ?      ?    1762.96 174.916      1201.12  174.916     436.792   174.916      
1 1 1 17 37 18 o 0 1570.6  82.2  ?      ?    3409.7  -73.7778     2990.67  -73.7778    1544.63   -73.7778     
1 1 1 18 19 37 o 0 1725.1  95.3  ?      ?    5057.85 126.449      2552.74  126.449     426.826   126.449      
1 1 1 18 21 37 o 0 927.4   92    ?      ?    3762.11 -77.6485     1696.26  -77.6485    168.465   -77.6485     
1 1 1 18 23 37 o 0 800.6   82.5  ?      ?    2684.67 101.148      1777.35  101.148     734.911   101.148      
1 1 1 18 25 37 o 0 74.8    88.3  ?      ?    1681.53 93.59        116.884  -86.41      739.847   -86.41       
1 1 1 18 27 37 o 0 294     115.9 ?      ?    2827.92 10.4154      394.726  10.4154     606.175   -169.585     
1 1 1 18 29 37 o 0 279.6   214.1 ?      ?    2257.24 -90.6386     414.784  -90.6386    333.148   89.3614      
1 1 1 0  37 19 o 0 1236.1  73.2  ?      ?    5817.14 90           2448.93  90          454.933   -90          
1 1 1 2  37 19 o 0 1009.1  48.7  ?      ?    4105.68 -144.409     2196.29  -144.409    167.192   -144.409     
1 1 1 4  37 19 o 0 1157    55.4  ?      ?    3929.26 -27.029      2552.24  -27.029     635.756   -27.029      
1 1 1 6  37 19 o 0 1410.3  66.3  ?      ?    6059.58 -141.457     2020.53  -141.457    887.374   38.5427      
1 1 1 8  37 19 f 1 482.3   45.4  ?      ?    1140.16 47.6843      1718.8   47.6843     1179.11   47.6843      
1 1 1 10 37 19 o 0 473.5   43.7  ?      ?    2821.06 -124.641     1245.91  -124.641    50.3393   55.3592      
1 1 1 12 37 19 o 0 493.6   48.5  ?      ?    2354.77 30.4758      1425.62  30.4758     371.409   30.4758      
1 1 1 14 37 19 o 0 219.6   48.2  ?      ?    379.367 26.6829      296.031  26.6829     131.161   26.6829      
1 1 1 16 37 19 o 0 1925    94.7  ?      ?    4855.92 -154.186     2944.62  -154.186    875.857   -154.186     
1 1 1 18 37 19 o 0 49.8    63.7  ?      ?    2672.52 59.3952      489.234  -120.605    1585.3    -120.605     
1 1 1 19 20 37 o 0 1809.4  103.5 ?      ?    5092.72 49.5685      2562.41  49.5685     492.868   49.5685      
1 1 1 19 22 37 f 1 770.6   94    ?      ?    2945.08 -147.018     1634.28  -147.018    481.77    -147.018     
1 1 1 19 24 37 o 0 -34.4   89.5  ?      ?    1286.93 -46.9493     241.891  133.051     720.414   133.051      
1 1 1 19 26 37 o 0 362.8   118.8 ?      ?    2631.41 -65.9894     641.746  -65.9894    294.436   114.011      
1 1 1 19 28 37 o 0 1031.5  160.1 ?      ?    2671.59 -150.674     1895.51  -150.674    1004.33   -150.674     
1 1 1 1  37 20 o 0 278.6   34.4  ?      ?    1430.16 -31.6498     1051.87  -31.6498    352.763   -31.6498     
1 1 1 3  37 20 o 0 1272    58.4  ?      ?    2434.91 -137.232     3370.8   -137.232    2193.78   -137.232     
1 1 1 5  37 20 o 0 643.7   48.1  ?      ?    3649.55 124.153      1460.4   124.153     278.595   -55.8473     
1 1 1 7  37 20 o 0 341     42.9  ?      ?    1603.46 69.0552      1166.8   69.0552     417.169   69.0552      
1 1 1 9  37 20 o 0 313.1   42.8  ?      ?    2032.26 -168.321     960.962  -168.321    30.3813   -168.321     
1 1 1 11 37 20 o 0 431.5   47.6  ?      ?    3315.54 -106.377     903.038  -106.377    578.949   73.6228      
1 1 1 13 37 20 o 0 359.7   55.6  ?      ?    3075.4  -27.1501     741.065  -27.1501    595.973   152.85       
1 1 1 15 37 20 o 0 568.9   60.8  ?      ?    2558.39 94.0327      1439.97  94.0327     347.345   94.0327      
1 1 1 17 37 20 o 0 646.9   72    ?      ?    3810.2  102.36       1139.65  102.36      430.342   -77.6402     
1 1 1 19 37 20 o 0 2509.6  128.1 ?      ?    6003.71 -39.0251     2974.05  -39.0251    598.001   -39.0251     
1 1 1 20 21 37 o 0 170     81.2  ?      ?    2768.11 152.962      12.5298  152.962     1065.08   -27.0383     
1 1 1 20 23 37 o 0 -194.2  102.6 ?      ?    1604.3  -115.017     404.941  64.9831     1002.61   64.9831      
1 1 1 20 25 37 o 0 308.4   114.9 ?      ?    1527.17 -166.647     645.323  -166.647    100.153   -166.647     
1 1 1 20 27 37 o 0 493.2   148.2 ?      ?    1925.02 113.995      1061.04  113.995     415.744   113.995      
1 1 1 0  37 21 o 0 557.1   60.3  ?      ?    3643.2  -90          1581.49  -90         173.046   90           
1 1 1 2  37 21 o 0 201.7   39.6  ?      ?    2407.82 3.42792      412.925  3.42792     736.234   -176.572     
1 1 1 4  37 21 o 0 37.8    37.9  ?      ?    1465.81 47.1835      336.585  -132.816    1027.55   -132.816     
1 1 1 6  37 21 o 0 562.6   49.5  ?      ?    5618.98 90.1283      344.248  90.1283     2263.4    -89.8717     
1 1 1 8  37 21 o 0 233.2   44.8  ?      ?    1636.98 18.527       706.872  18.527      38.5924   -161.473     
1 1 1 10 37 21 o 0 788.2   57.1  ?      ?    3556.67 168.059      1721.37  168.059     137.345   168.059      
1 1 1 12 37 21 o 0 1371.6  74.8  ?      ?    4682.57 -120.583     2319.84  -120.583    287.492   -120.583     
1 1 1 14 37 21 o 0 172.6   60    ?      ?    1889.27 -84.3071     281.844  -84.3071    525.312   95.6929      
1 1 1 16 37 21 o 0 5018.2  204.6 ?      ?    9135.47 16.4304      4196.66  16.4304     422.785   16.4304      
1 1 1 18 37 21 o 0 743.4   82.3  ?      ?    2357.42 -132.968     1765.96  -132.968    828.421   -132.968     
1 1 1 20 37 21 o 0 129.4   86.3  ?      ?    1068.31 138.05       108.849  138.05      295.546   -41.9498     
1 1 1 21 22 37 o 0 402.1   108.5 ?      ?    1995.77 -105.271     943.144  -105.271    199.552   -105.271     
1 1 1 21 24 37 o 0 814.4   115.7 ?      ?    4030.15 15.3135      1252.24  15.3135     188.742   -164.686     
1 1 1 21 26 37 o 0 401.4   142.7 ?      ?    2353.9  -151.061     740.523  -151.061    50.9709   28.9391      
1 1 1 1  37 22 f 1 1360.8  66.3  ?      ?    3813.7  92.1154      2866.46  92.1154     1060.94   92.1154      
1 1 1 3  37 22 o 0 2460.3  94.5  ?      ?    5557.88 -65.1268     3747.1   -65.1268    1157.29   -65.1268     
1 1 1 5  37 22 o 0 423.2   46.9  ?      ?    1896.18 3.37949      1375.3   3.37949     503.689   3.37949      
1 1 1 7  37 22 o 0 5.8     47.3  ?      ?    1161.46 20.2882      304.737  -159.712    829.647   -159.712     
1 1 1 9  37 22 o 0 388     53.9  ?      ?    1685.36 -129.311     1249.41  -129.311    503.065   -129.311     
1 1 1 11 37 22 o 0 1324.8  77.6  ?      ?    3948.63 129.324      2524.01  129.324     816.602   129.324      
1 1 1 13 37 22 o 0 1096.4  76.4  ?      ?    5001.58 121.914      1622.24  121.914     510.939   -58.0864     
1 1 1 15 37 22 o 0 691.7   74.9  ?      ?    2322.73 -94.0124     1738.2   -94.0124    778.274   -94.0124     
1 1 1 17 37 22 o 0 361.6   74.5  ?      ?    1776.85 -66.5853     942.911  -66.5853    248.418   -66.5853     
1 1 1 19 37 22 f 1 1108.5  103.5 ?      ?    3779.9  126.086      1925.4   126.086     479.121   126.086      
1 1 1 21 37 22 o 0 -164.2  107.4 ?      ?    3144.45 -43.1312     773.665  136.869     1911.47   136.869      
1 1 1 22 23 37 o 0 228.7   135.7 ?      ?    1323.99 169.599      383.442  169.599     89.8455   -10.401      
1 1 1 22 25 37 o 0 117     132.9 ?      ?    905.353 -158.842     101.105  -158.842    203.698   21.1577      
1 1 1 22 27 37 o 0 -90.5   176.4 ?      ?    2170.98 130.835      210.939  -49.1653    908.175   -49.1653     
1 1 1 0  37 23 o 0 405.7   66.9  ?      ?    3933.63 -90          1286.86  -90         535.12    90           
1 1 1 2  37 23 o 0 534.4   50.2  ?      ?    3148.07 151.586      1297.19  151.586     149.376   -28.4138     
1 1 1 4  37 23 o 0 26.2    45.2  ?      ?    1514.88 -17.2925     353.861  162.708     1042.01   162.708      
1 1 1 6  37 23 o 0 495     51.4  ?      ?    2444.58 -110.031     1400.6   -110.031    306.575   -110.031     
1 1 1 8  37 23 o 0 299.8   52.1  ?      ?    1956.1  -78.4087     884.93   -78.4087    25.4328   -78.4087     
1 1 1 10 37 23 f 1 61.5    58.8  ?      ?    957.011 -178.607     93.2903  1.39345     512.772   1.39345      
1 1 1 12 37 23 o 0 1061.7  76.8  ?      ?    3883.74 33.1482      1989.93  33.1482     339.805   33.1482      
1 1 1 14 37 23 o 0 149.9   66.5  ?      ?    751.32  113.895      184.655  113.895     125.321   -66.1053     
1 1 1 16 37 23 o 0 426.5   77.5  ?      ?    3110.96 -25.7864     807.754  -25.7864    408.815   154.214      
1 1 1 18 37 23 o 0 55.8    93.4  ?      ?    882.194 162.226      38.3609  -17.7736    374.978   -17.7736     
1 1 1 20 37 23 o 0 243.9   106.3 ?      ?    1028.01 0.957121     401.712  0.957121    27.7289   0.957121     
1 1 1 22 37 23 o 0 1204.6  138.4 ?      ?    3679.34 -162.782     1921.25  -162.782    644.987   -162.782     
1 1 1 23 24 37 o 0 67.7    136.9 ?      ?    1406.81 122.089      20.5463  122.089     452.793   -57.9106     
1 1 1 23 26 37 o 0 681.7   177.3 ?      ?    2637.14 -44.7942     1192.59  -44.7942    344.906   -44.7942     
1 1 1 1  37 24 o 0 13.4    51.8  ?      ?    1409.49 22.0084      335.092  -157.992    972.174   -157.992     
1 1 1 3  37 24 o 0 1180.5  67.2  ?      ?    3520    144.926      2531.52  144.926     955.1     144.926      
1 1 1 5  37 24 o 0 168.2   52.2  ?      ?    3055.94 -57.8257     1.91557  -57.8256    1349.3    122.174      
1 1 1 7  37 24 o 0 278.4   57.4  ?      ?    2686.49 -137.92      558.461  -137.92     626.443   42.0801      
1 1 1 9  37 24 o 0 634.9   67.7  ?      ?    2785.26 85.7817      1542.42  85.7817     338.067   85.7817      
1 1 1 11 37 24 o 0 74.4    67.8  ?      ?    2977.14 -98.128      485.531  81.872      1742.98   81.872       
1 1 1 13 37 24 o 0 279.5   71    ?      ?    2726.15 -3.36454     501.688  -3.36454    618.753   176.635      
1 1 1 15 37 24 o 0 1272.7  96.8  ?      ?    6195.15 -160.52      1379.16  -160.52     1039.55   19.4803      
1 1 1 17 37 24 o 0 -11.4   83.3  ?      ?    2023.68 -6.66499     389.476  173.335     1162.16   173.335      
1 1 1 19 37 24 o 0 -93.2   98    ?      ?    2206.92 -149.441     489.465  30.5595     1294.82   30.5595      
1 1 1 21 37 24 o 0 533.9   132.1 ?      ?    2150.21 9.6559       1162.33  9.6559      412.244   9.6559       
1 1 1 23 37 24 o 0 553.6   154.9 ?      ?    1952.01 151.574      1157.44  151.574     520.434   151.574      
1 1 1 24 25 37 o 0 561.6   179.6 ?      ?    3532.96 -77.5249     693.582  -77.5249    440.888   102.475      
1 1 1 0  37 25 o 0 347     78.6  ?      ?    3892.22 -90          1121.05  -90         628.855   90           
1 1 1 2  37 25 o 0 1305.7  72.1  ?      ?    3984.02 10.1396      2493.21  10.1396     714.168   10.1396      
1 1 1 4  37 25 o 0 671.9   67.2  ?      ?    2471.86 -171.808     1770.08  -171.808    677.826   -171.808     
1 1 1 6  37 25 o 0 445.6   59.9  ?      ?    2806.94 -8.93776     1052.58  -8.93776    170.336   171.062      
1 1 1 8  37 25 o 0 686.9   71.7  ?      ?    3152.17 127.169      1519.28  127.169     170.092   127.169      
1 1 1 10 37 25 f 1 395.3   75.8  ?      ?    972.741 26.1571      1069.54  26.1571     659.695   26.1571      
1 1 1 12 37 25 o 0 1200.4  94.2  ?      ?    4279.55 -130.528     2012.75  -130.528    299.043   -130.528     
1 1 1 14 37 25 o 0 2098.4  122.8 ?      ?    5590.05 52.431       2741.62  52.431      538.193   52.431       
1 1 1 16 37 25 f 1 876.4   100.7 ?      ?    6137.96 162.887      691.78   162.887     1661.47   -17.1133     
1 1 1 18 37 25 o 0 14      105.9 ?      ?    2731.36 -69.8081     428.249  110.192     1425.84   110.192      
1 1 1 20 37 25 o 0 127     135   ?      ?    3928.31 -150.974     399.086  29.0261     1774.08   29.0261      
1 1 1 22 37 25 o 0 416.3   155.9 ?      ?    1876.98 -20.9935     815.732  -20.9935    199.518   -20.9935     
1 1 1 24 37 25 o 0 338.9   170.4 ?      ?    1135.14 106.674      503.264  106.674     149.765   106.674      
1 1 1 1  37 26 o 0 646.1   65.1  ?      ?    2359.91 -146.294     1728.65  -146.294    695.011   -146.294     
1 1 1 3  37 26 o 0 851.1   71.8  ?      ?    3532.59 33.331       1759.92  33.331      225.142   33.331       
1 1 1 5  37 26 o 0 910.6   75.6  ?      ?    5643.47 -150.481     1023.22  -150.481    1399.75   29.5193      
1 1 1 7  37 26 o 0 729.8   72.2  ?      ?    3442.05 54.5568      1489.81  54.5568     34.7912   54.5568      
1 1 1 9  37 26 o 0 1588.3  101.9 ?      ?    4873.02 -94.8273     2391.85  -94.8273    371.189   -94.8273     
1 1 1 11 37 26 o 0 331.9   79.7  ?      ?    2413.41 129.906      742.689  129.906     215.876   -50.094      
1 1 1 13 37 26 f 1 -77.3   82.4  ?      ?    873.415 -95.0572     207.961  84.9428     552.112   84.9428      
1 1 1 15 37 26 o 0 286.6   94.8  ?      ?    1937.81 -21.95       615.96   -21.95      120.057   158.05       
1 1 1 17 37 26 o 0 1389.3  130.7 ?      ?    5624.31 113.872      1637.38  113.872     413.98    -66.1283     
1 1 1 19 37 26 o 0 -44.7   130.8 ?      ?    2243.99 144.6        293.671  -35.4       1079.97   -35.4        
1 1 1 21 37 26 o 0 486.7   155.1 ?      ?    3064.24 121.687      755.98   121.687     253.71    -58.3131     
1 1 1 23 37 26 o 0 1478.6  219.9 ?      ?    4129.68 -85.2015     1895.05  -85.2015    600.769   -85.2015     
1 1 1 0  37 27 o 0 689     119.3 ?      ?    3048.33 90           1520.42  90          214.361   90           
1 1 1 2  37 27 o 0 495     72.1  ?      ?    2509.51 -154.152     1253.18  -154.152    183.945   -154.152     
1 1 1 4  37 27 o 0 449.1   71.3  ?      ?    3157.82 30.392       903.317  30.392      429.466   -149.608     
1 1 1 6  37 27 o 0 1441.7  92.8  ?      ?    4798.9  172.661      2216.74  172.661     217.994   172.661      
1 1 1 8  37 27 o 0 553.3   76.4  ?      ?    3076.75 -42.3032     1172.32  -42.3032    62.5174   137.697      
1 1 1 10 37 27 f 1 1308.3  102.4 ?      ?    5389.76 124.364      1753.9   124.364     405.278   -55.6358     
1 1 1 12 37 27 o 0 148.7   92.7  ?      ?    589.962 97.9285      119.123  97.9285     110.145   -82.0715     
1 1 1 14 37 27 f 1 65.3    99.7  ?      ?    1334.3  -77.6386     63.5542  102.361     567.627   102.361      
1 1 1 16 37 27 o 0 132.6   114.8 ?      ?    1198.79 -79.3145     119.942  -79.3145    315.716   100.685      
1 1 1 18 37 27 o 0 736.4   140.6 ?      ?    3666.6  23.5771      1189.34  23.5771     93.9183   -156.423     
1 1 1 20 37 27 o 0 1346.4  178.9 ?      ?    5178.49 21.1454      1593.98  21.1454     114.684   -158.855     
1 1 1 22 37 27 o 0 1210.3  216.4 ?      ?    4179.96 140.725      1545.62  140.725     230.326   140.725      
1 1 1 1  37 28 o 0 76      76.9  ?      ?    766.719 4.82117      25.135   -175.179    338.305   -175.179     
1 1 1 3  37 28 o 0 225.3   82    ?      ?    1923.79 -139.076     440.213  -139.076    340.132   40.9243      
1 1 1 5  37 28 o 0 764.5   85.7  ?      ?    3728.89 -9.71429     1422.42  -9.71429    73.7875   170.286      
1 1 1 7  37 28 o 0 72.6    79.2  ?      ?    1668.19 125.747      129.499  -54.2528    797.947   -54.2528     
1 1 1 9  37 28 o 0 613.5   93.4  ?      ?    3146.68 -22.2623     1255.05  -22.2623    17.3804   -22.2623     
1 1 1 11 37 28 o 0 496.2   98.6  ?      ?    3283.89 54.1371      907.249  54.1371     355.637   -125.863     
1 1 1 13 37 28 o 0 -72.8   94    ?      ?    2143.05 -108.366     472.523  71.6338     1271.01   71.6338      
1 1 1 15 37 28 o 0 -26.6   112.5 ?      ?    1492.82 -97.7922     193.738  82.2078     733.079   82.2078      
1 1 1 17 37 28 o 0 794.2   141.7 ?      ?    3290.65 73.9754      1410.46  73.9754     281.56    73.9754      
1 1 1 19 37 28 o 0 2095.6  193.9 ?      ?    4954.41 -79.2821     2529.99  -79.2821    896.83    -79.2821     
1 1 1 0  37 29 o 0 81.5    133.7 ?      ?    205.733 90           30.8771  90          52.1849   -90          
1 1 1 2  37 29 o 0 1134.7  97.3  ?      ?    5154.78 0.877903     1587.55  0.877903    484.73    -179.122     
1 1 1 4  37 29 o 0 911.7   96.5  ?      ?    4857.23 -148.629     1288.1   -148.629    648.322   31.3708      
1 1 1 6  37 29 f 1 853.8   101   ?      ?    4354.85 59.9641      1330.35  59.9641     394.224   -120.036     
1 1 1 8  37 29 o 0 955.8   106.2 ?      ?    3981.63 -148.755     1634.68  -148.755    92.0296   -148.755     
1 1 1 10 37 29 o 0 70.1    109.8 ?      ?    1668.58 -149.419     81.9762  30.5808     712.315   30.5808      
1 1 1 12 37 29 o 0 -69.3   111   ?      ?    515.647 13.4242      79.8821  -166.576    270.006   -166.576     
1 1 1 14 37 29 o 0 186.9   119.4 ?      ?    2053.94 -88.1973     219.216  -88.1973    516.837   91.8027      
1 1 1 16 37 29 o 0 37.6    141.2 ?      ?    1473.86 22.3476      20.7272  -157.652    523.456   -157.652     
1 1 1 18 37 29 o 0 22.6    166.4 ?      ?    871.374 33.4191      33.2216  33.4191     253.08    -146.581     
1 1 1 1  37 30 f 1 977.9   112.2 ?      ?    2458.82 -146.909     2170.8   -146.91     1201.36   -146.91      
1 1 1 3  37 30 o 0 397.9   98.7  ?      ?    1682.13 -18.0496     1038.17  -18.0496    382.441   -18.0496     
1 1 1 5  37 30 o 0 148     94    ?      ?    2209.81 -4.47966     39.9449  -4.47966    808.765   175.52       
1 1 1 7  37 30 o 0 65.5    99.6  ?      ?    1462.27 129.462      84.5315  -50.5383    638.427   -50.5383     
1 1 1 9  37 30 o 0 -110.7  115.8 ?      ?    1922.01 98.4546      379.493  -81.5454    1094.65   -81.5454     
1 1 1 11 37 30 o 0 1163.9  144.1 ?      ?    3236.39 109.038      2088.51  109.038     910.397   109.038      
1 1 1 13 37 30 o 0 2001.2  169.8 ?      ?    5118.61 -125.726     2516.06  -125.726    700.803   -125.726     
1 1 1 15 37 30 o 0 1898.6  170   ?      ?    4536.34 45.5905      2521.34  45.5905     986.404   45.5905      
1 1 1 17 37 30 o 0 1811    194.4 ?      ?    4315.78 -76.8651     2368.46  -76.8651    958.336   -76.8651     
1 1 1 0  37 31 o 0 -502.4  188   ?      ?    490.239 90           19.257   90          166.703   -90          
1 1 1 2  37 31 o 0 257.9   117   ?      ?    1371.96 26.2344      488.526  26.2344     30.3606   -153.766     
1 1 1 4  37 31 o 0 411.7   117.3 ?      ?    1465.27 -100.717     1003.69  -100.717    453.472   -100.717     
1 1 1 6  37 31 o 0 154.7   108.1 ?      ?    1058.63 -155.421     170.801  -155.421    222.246   24.5788      
1 1 1 8  37 31 o 0 55.4    130.8 ?      ?    1892.6  24.0363      71.7092  -155.964    763.647   -155.964     
1 1 1 10 37 31 o 0 719     147.3 ?      ?    3674.5  -27.6686     1178.36  -27.6686    139.063   152.331      
1 1 1 12 37 31 o 0 129.4   155.8 ?      ?    2416.08 116.064      41.1682  116.064     790.912   -63.9358     
1 1 1 14 37 31 o 0 865.5   173.7 ?      ?    2864.98 -82.5358     1573.06  -82.5358    613.652   -82.5358     
1 1 1 16 37 31 o 0 -70.5   170.4 ?      ?    2933.85 77.9317      367.279  -102.068    1318.32   -102.068     
1 1 1 1  37 32 o 0 1119.4  132.7 ?      ?    3260.55 -79.8505     2041.61  -79.8505    842.491   -79.8505     
1 1 1 3  37 32 o 0 -39.1   131.8 ?      ?    404.35  -87.5856     29.4067  92.4144     177.455   92.4144      
1 1 1 5  37 32 o 0 470.9   131.9 ?      ?    3043.7  108.494      851.744  108.494     253.024   -71.5064     
1 1 1 7  37 32 o 0 415.9   135.1 ?      ?    2864.54 -75.8502     724.688  -75.8502    284.93    104.15       
1 1 1 9  37 32 f 1 46.6    158.2 ?      ?    1131.52 -110.272     46.7771  -110.272    347.504   69.7282      
1 1 1 11 37 32 o 0 184.6   162.5 ?      ?    2410.22 -18.0789     171.074  -18.0789    646.475   161.921      
1 1 1 13 37 32 o 0 281.8   175.6 ?      ?    2655.25 -128.768     301.402  -128.768    576.511   51.2325      
1 1 1 0  37 33 o 0 448.8   241   ?      ?    2815.27 -90          819.651  -90         167.758   90           
1 1 1 2  37 33 o 0 299.1   156.8 ?      ?    2988.63 109.91       337.716  109.91      708.839   -70.0904     
1 1 1 4  37 33 o 0 738.2   156.1 ?      ?    4124.71 -171.226     1058.81  -171.226    376.979   8.77388      
1 1 1 6  37 33 o 0 -362.2  152.9 ?      ?    2320.54 27.6002      499.081  -152.4      1298.61   -152.4       
1 1 1 8  37 33 o 0 158.2   156.3 ?      ?    1461.96 173.077      215.849  173.077     280.609   -6.92333     
1 1 1 10 37 33 o 0 1081.6  173.1 ?      ?    3013.7  -85.5325     1852.06  -85.5325    847.689   -85.5325     
1 1 1 1  37 34 o 0 692.3   219   ?      ?    2416.05 -157.166     1288.86  -157.166    468.571   -157.166     
1 1 1 3  37 34 f 1 1906    192.4 ?      ?    4406.34 66.2132      2545.52  66.2132     1045.74   66.2132      
1 1 1 5  37 34 o 0 37.9    164.3 ?      ?    348.629 -37.6216     22.677   -37.6216    94.4326   142.378      
1 1 1 7  37 34 o 0 872.5   175.7 ?      ?    4326.78 -31.6084     1119.91  -31.6084    316.361   148.392      
1 1 1 0  38 0  o 0 1295.5  96.1  ?      ?    2992.91 180          2663.2   180         1094.14   -180         
1 1 1 0  2  38 f 1 415     30.3  ?      ?    3988.69 5.09486e-14  1450.04  0           561.425   -180         
1 1 1 0  4  38 o 0 2705.7  122.5 ?      ?    8181.83 180          3714.7   180         401.323   -1.02614e-13 
1 1 1 0  6  38 o 0 3250.5  144.8 ?      ?    6716.31 -6.31361e-15 4066.85  0           690.898   3.08503e-14  
1 1 1 0  8  38 o 0 4159    200.3 ?      ?    8381.46 180          4571.3   180         378.981   -180         
1 1 1 0  10 38 o 0 1255.3  66.9  ?      ?    4522.14 8.2378e-15   2494.45  0           252.796   -7.30482e-14 
1 1 1 0  12 38 o 0 -25.7   23.7  ?      ?    380.405 -5.51278e-14 6.70523  0           179.406   180          
1 1 1 0  14 38 o 0 166.6   28.7  ?      ?    49.6735 -2.44855e-13 29.3412  0           5.03046   1.18332e-12  
1 1 1 0  16 38 o 0 232.5   34.6  ?      ?    1979.78 180          930.622  180         17.8152   2.51346e-13  
1 1 1 0  18 38 o 0 24.3    35.7  ?      ?    2056.22 180          126.385  180         833.869   -3.22658e-14 
1 1 1 0  20 38 f 1 332.3   52.4  ?      ?    2079.89 180          1080.05  180         133.168   -180         
1 1 1 0  22 38 o 0 38.6    56    ?      ?    413.353 180          35.7164  180         145.206   -6.88359e-14 
1 1 1 0  24 38 o 0 3828.2  199.5 ?      ?    7023.59 5.55793e-15  3636.27  0           634.93    -2.62726e-14 
1 1 1 0  26 38 o 0 1237.4  119.5 ?      ?    4130.86 180          1976.33  180         283.448   180          
1 1 1 0  28 38 o 0 1201.6  128.6 ?      ?    1803.6  -2.53632e-14 1859.45  0           1158.15   1.53583e-14  
1 1 1 0  30 38 o 0 -233.2  130.1 ?      ?    1364.53 -4.07431e-14 48.0569  0           454.146   180          
1 1 1 0  32 38 o 0 145.7   163.7 ?      ?    96.5072 -180         17.6111  180         15.4925   1.59548e-12  
1 1 1 1  38 1  o 0 835.2   33.4  ?      ?    3321.49 164.975      2367.15  164.975     629.411   164.975      
1 1 1 1  3  38 f 1 267.7   17.5  ?      ?    2144.58 -63.2473     947.506  -63.2473    136.031   116.753      
1 1 1 1  5  38 o 0 433.5   21.6  ?      ?    2987.24 113.337      1264.14  113.337     238.143   -66.6631     
1 1 1 1  7  38 o 0 332.7   20.7  ?      ?    2048.43 -149.948     1253.48  -149.948    226.425   -149.948     
1 1 1 1  9  38 o 0 205.2   19.4  ?      ?    2425.35 102.459      548.846  102.459     658.648   -77.5407     
1 1 1 1  11 38 o 0 42.1    17.1  ?      ?    704.761 -37.9382     122.514  142.062     469.512   142.062      
1 1 1 1  13 38 f 1 -19.1   18.5  ?      ?    1158.66 112.287      492.94   -67.7132    1058      -67.7132     
1 1 1 1  15 38 o 0 49.1    19.9  ?      ?    1486.6  -107.848     280.443  72.1523     1000.16   72.1523      
1 1 1 1  17 38 o 0 1561.8  57.5  ?      ?    4080.57 63.5756      3138.71  63.5756     1208.74   63.5756      
1 1 1 1  19 38 o 0 1084.4  54.5  ?      ?    2726.37 -147.99      2750.37  -147.99     1495.78   -147.99      
1 1 1 1  21 38 o 0 2055.5  86.4  ?      ?    5030.07 51.971       3271.43  51.971      1031.86   51.971       
1 1 1 1  23 38 o 0 123.1   44.2  ?      ?    1980.5  -67.0595     61.5318  -67.0595    789.455   112.941      
1 1 1 1  25 38 o 0 531.8   58    ?      ?    3498.12 -102.668     1001.4   -102.668    463.387   77.3315      
1 1 1 1  27 38 f 1 264.3   63.4  ?      ?    1499.12 158.94       653.924  158.94      61.5851   158.94       
1 1 1 1  29 38 o 0 -47.6   74    ?      ?    2095.72 -91.9278     506.203  88.0722     1301.86   88.0722      
1 1 1 1  31 38 o 0 195.2   103.1 ?      ?    2308.74 147.607      198.359  147.607     629.844   -32.3928     
1 1 1 1  33 38 o 0 175.6   210.5 ?      ?    1530.02 -17.7558     300.092  -17.7558    210.555   162.244      
1 1 1 0  38 2  f 1 -14     22.7  ?      ?    545.59  -180         12.6003  180         277.24    5.16094e-13  
1 1 1 2  38 2  o 0 542.2   24.4  ?      ?    4228.57 137.679      1095.81  137.679     1108.31   -42.3207     
1 1 1 2  4  38 o 0 175     15.9  ?      ?    1646.25 -47.3406     629.277  -47.3406    197.791   132.659      
1 1 1 2  6  38 o 0 1867    61.9  ?      ?    4399.76 84.8591      3816.3   84.8591     1608.53   84.8591      
1 1 1 2  8  38 o 0 297.3   19.8  ?      ?    3533.73 2.76918      505.817  2.76918     1258.23   -177.231     
1 1 1 2  10 38 o 0 925.3   37.2  ?      ?    3659.63 -4.41219     2301.92  -4.41219    491.703   -4.41219     
1 1 1 2  12 38 o 0 440.7   25.6  ?      ?    2264.54 -155.916     1533.06  -155.916    427.592   -155.916     
1 1 1 2  14 38 o 0 18.1    19.3  ?      ?    1268.38 109.888      433.634  -70.1116    1053.04   -70.1116     
1 1 1 2  16 38 o 0 348.5   26.8  ?      ?    2923.12 -162.392     869.891  -162.392    527.562   17.608       
1 1 1 2  18 38 o 0 2249.6  77.8  ?      ?    5764.03 33.5443      3382.63  33.5443     695.893   33.5443      
1 1 1 2  20 38 o 0 939.1   51.7  ?      ?    4436.15 65.9369      1716.01  65.9369     288.965   -114.063     
1 1 1 2  22 38 o 0 5671.8  197.9 ?      ?    9577.56 -88.7732     4933.85  -88.7732    747.313   -88.7732     
1 1 1 2  24 38 o 0 1718.8  82.4  ?      ?    5515.2  116.521      2403.41  116.521     48.8849   116.521      
1 1 1 2  26 38 o 0 75.6    53.1  ?      ?    1127.41 -61.7021     75.008   118.298     536.776   118.298      
1 1 1 2  28 38 o 0 1030    83.5  ?      ?    4283.47 144.681      1675.79  144.681     10.4575   144.681      
1 1 1 2  30 38 o 0 773.6   94.1  ?      ?    3025.18 -14.2952     1533.02  -14.2952    419.296   -14.2952     
1 1 1 2  32 38 o 0 1963.7  174.7 ?      ?    5124.35 91.4064      2446.76  91.4064     687.689   91.4064      
1 1 1 1  38 3  f 1 470.4   23.5  ?      ?    3139.27 12.5813      1375.58  12.5813     285.257   -167.419     
1 1 1 3  38 3  o 0 326.6   19.1  ?      ?    2798.62 76.0851      978.044  76.0851     472.963   -103.915     
1 1 1 3  5  38 o 0 312.8   19.9  ?      ?    3442.15 9.57114      612.643  9.57114     1113.44   -170.429     
1 1 1 3  7  38 o 0 445.4   23.4  ?      ?    2971.39 -93.7442     1303.16  -93.7442    181.848   86.2558      
1 1 1 3  9  38 o 0 175.8   18.8  ?      ?    2692.33 -105.063     291.481  -105.063    1044.26   74.9369      
1 1 1 3  11 38 o 0 1507.9  54.2  ?      ?    4838.71 -87.2115     2918.48  -87.2115    544.772   -87.2115     
1 1 1 3  13 38 o 0 2685.6  90.5  ?      ?    7040.27 48.3005      3630.13  48.3004     228.707   48.3004      
1 1 1 3  15 38 o 0 2843.6  93.6  ?      ?    4547.33 -153.197     4847.28  -153.197    2653.95   -153.197     
1 1 1 3  17 38 o 0 1964.1  68.6  ?      ?    3972.17 -14.625      3805.44  -14.625     1933.58   -14.625      
1 1 1 3  19 38 o 0 120.1   29.6  ?      ?    677.911 -48.3896     154.101  -48.3896    156.301   131.61       
1 1 1 3  21 38 f 1 466.2   43.5  ?      ?    3432.4  111.025      948.876  111.025     582.945   -68.9752     
1 1 1 3  23 38 o 0 668.4   52.6  ?      ?    3799.77 -86.4392     1263.7   -86.4392    386.683   93.5608      
1 1 1 3  25 38 f 1 403.8   51.9  ?      ?    4116.75 55.8594      418.67   55.8594     1310.19   -124.141     
1 1 1 3  27 38 o 0 50.6    55.8  ?      ?    883.611 140.697      118.693  -39.3034    465.042   -39.3034     
1 1 1 3  29 38 o 0 501.5   78.3  ?      ?    2982.88 32.9459      1004.79  32.9459     119.694   -147.054     
1 1 1 3  31 38 o 0 1024.4  115.8 ?      ?    4370.37 -108.738     1507.94  -108.738    57.2479   71.2624      
1 1 1 3  33 38 o 0 86      126.4 ?      ?    2551.82 41.9404      140.156  -138.06     990.764   -138.06      
1 1 1 0  38 4  o 0 128.3   22.2  ?      ?    1197.08 180          552.482  180         82.0582   3.26137e-14  
1 1 1 2  38 4  o 0 427.4   22.6  ?      ?    3116.79 -60.4008     1234.42  -60.4008    395.843   119.599      
1 1 1 4  38 4  o 0 856     33.6  ?      ?    2864.56 -26.5409     2585.83  -26.5409    1110.92   -26.5409     
1 1 1 4  6  38 o 0 75.4    15.7  ?      ?    1020.85 95.7632      55.8503  95.7632     454.168   -84.2368     
1 1 1 4  8  38 o 0 2398.1  77.5  ?      ?    7935.82 -160.611     2895.46  -160.611    1047.47   19.3888      
1 1 1 4  10 38 o 0 910.4   37.3  ?      ?    3608.87 171.768      2278.63  171.768     502.385   171.768      
1 1 1 4  12 38 o 0 1168    46.1  ?      ?    3840.58 -62.9744     2699.24  -62.9744    834.052   -62.9744     
1 1 1 4  14 38 o 0 493.7   29.2  ?      ?    2867.58 129.423      1391.07  129.423     1.95629   -50.5767     
1 1 1 4  16 38 f 1 253.1   25.6  ?      ?    1244.2  -115.541     918.123  -115.541    323.099   -115.541     
1 1 1 4  18 38 o 0 785.1   41.2  ?      ?    2687.88 -66.3207     2149.74  -66.3207    903.398   -66.3207     
1 1 1 4  20 38 o 0 522.4   41.1  ?      ?    3965.62 114.856      918.254  114.856     864.9     -65.1442     
1 1 1 4  22 38 o 0 1607.4  73.1  ?      ?    5048.89 -19.4816     2551.31  -19.4816    355.257   -19.4816     
1 1 1 4  24 38 o 0 1079.3  64.9  ?      ?    2606.89 179.971      2481     179.971     1373.36   179.971      
1 1 1 4  26 38 o 0 165.5   43.8  ?      ?    1101.44 -37.2778     280.059  -37.2778    160.131   142.722      
1 1 1 4  28 38 o 0 279.9   93.7  ?      ?    2439.58 38.907       500.233  38.907      444.216   -141.093     
1 1 1 4  30 38 o 0 179.1   51.2  ?      ?    2445.7  -165.321     168.038  -165.321    728.811   14.6794      
1 1 1 4  32 38 o 0 438     91.8  ?      ?    2067.79 -137.85      980.818  -137.85     273.562   -137.85      
1 1 1 1  38 5  o 0 1311.6  47.1  ?      ?    4564.16 -172.985     2879.17  -172.985    474.751   -172.985     
1 1 1 3  38 5  o 0 8.9     15.4  ?      ?    821.71  69.7349      329.538  -110.265    756.185   -110.265     
1 1 1 5  38 5  o 0 1146.4  40.1  ?      ?    3920.17 -49.0772     2754.48  -49.0772    753.269   -49.0772     
1 1 1 5  7  38 o 0 3431.2  108.1 ?      ?    7976.17 128.271      4226.4   128.271     263.415   128.271      
1 1 1 5  9  38 f 1 107.7   18.9  ?      ?    707.914 92.2425      224.738  92.2425     126.281   -87.7575     
1 1 1 5  11 38 o 0 1612.4  57.7  ?      ?    4869.66 105.531      3068.79  105.531     695.283   105.531      
1 1 1 5  13 38 o 0 910.1   39.3  ?      ?    3270.74 -134.265     2319.24  -134.265    721.652   -134.265     
1 1 1 5  15 38 o 0 1741.4  63.2  ?      ?    5432.26 16.4398      2865.65  16.4398     263.193   16.4398      
1 1 1 5  17 38 o 0 1964    72.7  ?      ?    4286.74 148.325      3643     148.325     1636.68   148.325      
1 1 1 5  19 38 o 0 2519.5  91.4  ?      ?    5815.42 -39.3997     3622.67  -39.3997    978.053   -39.3997     
1 1 1 5  21 38 f 1 1227.8  59.8  ?      ?    4208.75 -177.167     2298.66  -177.167    433.053   -177.167     
1 1 1 5  23 38 o 0 -30     49.3  ?      ?    563.341 109.637      169.781  -70.3627    412.833   -70.3627     
1 1 1 5  25 38 o 0 474.4   67    ?      ?    3112.63 -163.428     974.029  -163.428    317.349   16.5722      
1 1 1 5  27 38 o 0 1723.5  107.5 ?      ?    5119.47 16.4496      2445.2   16.4496     424.389   16.4496      
1 1 1 5  29 38 o 0 1121.2  125.2 ?      ?    5108.4  173.784      1453.87  173.784     460.111   -6.21614     
1 1 1 5  31 38 f 1 862.9   166.4 ?      ?    1729.08 -56.6056     1893.83  -56.6056    1274.75   -56.6056     
1 1 1 5  33 38 f 1 218.9   221.2 ?      ?    2721.85 140.621      181.427  140.621     725.841   -39.3789     
1 1 1 0  38 6  o 0 240.6   25.6  ?      ?    986.369 2.41441e-14  828.85   0           306.417   -4.11651e-14 
1 1 1 2  38 6  o 0 287.8   19.1  ?      ?    3416.83 65.9006      542.66   65.9006     1243.36   -114.099     
1 1 1 4  38 6  o 0 103.1   16.3  ?      ?    1094.9  110.939      242.758  110.939     320.658   -69.0611     
1 1 1 6  38 6  o 0 578.7   26.9  ?      ?    2879.75 126.01       1782.3   126.01      327.121   126.01       
1 1 1 6  8  38 o 0 3125.9  98.7  ?      ?    6960.4  -4.25843     4313.83  -4.25843    880.786   -4.25843     
1 1 1 6  10 38 f 1 809.4   34.3  ?      ?    4400.04 -179.916     1655.09  -179.916    506.137   0.0841755    
1 1 1 6  12 38 o 0 1986.1  69.1  ?      ?    4992.48 1.63443      3580.89  1.63443     1175.51   1.63443      
1 1 1 6  14 38 o 0 855.6   39.4  ?      ?    3320.87 -147.143     2142.62  -147.143    542.54    -147.143     
1 1 1 6  16 38 o 0 1606.6  60.6  ?      ?    4178.05 72.1389      3161.05  72.1389     1190.68   72.1389      
1 1 1 6  18 38 o 0 1450.9  66    ?      ?    4329.15 -105.085     2759.8   -105.085    769.294   -105.085     
1 1 1 6  20 38 o 0 -26.9   41.2  ?      ?    1203.29 115.243      397.468  -64.7569    933.959   -64.7569     
1 1 1 6  22 38 o 0 364.9   53    ?      ?    2165.99 49.2549      1040.26  49.2549     106.108   49.2549      
1 1 1 6  24 38 o 0 804.9   70.6  ?      ?    3296.12 131.574      1698.69  131.574     309.969   131.574      
1 1 1 6  26 38 o 0 244.6   76.3  ?      ?    2340.37 -49.6254     458.156  -49.6254    469.402   130.375      
1 1 1 6  28 38 f 1 815     103.1 ?      ?    2252.29 158.278      1883.65  158.278     1013.96   158.278      
1 1 1 6  30 38 o 0 1351.4  145.9 ?      ?    3641.47 13.4793      2235.8   13.4793     911.21    13.4793      
1 1 1 6  32 38 o 0 267.7   190.8 ?      ?    1448.86 -166.139     470.17   -166.139    21.4834   13.8614      
1 1 1 1  38 7  o 0 625.5   27.2  ?      ?    2224.85 -45.2909     2268.97  -45.2909    1100.23   -45.2909     
1 1 1 3  38 7  o 0 349.1   21.6  ?      ?    1930.9  38.1349      1399.18  38.1349     399.315   38.1349      
1 1 1 5  38 7  o 0 584.5   26.1  ?      ?    3391.65 175.623      1587.61  175.623     139.313   -4.37691     
1 1 1 7  38 7  o 0 1061.4  40    ?      ?    4455.83 -40.0439     2263.98  -40.0439    38.8785   -40.0439     
1 1 1 7  9  38 o 0 307.4   22.4  ?      ?    504.147 79.2922      871.555  79.2922     625.162   79.2922      
1 1 1 7  11 38 o 0 194.7   26.8  ?      ?    1450.75 96.0741      734.743  96.0742     34.1091   96.0742      
1 1 1 7  13 38 o 0 -8.7    24.3  ?      ?    1653.03 30.5001      645.552  -149.5      1445.34   -149.5       
1 1 1 7  15 38 o 0 70.6    27    ?      ?    1100.97 -76.32       51.9763  103.68      574.3     103.68       
1 1 1 7  17 38 o 0 856.8   47.2  ?      ?    2284.42 152.131      2453.55  152.131     1394.96   152.131      
1 1 1 7  19 38 o 0 407.1   41.6  ?      ?    2072.01 38.421       1255.96  38.421      323.16    38.421       
1 1 1 7  21 38 o 0 521.7   53.7  ?      ?    3965.63 69.8485      885.75   69.8485     844.488   -110.151     
1 1 1 7  23 38 o 0 2371.1  105.1 ?      ?    5845.2  -66.8331     3118.96  -66.8331    622.755   -66.8331     
1 1 1 7  25 38 o 0 160.6   70.4  ?      ?    2289.34 109.373      115.047  109.373     825.075   -70.6275     
1 1 1 7  27 38 o 0 221.4   85.9  ?      ?    1578.44 40.3087      438.05   40.3087     178.667   -139.691     
1 1 1 7  29 38 o 0 274.5   109.5 ?      ?    3154.79 -86.6333     234.157  -86.6333    935.896   93.3667      
1 1 1 7  31 38 o 0 110.8   175   ?      ?    1948.43 3.65638      127.612  3.65638     547.868   -176.344     
1 1 1 7  33 38 o 0 -159    252.1 ?      ?    1719.78 -153.915     44.4834  26.085      608.849   26.085       
1 1 1 0  38 8  o 0 442.6   31.9  ?      ?    3318.86 180          1573.04  180         175.873   -1.59805e-14 
1 1 1 2  38 8  o 0 462.4   24.5  ?      ?    3557.81 150.249      1148.13  150.249     702.572   -29.7514     
1 1 1 4  38 8  o 0 604.4   28.4  ?      ?    3017.32 -26.5985     1823.52  -26.5985    278.139   -26.5985     
1 1 1 6  38 8  o 0 103.8   20.1  ?      ?    662.02  150.959      200.133  150.959     132.861   -29.0412     
1 1 1 8  38 8  o 0 850.9   36.8  ?      ?    4193.36 142.781      1876.26  142.781     189.669   -37.2194     
1 1 1 8  10 38 o 0 217.9   23.5  ?      ?    1174.68 -101.153     857.424  -101.153    289.599   -101.153     
1 1 1 8  12 38 o 0 991.2   43.8  ?      ?    3138.71 28.5859      2536.62  28.5859     1014.01   28.5859      
1 1 1 8  14 38 o 0 1782.4  68.4  ?      ?    5727.73 -114.648     2779.77  -114.648    50.4487   -114.648     
1 1 1 8  16 38 o 0 311.5   31.9  ?      ?    2357.48 -18.763      918.68   -18.763     180.528   161.237      
1 1 1 8  18 38 o 0 275.2   36.6  ?      ?    2549.98 69.6163      660.062  69.6163     497.118   -110.384     
1 1 1 8  20 38 o 0 651.5   53.5  ?      ?    3435.25 9.7008       1434.25  9.7008      79.3759   -170.299     
1 1 1 8  22 38 o 0 320.7   56.4  ?      ?    1970.67 -138.962     893.637  -138.962    42.1606   -138.962     
1 1 1 8  24 38 o 0 777.7   74.3  ?      ?    2566.24 -175.329     1863.2   -175.329    794.96    -175.329     
1 1 1 8  26 38 f 1 158.1   85.4  ?      ?    2260.41 -80.1981     88.4932  -80.1981    801.563   99.8019      
1 1 1 8  28 38 f 1 776.4   110   ?      ?    3068.98 28.1915      1548.12  28.1915     383.341   28.1915      
1 1 1 8  30 38 o 0 1333.2  161.7 ?      ?    4508.03 -165.217     1905.41  -165.217    285.464   -165.217     
1 1 1 8  32 38 o 0 199     198.9 ?      ?    1121.08 -106.58      313.357  -106.58     62.4673   73.4203      
1 1 1 1  38 9  o 0 227     21.2  ?      ?    2764.68 14.9152      547.491  14.9152     894.547   -165.085     
1 1 1 3  38 9  o 0 179.2   20.9  ?      ?    2075.67 37.4708      550.674  37.4708     516.812   -142.529     
1 1 1 5  38 9  f 1 231.2   23.5  ?      ?    3873.55 -23.2921     51.2287  -23.2921    1918.96   156.708      
1 1 1 7  38 9  o 0 12.6    20.7  ?      ?    713.487 -75.5218     244.307  104.478     598.256   104.478      
1 1 1 9  38 9  o 0 238.6   24.2  ?      ?    2250.71 34.9631      753.545  34.9631     338.55    -145.037     
1 1 1 9  11 38 f 1 100.7   24.5  ?      ?    432.953 -132.845     95.0072  -132.845    116.453   47.1546      
1 1 1 9  13 38 o 0 377.8   30.6  ?      ?    2923.76 -150.035     971.708  -150.035    425.489   29.9645      
1 1 1 9  15 38 f 1 748.1   43    ?      ?    3069.85 126.386      1927.87  126.386     481.793   126.386      
1 1 1 9  17 38 o 0 2285    92.2  ?      ?    6229.97 -67.6828     3149.91  -67.6828    304.745   -67.6828     
1 1 1 9  19 38 o 0 867.2   61.1  ?      ?    3593.61 95.8127      1871.78  95.8127     275.448   95.8127      
1 1 1 9  21 38 o 0 414.8   57.1  ?      ?    2827.13 -83.7772     988.032  -83.7772    228.796   96.2228      
1 1 1 9  23 38 o 0 737     71.6  ?      ?    2845.89 77.7676      1710.47  77.7676     511.793   77.7676      
1 1 1 9  25 38 o 0 284.9   78.2  ?      ?    1410.56 -72.9003     715.553  -72.9003    155.675   -72.9003     
1 1 1 9  27 38 o 0 283.5   100.3 ?      ?    1598.12 8.78869      636.163  8.78869     20.4985   8.78869      
1 1 1 9  29 38 o 0 402.2   132.4 ?      ?    2399.14 138.828      790.096  138.828     87.1562   -41.1722     
1 1 1 9  31 38 o 0 -129.6  194.6 ?      ?    818.98  -122.296     24.7767  57.7042     304.678   57.7042      
1 1 1 0  38 10 o 0 231.3   29.4  ?      ?    587.379 2.08285e-14  535.505  0           228.888   -2.79016e-14 
1 1 1 2  38 10 o 0 670.6   30.4  ?      ?    4392.82 -68.9749     1387.34  -68.9749    877.02    111.025      
1 1 1 4  38 10 o 0 81.1    20.6  ?      ?    1014.23 125.158      93.931   125.158     420.947   -54.8416     
1 1 1 6  38 10 f 1 1275.4  51.2  ?      ?    3700.97 -171.6       3042.09  -171.6      1186.2    -171.6       
1 1 1 8  38 10 o 0 1453    57.2  ?      ?    5713.82 -73.2518     2398.31  -73.2518    392.609   106.748      
1 1 1 10 38 10 f 1 1384.2  56.8  ?      ?    3668.62 27.6833      3078.92  27.6833     1287.66   27.6833      
1 1 1 10 12 38 f 1 1538.3  61    ?      ?    3511.55 137.912      3371.69  137.912     1681.8    137.912      
1 1 1 10 14 38 o 0 629.1   36.9  ?      ?    2440.13 -143.006     1881.89  -143.006    735.406   -143.006     
1 1 1 10 16 38 o 0 570.7   43.8  ?      ?    2971.29 121.409      1489.36  121.409     123.884   121.409      
1 1 1 10 18 38 o 0 283.4   39.9  ?      ?    2798.7  14.0145      596.605  14.0145     654.709   -165.986     
1 1 1 10 20 38 o 0 1395.8  80.5  ?      ?    4287.1  -69.5047     2517.33  -69.5047    656.845   -69.5047     
1 1 1 10 22 38 o 0 2608.8  123.8 ?      ?    6132.07 169.242      3264.58  169.242     655.778   169.242      
1 1 1 10 24 38 o 0 272.5   78.3  ?      ?    2443.51 -51.9386     552.376  -51.9386    448.892   128.061      
1 1 1 10 26 38 o 0 120.3   91.6  ?      ?    1543.05 66.0927      64.0241  66.0927     538.587   -113.907     
1 1 1 10 28 38 o 0 658.7   114.2 ?      ?    3843.03 -40.8524     1041.78  -40.8524    385.353   139.148      
1 1 1 10 30 38 o 0 1000.9  181   ?      ?    3146.74 89.4411      1795.46  89.4411     701.194   89.4411      
1 1 1 10 32 38 o 0 521.9   238.5 ?      ?    2553.93 -144.727     761.609  -144.727    80.6095   35.2733      
1 1 1 1  38 11 o 0 483     28.1  ?      ?    2871.29 -28.5611     1515.84  -28.5611    35.2104   -28.5611     
1 1 1 3  38 11 o 0 21      21.6  ?      ?    1452.67 -175.301     466.309  4.69872     1205.16   4.69872      
1 1 1 5  38 11 o 0 455.6   28.2  ?      ?    2471.77 101.588      1542.63  101.588     305.958   101.588      
1 1 1 7  38 11 o 0 68.1    23.4  ?      ?    2475.88 49.4875      371.82   -130.513    1587.02   -130.513     
1 1 1 9  38 11 f 1 297.7   27.6  ?      ?    4174.96 125.641      144.598  125.641     1906.95   -54.359      
1 1 1 11 38 11 o 0 594.3   34.3  ?      ?    2493.58 -21.4411     1794.74  -21.4411    606.562   -21.4411     
1 1 1 11 13 38 o 0 460.8   35.1  ?      ?    3687.72 -102.529     913.204  -102.529    822.137   77.4714      
1 1 1 11 15 38 o 0 2971.2  107.3 ?      ?    5700.67 108.455      4281.24  108.455     1653.04   108.455      
1 1 1 11 17 38 o 0 312     40.4  ?      ?    2582.34 -27.1134     779.11   -27.1134    381.125   152.887      
1 1 1 11 19 38 o 0 559.3   47.1  ?      ?    3287.35 171.174      1249.09  171.174     186.962   -8.82581     
1 1 1 11 21 38 o 0 -13.6   14.5  ?      ?    988.878 -168.471     390.777  11.5287     814.992   11.5287      
1 1 1 11 23 38 o 0 1379.6  93.6  ?      ?    4556.99 68.4506      2201.04  68.4506     314.867   68.4506      
1 1 1 11 25 38 o 0 292.7   84.4  ?      ?    1935.36 -155.316     706.786  -155.316    58.0222   24.6844      
1 1 1 11 27 38 o 0 -148.8  110.2 ?      ?    1101.48 -88.4696     239.024  91.5304     653.672   91.5304      
1 1 1 11 29 38 o 0 714.5   158.7 ?      ?    3624.38 -57.1862     1170.48  -57.1862    130.791   122.814      
1 1 1 11 31 38 o 0 638     215.5 ?      ?    2691.17 36.2982      1105.17  36.2982     202.251   36.2982      
1 1 1 0  38 12 o 0 261.4   36.2  ?      ?    1203.67 -1.43385e-14 952.388  0           332.709   2.67059e-14  
1 1 1 2  38 12 o 0 -19.2   20.2  ?      ?    723.521 -95.7472     314.517  84.2528     682.507   84.2528      
1 1 1 4  38 12 o 0 112.2   23.6  ?      ?    954.452 143.001      285.506  143.001     192.744   -36.9995     
1 1 1 6  38 12 o 0 1120.8  45.1  ?      ?    3869.46 -96.2345     2625.45  -96.2345    720.543   -96.2345     
1 1 1 8  38 12 o 0 1047.2  43.8  ?      ?    4811.69 49.6859      1940.87  49.6859     421.004   -130.314     
1 1 1 10 38 12 f 1 791.4   39.6  ?      ?    3622.16 8.39001      1845.05  8.39001     98.5737   8.39001      
1 1 1 12 38 12 o 0 841.9   41.8  ?      ?    2815.39 -100.917     2245.74  -100.917    931.573   -100.917     
1 1 1 12 14 38 o 0 2715.5  100.2 ?      ?    5294.62 53.5967      4159.04  53.5967     1713.94   53.5967      
1 1 1 12 16 38 o 0 -19.4   35.3  ?      ?    1499.47 -92.2733     520.351  87.7267     1196.29   87.7267      
1 1 1 12 18 38 o 0 1143.2  64.5  ?      ?    3099.16 -168.177     2575.68  -168.177    1215.09   -168.177     
1 1 1 12 20 38 o 0 211.2   59.6  ?      ?    3094.07 112.048      145.3    112.048     1190.87   -67.9515     
1 1 1 12 22 38 o 0 1073    82.9  ?      ?    4246.93 -25.3618     1834.97  -25.3618    62.4076   -25.3618     
1 1 1 12 24 38 f 1 930.7   93    ?      ?    3961.07 10.1553      1622.75  10.1553     53.7781   10.1553      
1 1 1 12 26 38 o 0 666.6   106.4 ?      ?    3782.5  171.372      1123.5   171.372     324.617   -8.62827     
1 1 1 12 28 38 o 0 13.7    128.3 ?      ?    1818.64 -175.008     147.404  4.99201     809.261   4.99201      
1 1 1 12 30 38 o 0 -80.6   188.8 ?      ?    1021.96 -72.0606     15.0759  107.939     363.253   107.939      
1 1 1 1  38 13 f 1 1580.8  57.3  ?      ?    3093.99 -1.32486     3957.87  -1.32486    2378.55   -1.32486     
1 1 1 3  38 13 o 0 354.6   27.1  ?      ?    3626.87 -116.295     691.785  -116.295    1124.81   63.7055      
1 1 1 5  38 13 o 0 -9.4    23.6  ?      ?    269.376 148.689      109.012  -31.3114    244.133   -31.3114     
1 1 1 7  38 13 o 0 121.8   24.3  ?      ?    352.109 -172.03      132.57   -172.03     40.7353   7.96954      
1 1 1 9  38 13 o 0 955.4   41.4  ?      ?    3433.41 4.178        2317.48  4.178       664.197   4.178        
1 1 1 11 38 13 o 0 79.9    29.8  ?      ?    2768.04 -101.028     414.581  78.9721     1714.47   78.9721      
1 1 1 13 38 13 f 1 561.7   40.7  ?      ?    2919.59 -171.005     1469.22  -171.005    129.19    -171.005     
1 1 1 13 15 38 o 0 735.2   50.4  ?      ?    2278.04 -11.9351     2087.62  -11.9351    1058.9    -11.9351     
1 1 1 13 17 38 o 0 423.6   46.2  ?      ?    2016.95 -44.0167     1292.33  -44.0167    403.85    -44.0167     
1 1 1 13 19 38 f 1 -50.5   59.6  ?      ?    1927.49 163.36       566.35   -16.6399    1396.11   -16.6399     
1 1 1 13 21 38 o 0 646.3   75.7  ?      ?    5211.52 -18.1395     618.378  -18.1395    1571.32   161.861      
1 1 1 13 23 38 o 0 1433.9  102.8 ?      ?    6558.26 -147.223     1506.58  -147.223    1098.15   32.7768      
1 1 1 13 25 38 o 0 330     102.1 ?      ?    3709.35 22.7739      306.699  22.7739     1127.72   -157.226     
1 1 1 13 27 38 o 0 137.8   114   ?      ?    1842.8  -113.549     81.7706  -113.549    596.792   66.4511      
1 1 1 13 29 38 o 0 470.9   170.9 ?      ?    2102.29 111.522      961.428  111.522     235.488   111.522      
1 1 1 13 31 38 o 0 1529.5  245.2 ?      ?    4182.81 -174.829     1996.23  -174.829    624.471   -174.829     
1 1 1 0  38 14 o 0 132.2   35.8  ?      ?    1715.14 6.09055e-14  610.062  0           272.288   -180         
1 1 1 2  38 14 o 0 855.5   39    ?      ?    3729.18 -133.873     2076.91  -133.873    180.491   -133.873     
1 1 1 4  38 14 o 0 -3.7    25.4  ?      ?    415.439 -84.4869     159.648  95.5131     367.875   95.5131      
1 1 1 6  38 14 o 0 112.8   27.4  ?      ?    2753.27 1.29541      165.688  -178.705    1521.94   -178.705     
1 1 1 8  38 14 o 0 215.8   28.3  ?      ?    1776.37 -35.8164     709.394  -35.8164    148.067   144.184      
1 1 1 10 38 14 o 0 523.4   34.8  ?      ?    1468.11 -84.0598     1854.11  -84.0598    1161.83   -84.0598     
1 1 1 12 38 14 o 0 1067.4  49.8  ?      ?    4763.5  -167.744     1875.92  -167.744    311.083   12.2562      
1 1 1 14 38 14 o 0 1848.7  76.3  ?      ?    4419.22 121.689      3232.15  121.689     1266.83   121.689      
1 1 1 14 16 38 o 0 490.3   47.5  ?      ?    3639.74 27.0408      938.546  27.0408     667.653   -152.959     
1 1 1 14 18 38 o 0 302.3   46.9  ?      ?    3099.27 -167.19      533.007  -167.19     798.2     12.81        
1 1 1 14 20 38 o 0 322.2   53.3  ?      ?    3412.1  -54.5069     440.882  -54.5069    999.95    125.493      
1 1 1 14 22 38 o 0 1144.5  93    ?      ?    4853.05 158.418      1681.62  158.418     297.946   -21.582      
1 1 1 14 24 38 o 0 428.3   100.9 ?      ?    1498.15 -165.888     1131.44  -165.888    547.287   -165.888     
1 1 1 14 26 38 o 0 1643.3  142.1 ?      ?    5292.57 -16.9704     2121.16  -16.9704    152.838   -16.9704     
1 1 1 14 28 38 o 0 763.3   170.5 ?      ?    1843.92 -142.099     1691.28  -142.099    1036.38   -142.099     
1 1 1 14 30 38 o 0 1119.6  216.2 ?      ?    2672.98 76.5309      1961.34  76.5309     1072.97   76.5309      
1 1 1 1  38 15 o 0 318.9   30    ?      ?    2992.58 105.32       774.992  105.32      739.981   -74.6803     
1 1 1 3  38 15 o 0 435.6   32.5  ?      ?    2599.27 73.828       1348.37  73.828      49.1655   73.828       
1 1 1 5  38 15 o 0 726.4   38.1  ?      ?    2803.57 -128.292     2087.29  -128.292    707.784   -128.292     
1 1 1 7  38 15 o 0 890.4   43    ?      ?    3627.84 -44.2732     2096.03  -44.2732    343.921   -44.2732     
1 1 1 9  38 15 f 1 347.4   33.6  ?      ?    3840.95 148.881      467.653  148.881     1357.81   -31.1186     
1 1 1 11 38 15 o 0 148.7   32.2  ?      ?    1327.04 -0.00132522  399.217  -0.00132522 212.485   179.999      
1 1 1 13 38 15 o 0 1775.8  69.8  ?      ?    4046.87 50.7349      3297.75  50.7349     1487.38   50.7349      
1 1 1 15 38 15 o 0 1697.3  79.8  ?      ?    4189.9  -70.855      3018.73  -70.855     1203.94   -70.855      
1 1 1 15 17 38 o 0 2486.3  105.9 ?      ?    5152.25 105.492      3650.58  105.492     1433.64   105.492      
1 1 1 15 19 38 o 0 839.1   66.4  ?      ?    3675.62 -81.8029     1640.59  -81.8029    83.258    -81.8029     
1 1 1 15 21 38 o 0 2254    114.4 ?      ?    5638.6  92.7976      2931.62  92.7976     620.216   92.7976      
1 1 1 15 23 38 o 0 440.4   92.3  ?      ?    1985.33 53.1231      1136.23  53.1231     357.032   53.1231      
1 1 1 15 25 38 o 0 412.5   117.9 ?      ?    2403.15 -149.611     885.852  -149.611    15.2253   30.3893      
1 1 1 15 27 38 o 0 -37.6   141   ?      ?    811.762 -130.018     47.7872  49.9816     338.942   49.9816      
1 1 1 15 29 38 o 0 953.8   212.7 ?      ?    3222.48 8.75424      1596.76  8.75424     513.398   8.75424      
1 1 1 0  38 16 o 0 907.2   59.1  ?      ?    4725.07 8.1457e-16   2112.8   0           263.15    -180         
1 1 1 2  38 16 o 0 341.1   31.6  ?      ?    2158.38 53.3517      1163.71  53.3517     90.1143   53.3517      
1 1 1 4  38 16 f 1 1032.9  47.8  ?      ?    4704.41 155.926      1945.92  155.926     374.738   -24.0737     
1 1 1 6  38 16 o 0 903.4   45.5  ?      ?    3635.14 -73.4484     2118.83  -73.4484    365.676   -73.4484     
1 1 1 8  38 16 o 0 316.7   33.7  ?      ?    2786.5  50.6066      795.235  50.6066     522.022   -129.393     
1 1 1 10 38 16 o 0 293.2   33.7  ?      ?    1856.03 49.7285      985.1    49.7285     127.814   49.7285      
1 1 1 12 38 16 o 0 330.5   39    ?      ?    1688.37 -163.547     1074.18  -163.547    315.948   -163.547     
1 1 1 14 38 16 o 0 402.5   46.6  ?      ?    1339.08 -149.107     1296.2   -149.107    712.768   -149.107     
1 1 1 16 38 16 o 0 660     59.1  ?      ?    3001.3  -55.2358     1540.33  -55.2358    276.796   -55.2358     
1 1 1 16 18 38 o 0 -13.7   54.7  ?      ?    431.683 -115.273     111.389  64.727      294.602   64.727       
1 1 1 16 20 38 o 0 493.1   65.6  ?      ?    2987.68 102.428      1057.21  102.428     171.533   -77.5718     
1 1 1 16 22 38 o 0 355     71.1  ?      ?    4042.51 -66.8821     302.868  -66.8821    1270.28   113.118      
1 1 1 16 24 38 o 0 483.2   112.8 ?      ?    3198.86 149.866      877.433  149.866     335.874   -30.1337     
1 1 1 16 26 38 o 0 693.8   144.6 ?      ?    1726.13 168.1        1597.94  168.1       973.834   168.1        
1 1 1 16 28 38 o 0 444.7   204   ?      ?    2866.96 -148.133     659.625  -148.133    313.563   31.8666      
1 1 1 1  38 17 o 0 454.9   32.6  ?      ?    3565.75 -97.1628     993.74   -97.1628    767.375   82.8372      
1 1 1 3  38 17 o 0 1583.9  61.3  ?      ?    4684.74 47.7475      3001.66  47.7475     715.619   47.7475      
1 1 1 5  38 17 o 0 46.7    32.9  ?      ?    975.573 -140.082     164.075  39.9183     632.964   39.9183      
1 1 1 7  38 17 o 0 347.2   40.3  ?      ?    1896.54 -174.714     1199.07  -174.714    304.033   -174.714     
1 1 1 9  38 17 o 0 1767.2  71    ?      ?    5091.92 -34.7876     2940.52  -34.7876    591.942   -34.7876     
1 1 1 11 38 17 o 0 281.1   41.4  ?      ?    2560.64 154.43       671.687  154.43      480.476   -25.5701     
1 1 1 13 38 17 o 0 1101.1  59.7  ?      ?    2970.98 125.124      2536.04  125.124     1236.62   125.124      
1 1 1 15 38 17 o 0 50.7    50.7  ?      ?    1466.79 33.8681      212.558  -146.132    833.749   -146.132     
1 1 1 17 38 17 o 0 365.3   61.3  ?      ?    2038.97 -86.0532     981.256  -86.0532    137.067   -86.0532     
1 1 1 17 19 38 o 0 1257.1  91.8  ?      ?    4206.87 89.0026      2130.36  89.0026     397.449   89.0026      
1 1 1 17 21 38 f 1 899.4   93.1  ?      ?    3518.05 -62.9776     1703.99  -62.9776    322.873   -62.9776     
1 1 1 17 23 38 o 0 361.1   102   ?      ?    1984.87 89.1495      867.579  89.1495     111.188   89.1495      
1 1 1 17 25 38 o 0 111.7   136.3 ?      ?    1754.61 -166.797     65.2186  -166.797    573.174   13.2028      
1 1 1 17 27 38 o 0 745     177.4 ?      ?    3109.44 -35.5852     1332.09  -35.5852    268.275   -35.5852     
1 1 1 17 29 38 o 0 -382.2  237.2 ?      ?    2441.6  130.419      323.503  -49.5812    1119.06   -49.5812     
1 1 1 0  38 18 o 0 209.6   49.8  ?      ?    874.905 3.86925e-14  554.705  0           126.643   -1.30783e-13 
1 1 1 2  38 18 o 0 1332.2  59.2  ?      ?    4310.96 -144.924     2701.33  -144.924    613.198   -144.924     
1 1 1 4  38 18 o 0 1302.8  61.9  ?      ?    5077.94 -26.9771     2266.93  -26.9771    160.243   153.023      
1 1 1 6  38 18 o 0 840.7   49.2  ?      ?    4715.5  157.082      1457.63  157.082     759.518   -22.9175     
1 1 1 8  38 18 o 0 1122.1  56.3  ?      ?    3540.41 -69.8077     2487.73  -69.8077    857.891   -69.8077     
1 1 1 10 38 18 o 0 64.6    42    ?      ?    1417.16 -24.0366     170.543  155.963     808.141   155.963      
1 1 1 12 38 18 o 0 806.9   54.7  ?      ?    2857.63 78.792       1993.83  78.792      741.696   78.792       
1 1 1 14 38 18 o 0 333.8   55.2  ?      ?    3148.58 -108.289     612.75   -108.289    725.83    71.7108      
1 1 1 16 38 18 o 0 138     60.9  ?      ?    3033.92 -179.009     201.86   0.99122     1465.58   0.99122      
1 1 1 18 38 18 o 0 143.7   67    ?      ?    635.252 25.1864      143.124  25.1864     111.453   -154.814     
1 1 1 18 20 38 o 0 242.3   85.9  ?      ?    1824.7  -46.9179     500.855  -46.9179    212.479   133.082      
1 1 1 18 22 38 o 0 170.5   102.1 ?      ?    2880.53 21.4133      24.8189  -158.587    1125.78   -158.587     
1 1 1 18 24 38 o 0 -11     94.5  ?      ?    1561.57 97.866       244.352  -82.134     815.072   -82.134      
1 1 1 18 26 38 o 0 308     114   ?      ?    2188.26 157.34       573.694  157.34      179.514   -22.6597     
1 1 1 18 28 38 o 0 -141.8  228.9 ?      ?    1055.15 -27.235      1.98425  -27.235     344.454   152.765      
1 1 1 1  38 19 o 0 106.1   36.4  ?      ?    1308.42 -141.747     143.5    -141.747    484.137   38.2526      
1 1 1 3  38 19 o 0 2030.9  83.7  ?      ?    6696.13 55.9419      2692.28  55.9419     479.034   -124.058     
1 1 1 5  38 19 o 0 870.5   52.9  ?      ?    4334.15 -155.747     1666.3   -155.747    356.723   24.2531      
1 1 1 7  38 19 o 0 118.9   44.8  ?      ?    1534.21 -63.4717     122.806  -63.4717    580.679   116.528      
1 1 1 9  38 19 o 0 95.5    41.7  ?      ?    2658.3  -128.537     296.965  51.4629     1490.44   51.4629      
1 1 1 11 38 19 o 0 71.7    48.6  ?      ?    1642.84 154.117      160.938  -25.8829    880.637   -25.8829     
1 1 1 13 38 19 f 1 224.4   50.7  ?      ?    2023.51 85.7304      552.517  85.7304     314.161   -94.2696     
1 1 1 15 38 19 o 0 131.3   62.8  ?      ?    625.076 126.919      115.925  126.919     145.458   -53.0805     
1 1 1 17 38 19 o 0 309     71.1  ?      ?    1995.65 144.92       780.202  144.92      24.5038   -35.0797     
1 1 1 19 38 19 o 0 183.6   82.2  ?      ?    1028.49 4.63319      274.963  4.63319     115.235   -175.367     
1 1 1 19 21 38 o 0 622.9   95    ?      ?    2025.62 -111.427     1535.7   -111.427    760.556   -111.427     
1 1 1 19 23 38 o 0 469.2   127.7 ?      ?    2980.62 16.8192      846.547  16.8192     245.788   -163.181     
1 1 1 19 25 38 o 0 336.3   117.3 ?      ?    1754.57 22.9979      719.613  22.9979     102.998   22.9979      
1 1 1 19 27 38 o 0 -14.6   142.2 ?      ?    1241.85 167.048      64.8943  -12.9516    475.006   -12.9516     
1 1 1 0  38 20 f 1 139.5   53.4  ?      ?    3157.17 180          659.588  180         842.789   -2.55702e-14 
1 1 1 2  38 20 o 0 1907.3  77.9  ?      ?    5030.66 0.0843682    3228.97  0.0843682   870.149   0.0843682    
1 1 1 4  38 20 o 0 249.4   44.4  ?      ?    2172.28 -153.064     679.663  -153.064    326.204   26.9363      
1 1 1 6  38 20 o 0 253.4   47.9  ?      ?    4132.54 -177.589     32.9284  2.41149     1916.38   2.41149      
1 1 1 8  38 20 o 0 20.2    47.4  ?      ?    1586.42 -39.5835     378.368  140.416     1087.65   140.416      
1 1 1 10 38 20 o 0 1048.4  65.7  ?      ?    4217.03 101.961      1956.1   101.961     112.858   101.961      
1 1 1 12 38 20 o 0 445.1   59.8  ?      ?    3993.51 12.2856      607.552  12.2856     1116.44   -167.714     
1 1 1 14 38 20 o 0 503.6   64.5  ?      ?    2023.45 -150.588     1390.72  -150.588    543.065   -150.588     
1 1 1 16 38 20 o 0 415.1   73.3  ?      ?    3477.63 -155.762     662.882  -155.762    745.035   24.2379      
1 1 1 18 38 20 o 0 246.6   80.8  ?      ?    1732.57 73.3019      521.377  73.3019     140.134   -106.698     
1 1 1 20 38 20 o 0 380.9   96.4  ?      ?    2361    -98.5        827.896  -98.5       46.9947   81.5         
1 1 1 20 22 38 o 0 -10.9   112.1 ?      ?    840.025 80.766       88.2634  -99.234     396.408   -99.234      
1 1 1 20 24 38 o 0 1003.5  120.4 ?      ?    2550.94 -62.4126     1981.44  -62.4126    1082.74   -62.4126     
1 1 1 20 26 38 f 1 -59     150.5 ?      ?    1372.16 27.6248      104.555  -152.375    562.08    -152.375     
1 1 1 1  38 21 o 0 746.5   50.3  ?      ?    2447.45 4.07977      2112.19  4.07977     978.775   4.07977      
1 1 1 3  38 21 f 1 912.3   59.5  ?      ?    4606.56 -126.947     1597.52  -126.947    525.654   53.0532      
1 1 1 5  38 21 f 1 856.8   58.7  ?      ?    4907.44 88.8153      1330.56  88.8153     900.213   -91.1847     
1 1 1 7  38 21 o 0 835     65.2  ?      ?    2979.91 156.28       2035.45  156.28      711.5     156.28       
1 1 1 9  38 21 o 0 1094.4  69.1  ?      ?    4015.91 -18.6382     2110.69  -18.6382    362.957   -18.6382     
1 1 1 11 38 21 o 0 374.1   59.3  ?      ?    3105.64 -17.5787     724.831  -17.5787    612.712   162.421      
1 1 1 13 38 21 o 0 645.6   73.1  ?      ?    2341.6  -51.9347     1653.61  -51.9347    672.968   -51.9347     
1 1 1 15 38 21 o 0 725.2   82.6  ?      ?    3794.09 116.05       1290.08  116.05      248.816   -63.95       
1 1 1 17 38 21 f 1 153.5   84.9  ?      ?    1490.09 71.5647      179.834  71.5647     394.69    -108.435     
1 1 1 19 38 21 o 0 -37.6   92.9  ?      ?    773.845 -123.258     129.931  56.7418     418.581   56.7418      
1 1 1 21 38 21 o 0 401.9   109.1 ?      ?    3191.59 30.5454      611.315  30.5454     520.25    -149.455     
1 1 1 21 23 38 o 0 329.2   140.1 ?      ?    2085.98 -131.269     630.112  -131.269    105.254   48.7306      
1 1 1 21 25 38 o 0 33.6    133.1 ?      ?    734.253 -77.658      0.177472 102.342     244.152   102.342      
1 1 1 0  38 22 o 0 694.6   73.8  ?      ?    2235.38 -180         1660.93  180         641.077   180          
1 1 1 2  38 22 o 0 -7      51.5  ?      ?    1976.99 -55.1772     561.858  124.823     1456.54   124.823      
1 1 1 4  38 22 o 0 1629    77    ?      ?    5143.07 -57.6959     2616.5   -57.6959    316.084   -57.6959     
1 1 1 6  38 22 o 0 1265.4  77.4  ?      ?    4607.39 48.1222      2203.04  48.1222     173.285   48.1222      
1 1 1 8  38 22 o 0 100.1   62.3  ?      ?    1048.32 -164.992     31.9717  -164.992    427.615   15.0082      
1 1 1 10 38 22 o 0 1041.8  71.5  ?      ?    3661.32 -132.559     2057.87  -132.559    488.026   -132.559     
1 1 1 12 38 22 o 0 2052.9  108.4 ?      ?    5857.55 -130.185     2652.54  -130.185    205.364   -130.185     
1 1 1 14 38 22 o 0 1735.4  102.8 ?      ?    4856.46 26.1576      2548.28  26.1576     579.024   26.1576      
1 1 1 16 38 22 o 0 297.3   80.5  ?      ?    2563.42 -93.7615     573.439  -93.7615    411.308   86.2385      
1 1 1 18 38 22 o 0 -24.7   95.1  ?      ?    664.132 -86.8363     98.5434  93.1637     347.348   93.1637      
1 1 1 20 38 22 o 0 746     118.5 ?      ?    3928.35 -30.0042     1141.35  -30.0042    261.004   149.996      
1 1 1 22 38 22 o 0 884.1   150.8 ?      ?    4156.2  174.053      1255.46  174.053     158.439   -5.94713     
1 1 1 22 24 38 o 0 1344.8  156.5 ?      ?    2275.59 -54.9414     2423.18  -54.9414    1666.83   -54.9414     
1 1 1 1  38 23 o 0 66.5    50.2  ?      ?    1589.03 -88.956      179.344  91.044      887.627   91.044       
1 1 1 3  38 23 o 0 114.5   57    ?      ?    2226.96 134.098      92.5649  -45.9017    1089.55   -45.9017     
1 1 1 5  38 23 o 0 2124.2  95.4  ?      ?    4534.66 -62.627      3457.15  -62.627     1453.34   -62.627      
1 1 1 7  38 23 o 0 527.6   67.7  ?      ?    4210.1  -109.314     749.012  -109.314    1080.77   70.686       
1 1 1 9  38 23 o 0 346.9   65.5  ?      ?    3325.79 103.553      550.291  103.553     866.277   -76.4473     
1 1 1 11 38 23 o 0 1016.1  83.3  ?      ?    3731.89 147.778      1918.11  147.778     366.072   147.778      
1 1 1 13 38 23 o 0 -192.1  78.6  ?      ?    505.258 -19.1541     153.771  160.846     354.098   160.846      
1 1 1 15 38 23 o 0 268.4   86.3  ?      ?    1219.9  150.784      601.415  150.784     126.583   150.784      
1 1 1 17 38 23 o 0 -176.4  97.8  ?      ?    591.009 -64.3753     145.181  115.625     367.06    115.625      
1 1 1 19 38 23 o 0 337.9   116   ?      ?    1741.63 4.93422      708.888  4.93422     84.3102   4.93422      
1 1 1 21 38 23 o 0 1842.4  161.4 ?      ?    4845.14 -131.874     2342.89  -131.874    682.791   -131.874     
1 1 1 23 38 23 o 0 387.7   164.3 ?      ?    1965.11 89.5773      705.834  89.5773     76.3212   89.5773      
1 1 1 0  38 24 o 0 154.4   83.1  ?      ?    2950.5  -180         562.059  180         747.835   1.94065e-14  
1 1 1 2  38 24 o 0 834.4   68.8  ?      ?    3693.8  -67.2859     1688.92  -67.2859    60.4973   -67.2859     
1 1 1 4  38 24 o 0 590.4   64.6  ?      ?    2248.27 133.441      1616.95  133.441     636.406   133.441      
1 1 1 6  38 24 o 0 1322.2  83.2  ?      ?    4814.49 -148.325     2096.15  -148.325    26.4597   -148.325     
1 1 1 8  38 24 o 0 904.8   81.5  ?      ?    1475.68 78.8544      2389.62  78.8544     1766.6    78.8544      
1 1 1 10 38 24 o 0 498.8   74    ?      ?    1729.24 62.2555      1407.6   62.2555     693.249   62.2555      
1 1 1 12 38 24 f 1 1258.7  96.6  ?      ?    6063.7  112.376      1407.92  112.376     998.763   -67.6242     
1 1 1 14 38 24 o 0 2453    133.1 ?      ?    5914.11 -81.3026     2984.46  -81.3026    687.957   -81.3026     
1 1 1 16 38 24 o 0 436.9   98    ?      ?    3514.41 55.1648      664.913  55.1648     654.352   -124.835     
1 1 1 18 38 24 o 0 -359.1  117.2 ?      ?    676.794 139.716      175.338  -40.2837    418.608   -40.2837     
1 1 1 20 38 24 o 0 1423.1  162.9 ?      ?    4383.24 -163.648     1987.53  -163.648    478.419   -163.648     
1 1 1 22 38 24 o 0 245.9   177.4 ?      ?    2320.3  99.1661      318.714  99.1661     430.168   -80.8339     
1 1 1 1  38 25 o 0 1187    79.2  ?      ?    3856.58 154.944      2261.87  154.944     591.963   154.944      
1 1 1 3  38 25 f 1 282.3   67.5  ?      ?    2388.64 -116.814     635.957  -116.814    395.504   63.1858      
1 1 1 5  38 25 o 0 1931.9  99.1  ?      ?    5205.59 137.969      2798.9   137.969     590.644   137.969      
1 1 1 7  38 25 o 0 1580.8  96.3  ?      ?    3895.88 -5.30924     2774.28  -5.30924    1147.65   -5.30924     
1 1 1 9  38 25 o 0 303.8   73.7  ?      ?    2723.3  -127.575     575.458  -127.575    517.392   52.4252      
1 1 1 11 38 25 o 0 1710.8  115.4 ?      ?    5986.03 24.6167      2116.39  24.6167     261.692   -155.383     
1 1 1 13 38 25 o 0 1658    116.3 ?      ?    3560.8  146.483      2842.97  146.483     1466.6    146.483      
1 1 1 15 38 25 o 0 93      105   ?      ?    2882.64 -173.903     279.455  6.09654     1353.6    6.09654      
1 1 1 17 38 25 o 0 3111.8  172.4 ?      ?    7416.81 -19.4805     2880.73  -19.4805    214.645   -19.4805     
1 1 1 19 38 25 o 0 468.8   134.5 ?      ?    3017.81 115.54       811.889  115.54      229.75    -64.4605     
1 1 1 21 38 25 o 0 292     170.1 ?      ?    2952.15 54.7707      292.509  54.7707     665.204   -125.229     
1 1 1 0  38 26 o 0 94.7    103.1 ?      ?    346.078 180          57.48    180         89.3069   -1.39568e-13 
1 1 1 2  38 26 o 0 47.6    76.6  ?      ?    1231.14 141.489      123.425  -38.5107    642.567   -38.5107     
1 1 1 4  38 26 o 0 1604.6  97.6  ?      ?    4238.21 2.48145      2699.32  2.48145     964.643   2.48145      
1 1 1 6  38 26 o 0 563.1   77.1  ?      ?    3958.32 84.8494      900.69   84.8494     697.568   -95.1506     
1 1 1 8  38 26 f 1 21.4    80    ?      ?    1219.32 -97.5233     175.903  82.4767     662.478   82.4767      
1 1 1 10 38 26 o 0 150.5   90.1  ?      ?    1190.44 168.893      181.311  168.893     287.365   -11.1071     
1 1 1 12 38 26 o 0 1310    109.8 ?      ?    4600.04 -104.193     1979.08  -104.193    213.086   -104.193     
1 1 1 14 38 26 o 0 1195    125.1 ?      ?    2339.1  7.89447      2422.41  7.89447     1554.75   7.89447      
1 1 1 16 38 26 o 0 915.6   134.8 ?      ?    3315.12 171.993      1638.12  171.993     449.058   171.993      
1 1 1 18 38 26 o 0 1390.8  159.7 ?      ?    4968.11 -84.763      1789.46  -84.763     102.327   -84.763      
1 1 1 20 38 26 f 1 1783    196.9 ?      ?    4257.97 19.7686      2354.18  19.7686     961.144   19.7686      
1 1 1 1  38 27 f 1 1619.2  104.9 ?      ?    3340.48 83.893       3001.29  83.893      1641.44   83.893       
1 1 1 3  38 27 o 0 2456.5  119.4 ?      ?    4898.16 -104.694     3484.93  -104.694    1516.48   -104.694     
1 1 1 5  38 27 o 0 788.5   88    ?      ?    3215.3  -49.8888     1650.59  -49.8888    355.635   -49.8888     
1 1 1 7  38 27 o 0 424.2   86.4  ?      ?    1670.15 -13.0674     1144.7   -13.0674    482.114   -13.0674     
1 1 1 9  38 27 o 0 1165.2  109.9 ?      ?    3107.17 139.44       2285.55  139.44      1076.03   139.44       
1 1 1 11 38 27 o 0 -160.5  103.5 ?      ?    2554.95 122.838      647.212  -57.162     1614.3    -57.162      
1 1 1 13 38 27 o 0 -72.2   107.5 ?      ?    902.253 -150.592     153.302  29.4081     485.716   29.4081      
1 1 1 15 38 27 o 0 881.7   135.4 ?      ?    3655.08 145.643      1476.02  145.643     170.851   145.643      
1 1 1 17 38 27 o 0 140     150.5 ?      ?    1010.65 -36.4305     170.59   -36.4305    171.923   143.569      
1 1 1 19 38 27 o 0 416.1   177   ?      ?    2595.95 146.391      656.946  146.391     187.979   -33.6091     
1 1 1 0  38 28 o 0 400.6   123.3 ?      ?    2114.76 -2.54812e-14 980.2    0           132.858   1.62514e-13  
1 1 1 2  38 28 o 0 48.5    92.9  ?      ?    707.931 94.9256      39.2805  -85.0744    321.634   -85.0744     
1 1 1 4  38 28 o 0 1284.9  101.1 ?      ?    4310.07 153.608      2105.96  153.608     401.792   153.608      
1 1 1 6  38 28 f 1 636.8   95.9  ?      ?    743.83  -52.6286     1376.49  -52.6286    1084.45   -52.6286     
1 1 1 8  38 28 f 1 151.5   97.6  ?      ?    1581.93 146.407      147.07   146.407     460.689   -33.5926     
1 1 1 10 38 28 o 0 264.1   108.9 ?      ?    3035.27 -2.64728     234.201  -2.64728    901.69    177.353      
1 1 1 12 38 28 o 0 38.8    124.3 ?      ?    3024.52 65.7751      384.494  -114.225    1488.74   -114.225     
1 1 1 14 38 28 o 0 572     134.3 ?      ?    1806.88 -12.2266     1331.67  -12.2266    690.788   -12.2266     
1 1 1 16 38 28 o 0 390.2   158.7 ?      ?    1808.5  -178.42      769.022  -178.42     158.762   -178.42      
1 1 1 18 38 28 o 0 -100.1  174.7 ?      ?    684.884 52.2902      31.6605  -127.71     254.166   -127.71      
1 1 1 1  38 29 o 0 553.3   110.8 ?      ?    2235.47 -143.766     1342.22  -143.766    471.485   -143.766     
1 1 1 3  38 29 o 0 -93.5   102.4 ?      ?    893.005 49.772       182.273  -130.228    526.257   -130.228     
1 1 1 5  38 29 o 0 -53.4   102.3 ?      ?    1533.98 -142.222     285.122  37.7777     870.029   37.7777      
1 1 1 7  38 29 o 0 80.9    115.4 ?      ?    2729.86 8.47518      254.621  -171.525    1280.83   -171.525     
1 1 1 9  38 29 o 0 651.6   124.8 ?      ?    3191.41 -53.4416     1221.88  -53.4416    43.8763   -53.4416     
1 1 1 11 38 29 o 0 425.4   135   ?      ?    2553.7  59.6221      822.482  59.6221     99.2909   -120.378     
1 1 1 13 38 29 o 0 718.1   150.7 ?      ?    2048.59 129.823      1565.13  129.823     856.859   129.823      
1 1 1 15 38 29 o 0 1717.6  176.1 ?      ?    4373.13 -97.8991     2336.64  -97.8991    870.721   -97.8991     
1 1 1 17 38 29 o 0 1063.2  187.7 ?      ?    3699.66 130.18       1552.2   130.18      355.24    130.18       
1 1 1 0  38 30 o 0 -515.1  204.7 ?      ?    137.071 180          6.09951  180         45.631    -1.40478e-12 
1 1 1 2  38 30 o 0 311.1   111.9 ?      ?    1755.4  26.9308      666.424  26.9308     6.12565   26.9308      
1 1 1 4  38 30 o 0 1137.7  127.4 ?      ?    2842.09 -171.232     2221.28  -171.232    1160.27   -171.232     
1 1 1 6  38 30 o 0 333.5   116.5 ?      ?    2698.62 -11.455      552.61   -11.455     443.121   168.545      
1 1 1 8  38 30 o 0 379.6   129.4 ?      ?    1549.17 -145.566     859.812  -145.566    297.175   -145.566     
1 1 1 10 38 30 o 0 840     149.7 ?      ?    2695.06 -122.718     1677.06  -122.718    733.307   -122.718     
1 1 1 12 38 30 o 0 1425.7  182.9 ?      ?    4511.45 -4.52827     1963.08  -4.52827    420.973   -4.52827     
1 1 1 14 38 30 o 0 3128.9  208.1 ?      ?    6177.57 146.461      3138.95  146.461     1086.65   146.461      
1 1 1 1  38 31 o 0 504     142.1 ?      ?    2918.5  164.051      961.264  164.051     107.75    -15.9485     
1 1 1 3  38 31 o 0 25.1    135.8 ?      ?    806.239 -145.651     1.46902  -145.651    292.426   34.3492      
1 1 1 5  38 31 f 1 571.3   139.3 ?      ?    3542.52 -39.5443     922.353  -39.5443    364.529   140.456      
1 1 1 7  38 31 o 0 563.1   143.9 ?      ?    2774.77 98.795       1115.08  98.795      142.198   98.795       
1 1 1 9  38 31 o 0 344     157.9 ?      ?    1668.93 140.157      670.136  140.157     95.1227   140.157      
1 1 1 11 38 31 o 0 395.2   182.4 ?      ?    1027.99 -29.7913     689.186  -29.7913    342.609   -29.7913     
1 1 1 13 38 31 o 0 507.4   190.3 ?      ?    2461.4  -139.737     822.969  -139.737    14.4673   -139.737     
1 1 1 0  38 32 o 0 251     256   ?      ?    212.473 1.23986e-13  62.7133  0           11.6152   -180         
1 1 1 2  38 32 o 0 125.6   163.4 ?      ?    1607.48 -23.9591     162.661  -23.9591    398.565   156.041      
1 1 1 4  38 32 o 0 902.7   156.8 ?      ?    4511.88 159.341      1225.18  159.341     340.059   -20.6588     
1 1 1 6  38 32 o 0 704     159.2 ?      ?    2741.68 -66.774      1363.99  -66.774     422.957   -66.774      
1 1 1 8  38 32 o 0 250.4   173.6 ?      ?    1585.41 66.9768      420.122  66.9768     115.973   -113.023     
1 1 1 10 38 32 o 0 923     183.3 ?      ?    4673.79 -103.054     1095.45  -103.054    454.885   76.9459      
1 1 1 1  38 33 o 0 409.5   184.2 ?      ?    1813.62 -141.357     787.882  -141.357    173.082   -141.357     
1 1 1 3  38 33 o 0 1235    192.3 ?      ?    3665.26 -32.4027     1919.15  -32.4027    681.061   -32.4027     
1 1 1 5  38 33 f 1 1416.8  182.8 ?      ?    6446.15 103.136      1277.61  103.136     894.768   -76.8638     
1 1 1 7  38 33 o 0 1286.7  194   ?      ?    4433.64 -114.672     1689.73  -114.672    222.148   -114.672     
1 1 1 0  1  39 o 0 1894.8  90.5  ?      ?    5924.97 90           2965     90          123.191   90           
1 1 1 0  3  39 o 0 636.1   39.3  ?      ?    3599.54 -90          1727.2   -90         8.36607   90           
1 1 1 0  5  39 o 0 69.5    27.7  ?      ?    1580.15 90           313.191  90          449.665   -90          
1 1 1 0  7  39 o 0 1206.3  63.4  ?      ?    4932.88 -90          2375.35  -90         0.467778  -90          
1 1 1 0  9  39 o 0 189.3   32.3  ?      ?    4036.92 90           921.075  90          1009.21   -90          
1 1 1 0  11 39 o 0 1927.4  92.3  ?      ?    4913.91 90           2949.46  90          584.129   90           
1 1 1 0  13 39 o 0 747.2   46.7  ?      ?    3993.04 90           1808.81  90          84.5718   -90          
1 1 1 0  15 39 o 0 1335.9  73.4  ?      ?    3768.45 -90          2373.12  -90         620.121   -90          
1 1 1 0  17 39 o 0 650     53.3  ?      ?    773.364 -90          1183.02  -90         832.065   -90          
1 1 1 0  19 39 o 0 2384.3  133.6 ?      ?    4270.65 -90          3009.86  -90         1124.13   -90          
1 1 1 0  21 39 o 0 965.9   87.9  ?      ?    4139.58 90           1851.73  90          80.4668   90           
1 1 1 0  23 39 o 0 335.8   75.2  ?      ?    1961.49 90           947.55   90          126.304   90           
1 1 1 0  25 39 o 0 521.9   86    ?      ?    4739.71 -90          1248.87  -90         620.699   90           
1 1 1 0  27 39 o 0 1329.7  141.8 ?      ?    4621.48 90           1946.4   90          177.819   90           
1 1 1 0  29 39 o 0 -178.7  199.6 ?      ?    1707.48 90           123.466  90          496.402   -90          
1 1 1 0  31 39 o 0 127.4   174.9 ?      ?    443.448 90           73.938   90          76.4362   -90          
1 1 1 0  39 1  o 0 -11.9   25.4  ?      ?    1492.7  -90          39.4245  -90         717.575   90           
1 1 1 1  2  39 o 0 96.6    18    ?      ?    814.701 67.208       176.716  67.208      215.413   -112.792     
1 1 1 1  4  39 o 0 1838.8  62.1  ?      ?    4721.9  134.393      3480.31  134.393     1200.62   134.393      
1 1 1 1  6  39 o 0 3074.9  99.2  ?      ?    7477.91 -71.6571     3912.24  -71.6571    305.285   -71.6571     
1 1 1 1  8  39 o 0 2313.7  79.3  ?      ?    6653.5  121.523      3280.02  121.523     86.4701   121.523      
1 1 1 1  10 39 o 0 1494.9  54.8  ?      ?    5563.48 -36.2027     2479.09  -36.2027    167.465   143.797      
1 1 1 1  12 39 o 0 98.8    22.3  ?      ?    598.042 -18.84       112.413  -18.84      173.384   161.16       
1 1 1 1  14 39 o 0 261.5   25.7  ?      ?    2019.91 -11.3299     833.145  -11.3299    115.811   168.67       
1 1 1 1  16 39 f 1 477     34.2  ?      ?    2616.44 141.715      1355.46  141.715     145.165   141.715      
1 1 1 1  18 39 o 0 11.4    28.9  ?      ?    1176.26 -109.012     367.804  70.9876     894.597   70.9876      
1 1 1 1  20 39 o 0 294.5   42.8  ?      ?    1781.98 39.9922      897.228  39.9922     122.189   39.9922      
1 1 1 1  22 39 o 0 580     55.1  ?      ?    1920.06 -47.5743     1640.53  -47.5743    821.589   -47.5743     
1 1 1 1  24 39 o 0 1710.5  89.9  ?      ?    4665.72 -40.0053     2625.98  -40.0053    708.982   -40.0053     
1 1 1 1  26 39 o 0 724.6   74.9  ?      ?    4456.3  -157.617     1057.43  -157.617    687.561   22.3833      
1 1 1 1  28 39 o 0 1904.7  119.7 ?      ?    5784.14 -12.9194     2297.06  -12.9194    143.662   -12.9194     
1 1 1 1  30 39 o 0 1347.6  126.5 ?      ?    2943.07 160.946      2397.94  160.946     1355.1    160.946      
1 1 1 1  32 39 o 0 1565    157.2 ?      ?    5823.62 19.8894      1682.62  19.8894     241.483   -160.111     
1 1 1 1  39 2  o 0 1125.3  41.8  ?      ?    4556.55 -92.9218     2383.57  -92.9218    79.5001   -92.9218     
1 1 1 2  3  39 o 0 723.8   30.1  ?      ?    4732.79 63.8626      1282.08  63.8626     999.444   -116.137     
1 1 1 2  5  39 o 0 383.9   23.8  ?      ?    2729.1  -170.966     1147     -170.966    169.756   9.03429      
1 1 1 2  7  39 o 0 232.6   21.2  ?      ?    2082.23 140.366      775.182  140.365     226.384   -39.6345     
1 1 1 2  9  39 o 0 1495    54.2  ?      ?    4274.79 -32.9422     3072.75  -32.9422    1030.98   -32.9422     
1 1 1 2  11 39 o 0 1483.9  55.4  ?      ?    4955.03 -179.306     2663.21  -179.306    281.013   -179.306     
1 1 1 2  13 39 o 0 2240.7  78.1  ?      ?    5565.1  -45.6979     3512.74  -45.6979    877.236   -45.6979     
1 1 1 2  15 39 o 0 1135.8  48.1  ?      ?    2822.34 159.736      2842.51  159.736     1531.19   159.736      
1 1 1 2  17 39 o 0 652.1   38.4  ?      ?    3221.92 38.2514      1564.07  38.2514     103.495   38.2514      
1 1 1 2  19 39 o 0 1016.5  53.3  ?      ?    4328.39 81.9817      1871.46  81.9817     38.1433   -98.0183     
1 1 1 2  21 39 o 0 2943.1  114.4 ?      ?    7369.34 -75.0728     3242.25  -75.0728    90.8917   -75.0728     
1 1 1 2  23 39 o 0 1151    70.9  ?      ?    4422.52 172.46       1914.21  172.46      63.0866   172.46       
1 1 1 2  25 39 f 1 585.7   68.1  ?      ?    2394.6  -55.6361     1426.25  -55.6361    476.293   -55.6361     
1 1 1 2  27 39 o 0 1544.1  98.1  ?      ?    5689.01 171.202      1926.46  171.202     251.65    -8.79761     
1 1 1 2  29 39 o 0 -2.1    88    ?      ?    2127.77 -34.4613     368.041  145.539     1141.16   145.539      
1 1 1 2  31 39 o 0 -40.7   122.4 ?      ?    981.225 -122.039     102.578  57.961      435.745   57.961       
1 1 1 0  39 3  o 0 41.8    26.6  ?      ?    1372.75 90           157.448  90          542.642   -90          
1 1 1 2  39 3  o 0 154.3   18.5  ?      ?    431.67  -175.843     314.693  -175.843    97.4112   -175.843     
1 1 1 3  4  39 f 1 159.9   19.7  ?      ?    1759.97 -143.01      493.454  -143.01     359.464   36.9902      
1 1 1 3  6  39 o 0 2330.3  76.7  ?      ?    5515.86 43.9696      3841.79  43.9696     1187.13   43.9696      
1 1 1 3  8  39 f 1 1629.1  56.4  ?      ?    3666.13 -141.172     3570.19  -141.172    1805.02   -141.172     
1 1 1 3  10 39 o 0 1282.7  49.7  ?      ?    4504.65 29.6691      2514.19  29.6691     339.208   29.6691      
1 1 1 3  12 39 f 1 1199.2  49.3  ?      ?    4116.32 153.591      2484.29  153.591     511.641   153.591      
1 1 1 3  14 39 o 0 631.4   34    ?      ?    3522.36 -70.8805     1459.91  -70.8805    190.146   109.12       
1 1 1 3  16 39 o 0 1093.3  46.6  ?      ?    4679.33 99.3541      1961.67  99.3541     184.599   -80.6459     
1 1 1 3  18 39 o 0 535.1   38    ?      ?    3185.81 -89.5789     1252.02  -89.5789    170.854   90.4211      
1 1 1 3  20 39 o 0 357.7   44.3  ?      ?    2100.38 101.431      1046.01  101.431     134.826   101.431      
1 1 1 3  22 39 o 0 252.1   50    ?      ?    2399.2  -90.1939     530.478  -90.1939    490.428   89.8061      
1 1 1 3  24 39 o 0 290.9   53.4  ?      ?    1936.7  96.8336      754.585  96.8336     39.4905   -83.1664     
1 1 1 3  26 39 f 1 -34.9   57.8  ?      ?    744.602 103.101      196.838  -76.8987    489.533   -76.8987     
1 1 1 3  28 39 o 0 308.7   75.6  ?      ?    2956.78 37.7711      473.51   37.7711     625.686   -142.229     
1 1 1 3  30 39 o 0 555.3   108.1 ?      ?    2582.92 -133.698     1161.59  -133.698    247.371   -133.698     
1 1 1 3  32 39 o 0 307.3   133.6 ?      ?    2658.3  29.7798      407.527  29.7798     470.123   -150.22      
1 1 1 1  39 4  o 0 851.3   35.2  ?      ?    3701.42 94.1657      2163.04  94.1657     284.673   94.1657      
1 1 1 3  39 4  f 1 170     19.7  ?      ?    1452.62 -92.0965     626.454  -92.0965    104.29    87.9035      
1 1 1 4  5  39 o 0 136.2   19.1  ?      ?    2065.7  -3.41114     275.859  -3.41114    717.389   176.589      
1 1 1 4  7  39 o 0 273.9   22.5  ?      ?    1822.03 -72.6096     1027.5   -72.6096    154.422   -72.6096     
1 1 1 4  9  39 o 0 364.5   25.4  ?      ?    2116.36 28.0224      1283.91  28.0224     277.204   28.0224      
1 1 1 4  11 39 o 0 322.3   26.1  ?      ?    1898.49 -64.7613     1125.68  -64.7613    216.872   -64.7613     
1 1 1 4  13 39 o 0 612.5   34.4  ?      ?    3629.48 141.797      1373.93  141.797     337.309   -38.2026     
1 1 1 4  15 39 o 0 185.7   27.7  ?      ?    2582.92 105.816      305.562  105.816     889.143   -74.184      
1 1 1 4  17 39 o 0 49.4    28.9  ?      ?    1525.11 -55.0854     299.843  124.915     988.119   124.915      
1 1 1 4  19 39 o 0 802     46.9  ?      ?    4245.37 -151.364     1458.86  -151.364    405.857   28.6364      
1 1 1 4  21 39 o 0 565.6   52.2  ?      ?    2533.5  48.2068      1458.25  48.2068     364.5     48.2068      
1 1 1 4  23 39 f 1 820.2   63.3  ?      ?    4548.41 -117.749     1238.71  -117.749    667.99    62.2512      
1 1 1 4  25 39 o 0 188.3   51.5  ?      ?    2784.95 52.0932      138.137  52.0932     956.179   -127.907     
1 1 1 4  27 39 o 0 78.5    97.6  ?      ?    2544.3  -116.152     243.019  63.8485     1213.58   63.8485      
1 1 1 4  29 39 f 1 778     128.1 ?      ?    3572.75 -2.66398     1327.39  -2.66398    26.3346   -2.66398     
1 1 1 4  31 39 o 0 105.7   65.8  ?      ?    1271.4  40.4302      2.36593  -139.57     432.725   -139.57      
1 1 1 0  39 5  o 0 931.9   52.5  ?      ?    4025.39 -90          2214.57  -90         158.752   -90          
1 1 1 2  39 5  o 0 131.4   19.1  ?      ?    1558.92 -98.4249     383.462  -98.4249    402.437   81.5751      
1 1 1 4  39 5  o 0 463.6   24.9  ?      ?    3416.41 33.4864      1162.09  33.4864     533.493   -146.514     
1 1 1 5  6  39 o 0 60.9    20.9  ?      ?    1740.99 -112.778     197.672  67.2222     1031.38   67.2222      
1 1 1 5  8  39 o 0 68.8    22.1  ?      ?    591.388 115.068      26.388   115.068     255.237   -64.9315     
1 1 1 5  10 39 o 0 1358.6  52.3  ?      ?    3081.43 144.825      3255.87  144.825     1776.47   144.825      
1 1 1 5  12 39 o 0 464     30.1  ?      ?    2836.84 167.381      1277.92  167.381     66.0004   -12.6194     
1 1 1 5  14 39 o 0 987.3   44.8  ?      ?    3852.82 98.718       2132.69  98.718      338.699   98.718       
1 1 1 5  16 39 o 0 77.1    29    ?      ?    1895.89 -17.8954     155.978  162.105     1020.26   162.105      
1 1 1 5  18 39 o 0 503     39.1  ?      ?    2426.16 -37.0325     1420.79  -37.0325    343.844   -37.0325     
1 1 1 5  20 39 f 1 1198.6  61.8  ?      ?    3277.46 151.627      2555.34  151.627     1134.23   151.627      
1 1 1 5  22 39 o 0 56.8    44.3  ?      ?    2564.63 98.6544      507.903  -81.3456    1592.62   -81.3456     
1 1 1 5  24 39 o 0 808.6   79.5  ?      ?    3125.55 64.2053      1703.84  64.2053     429.895   64.2053      
1 1 1 5  26 39 f 1 423.7   87    ?      ?    4339.32 -175.037     371.338  -175.037    1324.59   4.96318      
1 1 1 5  28 39 o 0 1674.1  130.4 ?      ?    4619.83 -25.4612     2390.73  -25.4612    682.853   -25.4612     
1 1 1 5  30 39 f 1 443.6   151.7 ?      ?    3601.01 -103.485     553.702  -103.485    700.307   76.5151      
1 1 1 5  32 39 o 0 -332.6  217.3 ?      ?    2173.52 -153.486     287.228  26.514      1001.15   26.514       
1 1 1 1  39 6  o 0 809.9   34    ?      ?    3575.05 178.638      2116.2   178.638     303.071   178.638      
1 1 1 3  39 6  o 0 887.3   35.2  ?      ?    3660.1  -10.2918     2237.25  -10.2918    407.222   -10.2918     
1 1 1 5  39 6  o 0 452.6   24.6  ?      ?    1850.52 -166.478     1719.07  -166.478    809.352   -166.478     
1 1 1 6  7  39 o 0 1441    52.5  ?      ?    4186.94 8.87815      3006.13  8.87815     1013      8.87815      
1 1 1 6  9  39 o 0 392.4   25    ?      ?    2699.66 -178.345     1116.94  -178.345    180.966   1.65506      
1 1 1 6  11 39 o 0 3653.1  120.8 ?      ?    8943.53 13.9713      3694.48  13.9713     555.885   -166.029     
1 1 1 6  13 39 o 0 784.2   40.2  ?      ?    4046.59 -171.507     1613.13  -171.507    280.538   8.49337      
1 1 1 6  15 39 o 0 132     28.8  ?      ?    1475.71 -174.347     295.824  -174.347    381.537   5.65282      
1 1 1 6  17 39 o 0 427.9   35.8  ?      ?    1738.89 109.847      1388.75  109.847     610.08    109.847      
1 1 1 6  19 39 o 0 326.1   43.2  ?      ?    567.822 -147.813     712.124  -147.813    464.668   -147.813     
1 1 1 6  21 39 o 0 2582.2  110.6 ?      ?    6055.99 6.91864      3292.69  6.91864     698.731   6.91864      
1 1 1 6  23 39 f 1 302.7   68.3  ?      ?    1738.66 -62.1705     823.004  -62.1705    99.8531   -62.1705     
1 1 1 6  25 39 o 0 546.2   80.7  ?      ?    3035.81 51.9469      1135.22  51.9469     48.4224   -128.053     
1 1 1 6  27 39 o 0 510.2   101.8 ?      ?    1444.35 -146.457     1303.25  -146.457    756.501   -146.457     
1 1 1 6  29 39 o 0 617.7   137.8 ?      ?    2670.07 161.1        1262.65  161.1       303.053   161.1        
1 1 1 6  31 39 o 0 647.3   173.9 ?      ?    3295.46 -112.725     1067.59  -112.725    39.6673   67.2755      
1 1 1 0  39 7  o 0 698.2   43    ?      ?    2023.38 90           1903.98  90          873.546   90           
1 1 1 2  39 7  o 0 28.5    18.8  ?      ?    1408.86 82.4976      405.41   -97.5024    1113.8    -97.5024     
1 1 1 4  39 7  o 0 705.1   30.7  ?      ?    1718.54 -59.6882     2518.3   -59.6882    1667.48   -59.6882     
1 1 1 6  39 7  o 0 1513.6  53.4  ?      ?    4190.7  82.3039      3199.02  82.3039     1161.74   82.3039      
1 1 1 7  8  39 o 0 2015.3  69.6  ?      ?    6322.23 -88.9196     2888.49  -88.9196    150.716   91.0804      
1 1 1 7  10 39 o 0 159.9   23.7  ?      ?    1529.71 -96.6283     458.899  -96.6283    269.277   83.3717      
1 1 1 7  12 39 o 0 1614.8  64.8  ?      ?    5382.12 -40.6277     2628.01  -40.6277    100.776   -40.6277     
1 1 1 7  14 39 o 0 217.5   32.1  ?      ?    3012.04 93.3418      293.37   93.3418     1096.4    -86.6582     
1 1 1 7  16 39 f 1 3102.2  114.4 ?      ?    5788.79 7.0907       4280.14  7.0907      1654.88   7.0907       
1 1 1 7  18 39 o 0 3277.4  121.8 ?      ?    6209.88 176.41       4197.56  176.41      1467.09   176.41       
1 1 1 7  20 39 o 0 1210.4  69.9  ?      ?    4477.56 -42.0037     2095.98  -42.0037    183.851   -42.0037     
1 1 1 7  22 39 o 0 1012.9  77.8  ?      ?    4476.79 -153.369     1648.04  -153.369    227.202   26.6313      
1 1 1 7  24 39 o 0 522     76.2  ?      ?    1865.89 -51.4349     1386.43  -51.4349    648.189   -51.4349     
1 1 1 7  26 39 o 0 212.5   94    ?      ?    1438.03 -7.81425     388.73   -7.81425    164.749   172.186      
1 1 1 7  28 39 o 0 292.6   120.1 ?      ?    1876.2  45.8436      566.155  45.8436     120.789   -134.156     
1 1 1 7  30 39 o 0 423.1   150.8 ?      ?    3477.1  128.645      527.917  128.645     664.666   -51.3549     
1 1 1 1  39 8  o 0 713.4   30.7  ?      ?    2664.84 93.3231      2252.27  93.3231     907.304   93.3231      
1 1 1 3  39 8  f 1 316.1   23.6  ?      ?    1029.47 152.458      1301.14  152.458     785.885   152.458      
1 1 1 5  39 8  o 0 320.8   25.2  ?      ?    2810.53 -21.93       894.81   -21.93      480.723   158.07       
1 1 1 7  39 8  o 0 79.1    23.3  ?      ?    554.612 100.087      35.0061  100.087     235.9     -79.9126     
1 1 1 8  9  39 o 0 146.2   26.1  ?      ?    2324.9  -150.416     191.632  -150.416    915.222   29.584       
1 1 1 8  11 39 o 0 126.5   28.4  ?      ?    3076.74 -169.613     194.818  10.3866     1642.22   10.3866      
1 1 1 8  13 39 f 1 1086.2  53.5  ?      ?    4867.85 -48.2603     1870.68  -48.2603    396.219   131.74       
1 1 1 8  15 39 o 0 26.1    32.2  ?      ?    1979.56 45.7996      554.434  -134.2      1451.96   -134.2       
1 1 1 8  17 39 o 0 266.7   40.3  ?      ?    3031.24 -159.973     445.462  -159.973    896.994   20.0265      
1 1 1 8  19 39 o 0 28.7    38.4  ?      ?    1043.35 -99.0186     235.556  80.9814     685.158   80.9814      
1 1 1 8  21 39 o 0 339     63.6  ?      ?    1271.95 4.76521      985.253  4.76521     446.621   4.76521      
1 1 1 8  23 39 o 0 211.7   74.6  ?      ?    2449.7  -93.7327     293.363  -93.7327    708.193   86.2673      
1 1 1 8  25 39 o 0 383.7   87.9  ?      ?    2796.7  122.784      777.323  122.784     315.005   -57.2163     
1 1 1 8  27 39 f 1 497.6   107.7 ?      ?    2062.11 -105.394     1171.57  -105.394    399.579   -105.394     
1 1 1 8  29 39 o 0 145.3   149.8 ?      ?    2962.28 -6.77456     47.2798  173.225     1099.55   173.225      
1 1 1 8  31 39 o 0 229     223.1 ?      ?    1876.25 29.5295      368.716  29.5295     254.387   -150.47      
1 1 1 0  39 9  o 0 474.6   40.9  ?      ?    2846.9  90           1559.85  90          120.363   90           
1 1 1 2  39 9  o 0 929.4   40.6  ?      ?    5420.5  39.7007      1509.9   39.7007     1197.02   -140.299     
1 1 1 4  39 9  o 0 186.1   25.1  ?      ?    1056.12 131.829      698.273  131.829     178.846   131.829      
1 1 1 6  39 9  o 0 906.4   41.6  ?      ?    4315.5  -108.425     1861.69  -108.425    259.804   71.5752      
1 1 1 8  39 9  o 0 298.3   28    ?      ?    1191.61 62.5199      1112.87  62.5199     539.214   62.5199      
1 1 1 9  10 39 o 0 1229.2  53.1  ?      ?    4133.64 140.645      2512.23  140.645     566.933   140.645      
1 1 1 9  12 39 o 0 868.8   45.1  ?      ?    4520.66 -46.3682     1586.6   -46.3682    511.109   133.632      
1 1 1 9  14 39 o 0 3012.7  106.7 ?      ?    7452.71 143.037      3507.44  143.037     110.502   143.037      
1 1 1 9  16 39 o 0 563.4   40.6  ?      ?    3489.78 -31.6619     1207.53  -31.6619    346.587   148.338      
1 1 1 9  18 39 o 0 247     41.9  ?      ?    2253.78 126.596      608.379  126.596     369.962   -53.4043     
1 1 1 9  20 39 o 0 603.7   61.4  ?      ?    2883.43 -121.553     1419.67  -121.553    187.429   -121.553     
1 1 1 9  22 39 o 0 683.9   76.3  ?      ?    3003.89 62.7698      1507.35  62.7698     265.68    62.7698      
1 1 1 9  24 39 o 0 815.6   91.6  ?      ?    3459.22 -102.981     1572.36  -102.981    222.017   -102.981     
1 1 1 9  26 39 o 0 933.3   110.9 ?      ?    3048.11 77.9386      1859.79  77.9386     702.457   77.9386      
1 1 1 9  28 39 o 0 1374.8  142.8 ?      ?    4742.4  -113.304     1901.11  -113.304    188.368   -113.304     
1 1 1 9  30 39 o 0 451.2   177.8 ?      ?    2006.68 7.07209      883.444  7.07209     204.6     7.07209      
1 1 1 1  39 10 o 0 3147.6  103.1 ?      ?    7111.2  -64.8159     4329.82  -64.8159    773.384   -64.8159     
1 1 1 3  39 10 o 0 238     25.2  ?      ?    2279.07 -88.058      700.17   -88.058     444.099   91.942       
1 1 1 5  39 10 o 0 153.2   27.8  ?      ?    2452.56 -55.6789     195.124  -55.6789    1016.08   124.321      
1 1 1 7  39 10 o 0 1816.9  69.4  ?      ?    5334.49 94.3894      3061.88  94.3894     478.013   94.3894      
1 1 1 9  39 10 o 0 916     45.6  ?      ?    3368.06 -99.3137     2220.35  -99.3137    625.092   -99.3137     
1 1 1 10 11 39 o 0 6.2     30.6  ?      ?    808.593 69.5118      252.067  -110.488    627.478   -110.488     
1 1 1 10 13 39 o 0 82.6    32.9  ?      ?    900.417 -157.596     29.9475  -157.596    381.375   22.4042      
1 1 1 10 15 39 f 1 693.8   44.5  ?      ?    4038.24 9.49776      1311.84  9.49776     503.813   -170.502     
1 1 1 10 17 39 o 0 876.6   56.8  ?      ?    3326.91 122.784      1962.64  122.784     510.271   122.784      
1 1 1 10 19 39 f 1 660.6   56.3  ?      ?    4220.44 -20.7818     1061.18  -20.7818    766.123   159.218      
1 1 1 10 21 39 o 0 1159.1  84.1  ?      ?    3745.76 -177.383     2171.55  -177.383    608.936   -177.383     
1 1 1 10 23 39 o 0 296.4   82.4  ?      ?    2239.43 15.7348      656.437  15.7348     227.409   -164.265     
1 1 1 10 25 39 o 0 734.7   104.4 ?      ?    3053.38 174.551      1504.67  174.551     330.383   174.551      
1 1 1 10 27 39 o 0 389.2   120.7 ?      ?    2122.51 -33.6709     825.287  -33.6709    47.4189   -33.6709     
1 1 1 10 29 39 o 0 1334.7  167.4 ?      ?    5063.18 164.626      1696.71  164.626     44.6245   -15.374      
1 1 1 10 31 39 o 0 -144.6  240.5 ?      ?    886.417 -118.353     7.81882  -118.353    281.907   61.6468      
1 1 1 0  39 11 o 0 11.2    32.4  ?      ?    484.783 90           24.6439  90          221.968   -90          
1 1 1 2  39 11 o 0 1905.4  65.8  ?      ?    6166.2  -151.927     2922.07  -151.927    177.273   28.0735      
1 1 1 4  39 11 o 0 81.5    25.8  ?      ?    2188.47 -112.795     197.712  67.2052     1281.41   67.2052      
1 1 1 6  39 11 o 0 656.6   35.5  ?      ?    2186.31 62.5894      2111.88  62.5894     1048.36   62.5894      
1 1 1 8  39 11 o 0 700.1   41    ?      ?    3667.42 -176.133     1599.28  -176.133    148.019   3.86671      
1 1 1 10 39 11 o 0 3281.2  116.6 ?      ?    6872.88 -38.9376     4151.12  -38.9376    953.993   -38.9376     
1 1 1 11 12 39 o 0 412.4   38.1  ?      ?    2046.23 172.8        1340.24  172.8       404.856   172.8        
1 1 1 11 14 39 o 0 1683.8  71.4  ?      ?    5094.33 -74.1191     2729.11  -74.1191    446.132   -74.1191     
1 1 1 11 16 39 o 0 124.6   40.6  ?      ?    2654.33 104.186      84.3965  -75.8137    1247.84   -75.8137     
1 1 1 11 18 39 o 0 405.8   50.6  ?      ?    1450.11 -54.2534     1279.06  -54.2534    659.751   -54.2534     
1 1 1 11 20 39 f 1 29.9    61.1  ?      ?    1376.46 -158.772     244.965  21.2281     826.757   21.2281      
1 1 1 11 22 39 o 0 92.1    76.8  ?      ?    1595.95 -159.81      38.6186  20.1895     687.202   20.1895      
1 1 1 11 24 39 o 0 95.8    96.7  ?      ?    1058.05 -71.8112     36.3667  -71.8112    375.039   108.189      
1 1 1 11 26 39 o 0 1067.2  122.1 ?      ?    3492.75 72.6327      1895.25  72.6327     598.754   72.6327      
1 1 1 11 28 39 o 0 66      141.8 ?      ?    872.286 -169.637     59.3781  -169.637    250.099   10.3626      
1 1 1 11 30 39 f 1 742.8   201.7 ?      ?    2271.25 -74.7709     1437.66  -74.7709    678.75    -74.7709     
1 1 1 1  39 12 o 0 431.3   29.6  ?      ?    2954.97 125.114      1196.41  125.114     287.507   -54.8861     
1 1 1 3  39 12 f 1 126.8   25.2  ?      ?    1006.78 93.1873      300.787  93.1873     200.954   -86.8127     
1 1 1 5  39 12 o 0 358.9   31.5  ?      ?    2184.87 84.1879      1197.89  84.1879     132.546   84.1879      
1 1 1 7  39 12 o 0 102.7   29.2  ?      ?    1016.91 -68.4108     158.507  -68.4108    327.927   111.589      
1 1 1 9  39 12 o 0 652.9   40.2  ?      ?    3845.79 102.906      1376.65  102.906     422.525   -77.0937     
1 1 1 11 39 12 o 0 2282.9  83.5  ?      ?    5940.1  -71.9751     3275.88  -71.9751    566.927   -71.9751     
1 1 1 12 13 39 o 0 1592.3  70.3  ?      ?    5785.62 166.663      2295.1   166.663     299.731   -13.3373     
1 1 1 12 15 39 o 0 99.6    39    ?      ?    1803.45 123.691      36.1242  -56.3089    828.543   -56.3089     
1 1 1 12 17 39 o 0 1148.7  69.1  ?      ?    5319.12 -33.8811     1658.86  -33.8811    622.17    146.119      
1 1 1 12 19 39 o 0 399.5   54.8  ?      ?    3422.87 158.984      677.394  158.984     769.58    -21.0158     
1 1 1 12 21 39 o 0 609.6   83.4  ?      ?    2038.6  71.3642      1604.6   71.3642     769.904   71.3642      
1 1 1 12 23 39 o 0 472.8   87.2  ?      ?    2931.96 116.472      986.932  116.472     163.662   -63.5277     
1 1 1 12 25 39 o 0 289.9   114.7 ?      ?    1317.46 -35.6758     611.459  -35.6758    114.521   -35.6758     
1 1 1 12 27 39 f 1 238.1   135.1 ?      ?    1602.05 -112.242     416.79   -112.242    162.123   67.7577      
1 1 1 12 29 39 o 0 209.2   178.3 ?      ?    1059.25 -118.871     314.004  -118.871    43.0776   61.1295      
1 1 1 0  39 13 o 0 849.5   58.3  ?      ?    3006.79 90           2034.68  90          529.32    90           
1 1 1 2  39 13 o 0 228.6   29    ?      ?    2013.25 92.7085      728.521  92.7085     267.924   -87.2915     
1 1 1 4  39 13 o 0 129.2   30    ?      ?    2357.28 -76.7078     81.8457  -76.7078    1068.07   103.292      
1 1 1 6  39 13 o 0 97.5    29.9  ?      ?    1310.8  -158.819     112.499  -158.819    515.829   21.1808      
1 1 1 8  39 13 f 1 343.2   32.8  ?      ?    3437.09 -9.42947     620.235  -9.42947    1002.92   170.571      
1 1 1 10 39 13 o 0 97.7    33.8  ?      ?    1191.34 16.4821      99.2079  16.4821     447.103   -163.518     
1 1 1 12 39 13 o 0 -12.8   35.4  ?      ?    1266.03 128.974      420.973  -51.0263    985.112   -51.0263     
1 1 1 13 14 39 o 0 943.2   54.8  ?      ?    4384.33 81.7854      1697.71  81.7854     230.366   -98.2146     
1 1 1 13 16 39 o 0 592.2   54.9  ?      ?    1165.53 -151.825     1789.81  -151.825    1288.74   -151.825     
1 1 1 13 18 39 o 0 166.4   50.1  ?      ?    1674.71 137.511      316.387  137.511     394.506   -42.4888     
1 1 1 13 20 39 o 0 213     54.6  ?      ?    1472.01 140.922      518.456  140.922     87.7543   -39.0777     
1 1 1 13 22 39 o 0 1187.2  99.8  ?      ?    4912.36 -14.925      1713.95  -14.925     202.489   165.075      
1 1 1 13 24 39 o 0 317.9   108.1 ?      ?    481.298 -117.982     404.336  -117.982    221.122   -117.982     
1 1 1 13 26 39 o 0 -168.5  135.7 ?      ?    494.957 126.945      80.7187  -53.0549    260.516   -53.0549     
1 1 1 13 28 39 o 0 167.9   152.7 ?      ?    1488.55 145.035      234.979  145.035     273.193   -34.9653     
1 1 1 1  39 14 o 0 3711.1  120.3 ?      ?    7939.52 -59.6448     4389.83  -59.6448    473.42    -59.6448     
1 1 1 3  39 14 o 0 138.1   30.3  ?      ?    1225.11 116.155      364.665  116.155     232.014   -63.8445     
1 1 1 5  39 14 o 0 39.6    31    ?      ?    337.55  -59.8941     64.8585  120.106     226.683   120.106      
1 1 1 7  39 14 o 0 1166.7  51.7  ?      ?    4934.26 -177.48      2041.91  -177.48     279.424   2.52005      
1 1 1 9  39 14 o 0 188.4   33.6  ?      ?    1364.29 -15.7913     597.498  -15.7913    30.3538   164.209      
1 1 1 11 39 14 o 0 689     44.1  ?      ?    4525.54 -85.7835     1112.72  -85.7835    914.757   94.2165      
1 1 1 13 39 14 o 0 114.9   39.3  ?      ?    589.197 147.119      101.961  147.119     154.467   -32.8815     
1 1 1 14 15 39 f 1 897.4   61.2  ?      ?    1001.89 130.432      2446.12  130.432     2012.59   130.432      
1 1 1 14 17 39 o 0 194.1   53.2  ?      ?    1592.55 123.963      449.773  123.963     227.924   -56.0371     
1 1 1 14 19 39 o 0 43.2    55    ?      ?    2110.49 34.7084      395.435  -145.292    1268.17   -145.292     
1 1 1 14 21 39 o 0 423.8   87.3  ?      ?    3604.2  -108.984     636.682  -108.984    777.519   71.0156      
1 1 1 14 23 39 o 0 118.1   99.2  ?      ?    2134.39 140.988      29.0389  -39.012     847.566   -39.012      
1 1 1 14 25 39 o 0 -401.5  134   ?      ?    1699.28 15.251       432.903  -164.749    1055.81   -164.749     
1 1 1 14 27 39 o 0 181.4   163.3 ?      ?    2472.94 85.7073      167.993  85.7073     685.378   -94.2927     
1 1 1 14 29 39 o 0 1123    203.1 ?      ?    3429.21 -100.612     1745.52  -100.612    617.282   -100.612     
1 1 1 0  39 15 o 0 56.9    42.2  ?      ?    1117.61 -90          148.011  -90         400.212   90           
1 1 1 2  39 15 o 0 1210.9  51.6  ?      ?    4573.92 -154.428     2357.57  -154.428    138.064   -154.428     
1 1 1 4  39 15 o 0 1766.5  71.9  ?      ?    4349.23 -23.7091     3390.23  -23.7091    1309.1    -23.7091     
1 1 1 6  39 15 o 0 118     34.2  ?      ?    1230.87 125.416      238.069  125.416     340.915   -54.584      
1 1 1 8  39 15 o 0 653.9   42.8  ?      ?    4618.79 117.218      1016.48  117.218     1109.35   -62.7817     
1 1 1 10 39 15 f 1 672.7   44.1  ?      ?    2233.41 -100.007     1939.9   -100.007    930.222   -100.007     
1 1 1 12 39 15 o 0 172.6   40.2  ?      ?    1714.84 -145.805     399.078  -145.805    351.227   34.1953      
1 1 1 14 39 15 f 1 1017    63    ?      ?    3907.78 87.3578      1951.9   87.3578     284.629   87.3578      
1 1 1 15 16 39 o 0 523.9   57.1  ?      ?    2567.08 -104.589     1320     -104.589    226.681   -104.589     
1 1 1 15 18 39 o 0 1062.6  78    ?      ?    3708.7  92.6913      2006.62  92.6913     469.24    92.6913      
1 1 1 15 20 39 o 0 1014.5  82.5  ?      ?    3428.72 -84.5094     1966.56  -84.5094    615.762   -84.5094     
1 1 1 15 22 39 o 0 445.9   98.8  ?      ?    3310.92 113.861      770.36   113.861     506.578   -66.1388     
1 1 1 15 24 39 o 0 1891.7  140   ?      ?    4745.96 48.4512      2609.71  48.4512     857.231   48.4512      
1 1 1 15 26 39 o 0 1502.2  163.2 ?      ?    3988.44 -58.6636     2274.08  -58.6636    862.227   -58.6636     
1 1 1 15 28 39 o 0 -47.5   198.2 ?      ?    3026.2  133.046      274.545  -46.9539    1280.82   -46.9539     
1 1 1 1  39 16 f 1 140.9   35    ?      ?    487.368 -114.125     233.057  -114.125    3.37775   65.8745      
1 1 1 3  39 16 o 0 599.2   43.2  ?      ?    2117.45 -13.6069     1936.67  -13.6069    927.491   -13.6069     
1 1 1 5  39 16 o 0 390.3   38.2  ?      ?    2316.52 -158.114     1217.17  -158.114    129.874   -158.114     
1 1 1 7  39 16 f 1 491.9   43.4  ?      ?    1195.45 65.9983      1638.68  65.9983     1085.58   65.9983      
1 1 1 9  39 16 o 0 184.9   38.2  ?      ?    1063.24 -164.213     480.395  -164.213    1.74662   -164.213     
1 1 1 11 39 16 o 0 -22.4   40.3  ?      ?    1463.43 105.229      475.133  -74.7708    1117.56   -74.7708     
1 1 1 13 39 16 o 0 1593.7  71.4  ?      ?    5341.78 -18.9438     2363.59  -18.9438    85.2838   -18.9438     
1 1 1 15 39 16 o 0 76.6    51.2  ?      ?    660.263 92.9378      29.9157  -87.0622    306.231   -87.0622     
1 1 1 16 17 39 o 0 247.6   60.7  ?      ?    2203.28 -15.0796     544.549  -15.0796    369.482   164.92       
1 1 1 16 19 39 o 0 1503.3  91.5  ?      ?    4685.8  123.652      2301.93  123.652     451.536   123.652      
1 1 1 16 21 39 o 0 587.5   85.2  ?      ?    2688.23 -68.5888     1321.16  -68.5888    280.291   -68.5888     
1 1 1 16 23 39 o 0 1627.8  140.2 ?      ?    4752.24 -66.5098     2282.41  -66.5098    517.861   -66.5098     
1 1 1 16 25 39 o 0 -21.5   27    ?      ?    517.977 -152.185     158.438  27.8151     343.112   27.8151      
1 1 1 16 27 39 f 1 131.4   186.1 ?      ?    3736.93 -121.518     235.98   58.4816     1496.63   58.4816      
1 1 1 0  39 17 o 0 389.7   55.8  ?      ?    2028.78 -90          1248.77  -90         279.55    -90          
1 1 1 2  39 17 o 0 664.6   40.9  ?      ?    2649.16 170.969      1883.43  170.969     630.504   170.969      
1 1 1 4  39 17 o 0 814.5   48.7  ?      ?    3070.12 157.144      2061.18  157.144     628.464   157.144      
1 1 1 6  39 17 o 0 31.8    38.8  ?      ?    1408.85 30.1631      334.729  -149.837    981.34    -149.837     
1 1 1 8  39 17 o 0 100.2   41.5  ?      ?    1969.48 -6.63972     71.7783  173.36      957.872   173.36       
1 1 1 10 39 17 o 0 120.8   40.3  ?      ?    1131.89 -92.8251     162.296  -92.8251    335.223   87.1749      
1 1 1 12 39 17 o 0 357.3   46.5  ?      ?    2264.32 69.6293      984.246  69.6293     15.3674   69.6293      
1 1 1 14 39 17 o 0 -29.4   52.8  ?      ?    913.606 -102.346     259.629  77.6544     644       77.6544      
1 1 1 16 39 17 o 0 777.1   67.6  ?      ?    2364.58 -147.372     1880.14  -147.372    919.342   -147.372     
1 1 1 17 18 39 o 0 57.7    63.9  ?      ?    973.751 -40.0292     88.8123  139.971     481.376   139.971      
1 1 1 17 20 39 o 0 1050.1  88.7  ?      ?    4325.37 58.5764      1691.81  58.5764     13.336    58.5764      
1 1 1 17 22 39 o 0 694.5   97.1  ?      ?    2696.77 -119.491     1486.23  -119.491    481.1     -119.491     
1 1 1 17 24 39 o 0 661.4   102.6 ?      ?    924.298 -71.1283     1421.88  -71.1283    1090.56   -71.1283     
1 1 1 17 26 39 o 0 -63.6   39.5  ?      ?    1388.86 156.449      400.664  -23.551     869.822   -23.551      
1 1 1 1  39 18 o 0 957.4   50.9  ?      ?    4543.5  102.109      1773.42  102.109     357.28    -77.8913     
1 1 1 3  39 18 o 0 1299.7  62.9  ?      ?    3520.92 2.61821      2844.12  2.61821     1211.62   2.61821      
1 1 1 5  39 18 o 0 735.4   53.6  ?      ?    2493.35 -148.775     2041.3   -148.775    902.124   -148.775     
1 1 1 7  39 18 o 0 127.1   44.7  ?      ?    1503.02 39.0578      171.33   39.0578     503.107   -140.942     
1 1 1 9  39 18 o 0 93.3    46.5  ?      ?    2103.73 80.2224      144.843  -99.7776    1068.83   -99.7776     
1 1 1 11 39 18 o 0 1147.9  63.2  ?      ?    5173.73 -118.964     1716.51  -118.964    499.894   61.036       
1 1 1 13 39 18 o 0 151.2   55.5  ?      ?    1957.07 45.6718      165.702  45.6718     660.323   -134.328     
1 1 1 15 39 18 o 0 506.6   69.4  ?      ?    3009.04 -46.5728     1076.47  -46.5728    152.77    133.427      
1 1 1 17 39 18 o 0 570.4   78.6  ?      ?    1985.44 118.672      1466.41  118.672     684.728   118.672      
1 1 1 18 19 39 o 0 977.2   97.6  ?      ?    3571.91 -39.0754     1820.9   -39.0754    434.153   -39.0754     
1 1 1 18 21 39 o 0 233.6   112.3 ?      ?    1905.93 131.345      400.512  131.345     314.922   -48.655      
1 1 1 18 23 39 o 0 13.6    141.2 ?      ?    1291.05 -143.349     41.1491  36.6512     505.591   36.6512      
1 1 1 18 25 39 o 0 69.7    119   ?      ?    926.433 -115.171     15.597   -115.171    298.972   64.8287      
1 1 1 18 27 39 o 0 95.2    219.7 ?      ?    1781.78 160.663      125.279  160.663     453.094   -19.3371     
1 1 1 0  39 19 o 0 1410    91.8  ?      ?    4859.64 90           2431.73  90          177.507   90           
1 1 1 2  39 19 o 0 1070.8  62.4  ?      ?    4224.4  -147.192     2099.25  -147.192    157.646   -147.192     
1 1 1 4  39 19 o 0 1416.8  70.9  ?      ?    3817.33 -41.8941     2865.11  -41.8941    1132.71   -41.8941     
1 1 1 6  39 19 o 0 752.5   59.1  ?      ?    3369.48 76.1539      1717.67  76.1539     212.906   76.1539      
1 1 1 8  39 19 o 0 248.2   55.3  ?      ?    2507.46 -105.391     535.889  -105.391    562.299   74.6088      
1 1 1 10 39 19 f 1 136.2   53.8  ?      ?    2159.9  98.7278      44.2788  98.7278     898.328   -81.2722     
1 1 1 12 39 19 o 0 2037.3  95.1  ?      ?    5702.26 -176.763     2730.37  -176.763    320.882   -176.763     
1 1 1 14 39 19 o 0 93.3    65    ?      ?    1970.3  -98.2811     123.339  81.7189     930.848   81.7189      
1 1 1 16 39 19 o 0 287.2   83.3  ?      ?    2743.96 59.9345      489.173  59.9345     575.523   -120.066     
1 1 1 18 39 19 o 0 330.9   87.7  ?      ?    1774.73 -23.9172     813.691  -23.9172    142.581   -23.9172     
1 1 1 19 20 39 o 0 110.8   94.7  ?      ?    1016.32 -124.155     64.27    -124.155    317.327   55.845       
1 1 1 19 22 39 f 1 -23.1   128.9 ?      ?    780.908 -106.845     59.1719  73.1551     342.191   73.1551      
1 1 1 19 24 39 o 0 180.4   123.2 ?      ?    1099.32 82.6659      234.256  82.6659     140.27    -97.3341     
1 1 1 19 26 39 o 0 606.9   151.1 ?      ?    1663.41 141.956      1272.48  141.956     729.87    141.956      
1 1 1 1  39 20 o 0 1732.5  75.8  ?      ?    5475.21 93.5756      2679.43  93.5756     190.833   93.5756      
1 1 1 3  39 20 o 0 1615.9  79.9  ?      ?    4912.41 -104.008     2708.67  -104.008    499.275   -104.008     
1 1 1 5  39 20 f 1 1367.6  76    ?      ?    3524.37 21.9311      2822.68  21.9311     1250.83   21.9311      
1 1 1 7  39 20 o 0 103.8   53.5  ?      ?    2346.4  107.312      150.633  -72.688     1173.19   -72.688      
1 1 1 9  39 20 o 0 1688.6  83.3  ?      ?    4282.74 -106.241     2889.67  -106.241    1036.67   -106.241     
1 1 1 11 39 20 f 1 3406.7  135.2 ?      ?    5832.77 54.3185      4197.03  54.3185     1720.89   54.3185      
1 1 1 13 39 20 o 0 91.4    67.1  ?      ?    1719.46 -150.502     79.4603  29.4983     784.948   29.4983      
1 1 1 15 39 20 o 0 138.6   72.6  ?      ?    686.423 -170.243     108.413  -170.243    158.811   9.75685      
1 1 1 17 39 20 o 0 1380.6  106.5 ?      ?    3799.43 -58.861      2341.36  -58.861     896.517   -58.861      
1 1 1 19 39 20 o 0 1983.5  130.3 ?      ?    5421.18 138.819      2455.93  138.819     477.959   138.819      
1 1 1 20 21 39 o 0 169.8   122.3 ?      ?    1836.37 111.933      184.221  111.933     477.581   -68.0666     
1 1 1 20 23 39 o 0 161.3   153.9 ?      ?    1538.42 -38.9509     229.77   -38.9509    295.157   141.049      
1 1 1 20 25 39 o 0 -8.1    158.5 ?      ?    1565.14 -134.773     58.8345  45.2265     570.956   45.2265      
1 1 1 0  39 21 o 0 2097    124.3 ?      ?    6097.56 90           2864.93  90          131.085   90           
1 1 1 2  39 21 o 0 969.8   63.5  ?      ?    3910.46 -70.3997     1958.25  -70.3997    219.386   -70.3997     
1 1 1 4  39 21 o 0 601.4   63.4  ?      ?    3683.58 -157.477     1172.71  -157.477    468.408   22.5231      
1 1 1 6  39 21 o 0 738.8   65.1  ?      ?    2053.76 6.67662      2033.41  6.67662     1132.42   6.67662      
1 1 1 8  39 21 o 0 467.5   65.1  ?      ?    1932.38 -162.816     1348.7   -162.816    516.907   -162.816     
1 1 1 10 39 21 o 0 49.3    62.1  ?      ?    1293.92 55.4186      169.208  -124.581    713.728   -124.581     
1 1 1 12 39 21 o 0 1673.9  102.2 ?      ?    4442.25 -6.90258     2648.83  -6.90258    828.043   -6.90258     
1 1 1 14 39 21 o 0 160.2   82.5  ?      ?    2274.78 -165.932     90.0717  -165.932    796.517   14.0683      
1 1 1 16 39 21 o 0 641.4   93.8  ?      ?    3254.1  -159.886     1246.87  -159.886    5.16811   -159.886     
1 1 1 18 39 21 o 0 118.9   108   ?      ?    1379.55 122.691      85.7829  122.691     420.492   -57.3086     
1 1 1 20 39 21 o 0 302.5   125.1 ?      ?    1037.03 78.5484      536.384  78.5484     173.94    78.5484      
1 1 1 21 22 39 o 0 635.9   153.2 ?      ?    3650.03 -16.0497     992.675  -16.0497    252.376   163.95       
1 1 1 21 24 39 o 0 731.7   189.5 ?      ?    3771.81 -162.105     1044.18  -162.105    191.482   17.8955      
1 1 1 1  39 22 o 0 700.6   62    ?      ?    3759.35 -1.49858     1382.04  -1.49858    289.504   178.501      
1 1 1 3  39 22 o 0 871.4   67.7  ?      ?    4289.79 129.075      1529.56  129.075     359.607   -50.9254     
1 1 1 5  39 22 o 0 3041    124   ?      ?    6490.84 -127.867     3675.61  -127.867    854.821   -127.867     
1 1 1 7  39 22 o 0 497.8   67.4  ?      ?    3197.74 78.7639      1037.97  78.7639     328.434   -101.236     
1 1 1 9  39 22 o 0 262.7   69.4  ?      ?    1218.03 -116.501     699.388  -116.501    189.495   -116.501     
1 1 1 11 39 22 o 0 508.6   74    ?      ?    4366.18 -15.6659     594.084  -15.6659    1189.86   164.334      
1 1 1 13 39 22 o 0 183.6   80.9  ?      ?    1591.65 -157.702     295.293  -157.702    324.415   22.2983      
1 1 1 15 39 22 o 0 16.8    103.3 ?      ?    432.179 169.374      31.942   -10.6255    197.055   -10.6255     
1 1 1 17 39 22 o 0 3596.8  175.7 ?      ?    6515.37 115.771      3690.08  115.771     1302.62   115.771      
1 1 1 19 39 22 f 1 2444.3  166.7 ?      ?    3808.96 -18.5448     3365.41  -18.5448    2018.54   -18.5448     
1 1 1 21 39 22 o 0 533.5   147.1 ?      ?    2725.29 -129.79      999.091  -129.79     99.0373   -129.79      
1 1 1 22 23 39 o 0 781.5   178.7 ?      ?    3136.09 115.407      1318.64  115.407     291.9     115.407      
1 1 1 0  39 23 o 0 2353.6  142   ?      ?    5038.89 -90          2919.47  -90         715.59    -90          
1 1 1 2  39 23 o 0 855.2   74.1  ?      ?    2692.45 69.0892      2068.08  69.0892     898.919   69.0892      
1 1 1 4  39 23 f 1 511.1   66.9  ?      ?    2140.42 164.643      1412.73  164.643     488.258   164.643      
1 1 1 6  39 23 f 1 79.3    71.8  ?      ?    2183.98 31.171       228.648  -148.829    1158.17   -148.829     
1 1 1 8  39 23 o 0 530.2   81.1  ?      ?    2339.15 -170.734     1357.19  -170.734    385.263   -170.734     
1 1 1 10 39 23 o 0 168.2   75    ?      ?    1511.26 -109.562     242.062  -109.562    359.929   70.4383      
1 1 1 12 39 23 o 0 721.1   89.3  ?      ?    2486.95 -135.67      1692.69  -135.67     714.5     -135.67      
1 1 1 14 39 23 o 0 -174.3  93.5  ?      ?    829.888 46.1422      214.816  -133.858    531.564   -133.858     
1 1 1 16 39 23 o 0 789.9   117.1 ?      ?    3700.25 75.138       1326.05  75.1379     31.6622   -104.862     
1 1 1 18 39 23 o 0 206.2   128.3 ?      ?    1796.75 -9.90119     294.71   -9.90119    339.445   170.099      
1 1 1 20 39 23 o 0 541.3   158.1 ?      ?    3124.88 170.463      911.808  170.463     126.736   -9.53667     
1 1 1 22 39 23 o 0 1577.5  204   ?      ?    5305.55 33.1065      1751.67  33.1065     72.0721   33.1065      
1 1 1 1  39 24 o 0 551.6   69.2  ?      ?    2675.56 110.23       1353.55  110.23      210.893   110.23       
1 1 1 3  39 24 o 0 2053.3  102.9 ?      ?    4557.28 -70.2158     3208.42  -70.2158    1278.81   -70.2158     
1 1 1 5  39 24 o 0 289.8   69.6  ?      ?    2894.28 77.6259      493.803  77.6259     716.538   -102.374     
1 1 1 7  39 24 o 0 255.8   79.6  ?      ?    1576.51 -95.3763     621.211  -95.3763    14.6018   84.6237      
1 1 1 9  39 24 o 0 296.1   88    ?      ?    2216.24 35.3425      663.734  35.3425     212.404   -144.658     
1 1 1 11 39 24 o 0 2622.2  135.8 ?      ?    7124.63 -162.812     2737.51  -162.812    49.6885   17.1878      
1 1 1 13 39 24 o 0 2583.5  146.1 ?      ?    6138.49 24.4643      2975.9   24.4643     640.44    24.4643      
1 1 1 15 39 24 o 0 -19.3   116.6 ?      ?    1407.43 26.6539      169.377  -153.346    685.341   -153.346     
1 1 1 17 39 24 o 0 1425.2  143.9 ?      ?    4492.09 -116.932     2009.2   -116.932    421.37    -116.932     
1 1 1 19 39 24 o 0 1458.8  158.9 ?      ?    4459.34 36.3403      1998.68  36.3403     510.71    36.3403      
1 1 1 21 39 24 o 0 628.6   186   ?      ?    2649.44 -159.089     1112.4   -159.089    268.105   -159.089     
1 1 1 0  39 25 o 0 382.7   110   ?      ?    2554.46 -90          1029.05  -90         19.7915   90           
1 1 1 2  39 25 f 1 414.7   83    ?      ?    1659.8  151.137      1149.71  151.137     468.521   151.137      
1 1 1 4  39 25 o 0 9.4     79.1  ?      ?    1610.02 -98.7174     286.106  81.2826     936.597   81.2826      
1 1 1 6  39 25 o 0 958.5   90.8  ?      ?    2375.59 80.043       2212.11  80.043      1265.56   80.043       
1 1 1 8  39 25 o 0 1003.8  99.1  ?      ?    2710.6  -80.8001     2184.17  -80.8001    1108.85   -80.8001     
1 1 1 10 39 25 o 0 1791.1  125   ?      ?    3776.03 147.238      2954.49  147.238     1488.55   147.238      
1 1 1 12 39 25 o 0 262.5   104.8 ?      ?    3520.18 22.4614      100.603  22.4614     1231.45   -157.539     
1 1 1 14 39 25 o 0 1099.8  129.1 ?      ?    3719.1  -86.7421     1846.62  -86.7421    487.467   -86.7421     
1 1 1 16 39 25 o 0 1671    151.4 ?      ?    5513.05 87.2611      1990.05  87.2611     42.8329   87.2611      
1 1 1 18 39 25 o 0 844.2   157.3 ?      ?    3881.27 -123.889     1274.93  -123.889    22.3444   56.1113      
1 1 1 20 39 25 o 0 1338    197.5 ?      ?    3781.07 -23.2104     1914.36  -23.2104    704.319   -23.2104     
1 1 1 1  39 26 o 0 527.6   88.3  ?      ?    3597.88 -48.9984     940.36   -48.9984    519.032   131.002      
1 1 1 3  39 26 f 1 2165.6  121.3 ?      ?    7692.99 129.078      2053.12  129.078     1061.45   -50.9219     
1 1 1 5  39 26 f 1 -53.8   86.2  ?      ?    929.618 -98.495      198.553  81.505      570.611   81.505       
1 1 1 7  39 26 o 0 1440.5  109.8 ?      ?    4527.15 -89.4453     2240.32  -89.4453    466.188   -89.4453     
1 1 1 9  39 26 o 0 1810.5  127.3 ?      ?    4085.07 46.9923      2846.29  46.9923     1276.09   46.9923      
1 1 1 11 39 26 o 0 781.9   133   ?      ?    3796.27 31.6746      1290.09  31.6746     128.224   -148.325     
1 1 1 13 39 26 o 0 2356.4  157.7 ?      ?    6616.09 -173.743     2450.78  -173.743    45.9132   -173.743     
1 1 1 15 39 26 o 0 288.6   145.9 ?      ?    2030.17 22.7214      522.179  22.7214     192.703   -157.279     
1 1 1 17 39 26 o 0 1154.4  160.5 ?      ?    3369.28 -4.66536     1896.3   -4.66536    770.842   -4.66536     
1 1 1 19 39 26 o 0 -198.2  187.4 ?      ?    1026.51 167.178      88.8682  -12.8223    418.011   -12.8223     
1 1 1 0  39 27 o 0 339.5   133.1 ?      ?    34.0562 90           21.0309  90          7.52017   90           
1 1 1 2  39 27 o 0 927.7   98.6  ?      ?    5021.93 3.73494      1242.46  3.73494     740.122   -176.265     
1 1 1 4  39 27 o 0 298.4   95.2  ?      ?    3489.13 49.5306      262.995  49.5306     1102.11   -130.469     
1 1 1 6  39 27 o 0 363.3   106.3 ?      ?    2619.79 166.574      734.322  166.574     277.399   -13.4256     
1 1 1 8  39 27 f 1 680.8   109.3 ?      ?    3174.74 -126.013     1315.42  -126.013    109.386   -126.013     
1 1 1 10 39 27 o 0 261.1   120.2 ?      ?    2890.93 -35.6527     254.642  -35.6527    814.682   144.347      
1 1 1 12 39 27 f 1 818.1   153.2 ?      ?    3494.99 117.926      1404.92  117.926     137.139   117.926      
1 1 1 14 39 27 o 0 345.8   147.3 ?      ?    3205.86 146.209      414.667  146.209     689.817   -33.7905     
1 1 1 16 39 27 f 1 1360.5  177.5 ?      ?    3557.92 -13.3081     2107.28  -13.3081    915.557   -13.3081     
1 1 1 18 39 27 o 0 289     189   ?      ?    1695.59 -150.59      421.194  -150.59     122.264   29.4101      
1 1 1 1  39 28 o 0 -210.5  117.4 ?      ?    939.427 -130.311     221.183  49.6885     582.045   49.6885      
1 1 1 3  39 28 o 0 -5.6    107.1 ?      ?    3874.21 -67.6783     823.514  112.322     2302.24   112.322      
1 1 1 5  39 28 o 0 362.6   110.6 ?      ?    2142.02 33.7037      807.447  33.7037     1.57627   -146.296     
1 1 1 7  39 28 o 0 397.8   117.6 ?      ?    1528.58 92.993       959.286  92.993      390.317   92.993       
1 1 1 9  39 28 o 0 507.2   131   ?      ?    2423.43 144.747      1096.4   144.747     211.024   144.747      
1 1 1 11 39 28 o 0 250.6   147   ?      ?    527.446 -84.6074     270.181  -84.6074    81.8244   -84.6074     
1 1 1 13 39 28 o 0 1623.9  175.7 ?      ?    3589.16 22.7004      2504.52  22.7004     1277.4    22.7004      
1 1 1 15 39 28 o 0 752.9   182.7 ?      ?    3594.68 -58.6554     1155.7   -58.6554    35.3419   121.345      
1 1 1 0  39 29 o 0 797.5   173.8 ?      ?    4189.06 90           1441.41  90          127.832   -90          
1 1 1 2  39 29 o 0 566.8   123.9 ?      ?    4739.81 -142.403     544.692  -142.403    1224.4    37.5966      
1 1 1 4  39 29 f 1 103.9   126.3 ?      ?    1063.37 -7.75969     84.3775  -7.75969    311.612   172.24       
1 1 1 6  39 29 o 0 500.5   129.4 ?      ?    2376.74 -100.431     1098.58  -100.431    229.035   -100.431     
1 1 1 8  39 29 o 0 542.1   139.9 ?      ?    3401.41 26.3376      903.421  26.3376     320.983   -153.662     
1 1 1 10 39 29 o 0 380.1   149   ?      ?    2952.34 -161.439     570.251  -161.439    454.006   18.5614      
1 1 1 12 39 29 o 0 1213.9  175.9 ?      ?    3784.83 -52.1094     1879.43  -52.1094    598.269   -52.1094     
1 1 1 14 39 29 o 0 1.7     184.6 ?      ?    1838.94 -9.66477     33.5696  170.335     638.283   170.335      
1 1 1 1  39 30 o 0 1446.2  158.3 ?      ?    4481.45 82.7259      2103.69  82.726      472.588   82.726       
1 1 1 3  39 30 o 0 303.9   136.1 ?      ?    2278.13 -179.943     544.897  -179.943    279.977   0.0567948    
1 1 1 5  39 30 f 1 485.6   149.4 ?      ?    863.997 123.974      960.205  123.974     653.672   123.974      
1 1 1 7  39 30 o 0 78.1    146   ?      ?    1581.65 -17.152      44.8391  -17.152     505.566   162.848      
1 1 1 9  39 30 o 0 1251.8  180.9 ?      ?    4678.37 -114.103     1675.7   -114.103    76.5277   -114.103     
1 1 1 11 39 30 f 1 960.4   189.2 ?      ?    2840.39 62.0374      1708.56  62.0374     753.563   62.0374      
1 1 1 0  39 31 o 0 -235.8  269.8 ?      ?    1444.91 -90          133.016  -90         369.963   90           
1 1 1 2  39 31 o 0 1217.4  175.3 ?      ?    4264.87 -20.3103     1784.4   -20.3103    303.274   -20.3103     
1 1 1 4  39 31 o 0 1751.2  184   ?      ?    5724.46 122.825      2007.82  122.825     33.1977   122.825      
1 1 1 6  39 31 o 0 59.6    172.9 ?      ?    3510.61 -57.6804     318.603  122.32      1516.23   122.32       
1 1 1 8  39 31 o 0 338.6   187.7 ?      ?    2481.16 176.086      496.264  176.086     337.27    -3.91417     
1 1 1 10 39 31 o 0 -291    201.5 ?      ?    885.423 -157.507     95.4377  22.4931     387.103   22.4931      
1 1 1 1  39 32 o 0 123.6   200.7 ?      ?    1520.16 -63.405      201.575  -63.405     311.75    116.595      
1 1 1 3  39 32 o 0 -300.2  188.5 ?      ?    1880.08 -54.8709     275.585  125.129     907.944   125.129      
1 1 1 5  39 32 o 0 69.7    186.3 ?      ?    2294.7  120.505      28.1561  -59.4952    793.539   -59.4952     
1 1 1 0  40 0  o 0 1007.1  87    ?      ?    4230.9  -180         2181.62  180         126.1     180          
1 1 1 0  2  40 f 1 330.6   33.6  ?      ?    3089.99 1.29911e-15  1184.5   0           248.504   -180         
1 1 1 0  4  40 o 0 905.4   53.2  ?      ?    3432.04 -1.2457e-14  1977.65  0           389.66    5.07664e-14  
1 1 1 0  6  40 o 0 1775.4  90.3  ?      ?    6553.15 180          2767.05  180         316.834   5.7217e-14   
1 1 1 0  8  40 o 0 1647.9  85.7  ?      ?    4980.73 -2.50925e-15 2653.27  0           320.358   1.82728e-14  
1 1 1 0  10 40 o 0 792     54.8  ?      ?    3235.16 180          1822.23  180         320.141   -180         
1 1 1 0  12 40 o 0 457.6   42.1  ?      ?    2410.52 180          1354.29  180         249.371   -180         
1 1 1 0  14 40 o 0 1893.3  96.6  ?      ?    4326.36 -7.09557e-15 2736.95  0           787.161   1.75756e-14  
1 1 1 0  16 40 o 0 1039    68.8  ?      ?    3981.1  180          1983.79  180         229.582   180          
1 1 1 0  18 40 o 0 431.3   55.1  ?      ?    600.934 180          655.962  180         397.74    -180         
1 1 1 0  20 40 o 0 975.1   90.1  ?      ?    4877.34 -180         1814.59  180         249.149   7.52551e-14  
1 1 1 0  22 40 o 0 33.4    77.2  ?      ?    535.574 -180         45.2028  180         173.993   3.19292e-14  
1 1 1 0  24 40 o 0 260.8   96.6  ?      ?    799.292 180          360.661  180         51.7785   -180         
1 1 1 0  26 40 o 0 312.6   120.5 ?      ?    772.383 180          390.996  180         100.765   -180         
1 1 1 0  28 40 o 0 327.3   146.8 ?      ?    3169.37 180          752.573  180         379.709   -9.71048e-15 
1 1 1 0  30 40 o 0 775.6   188.8 ?      ?    1808.68 -1.14155e-14 1221.6   0           616.683   1.11977e-14  
1 1 1 1  40 1  o 0 131.5   21.4  ?      ?    1350.29 -55.2385     394.618  -55.2385    260.281   124.761      
1 1 1 1  3  40 f 1 173.8   21.3  ?      ?    2054.88 100.134      470.816  100.134     484.916   -79.866      
1 1 1 1  5  40 o 0 779.1   34.7  ?      ?    3953.21 13.5609      1700.9   13.5609     129.548   -166.439     
1 1 1 1  7  40 o 0 252.5   26.2  ?      ?    3590.28 -174.216     217.553  -174.216    1469.6    5.78393      
1 1 1 1  9  40 o 0 1088.2  48    ?      ?    3494.68 -61.5409     2491.13  -61.5409    860.073   -61.5409     
1 1 1 1  11 40 o 0 355.8   29.9  ?      ?    1840.33 170.16       1219.54  170.16      369.874   170.16       
1 1 1 1  13 40 o 0 -25.7   27.5  ?      ?    1299.08 16.2132      488.119  -163.787    1079.03   -163.787     
1 1 1 1  15 40 o 0 1355.4  56    ?      ?    4813.56 125.669      2307.5   125.669     162.29    125.669      
1 1 1 1  17 40 o 0 1727.5  67.8  ?      ?    3966.5  29.3907      3171.54  29.3907     1444.03   29.3907      
1 1 1 1  19 40 o 0 1163.4  58.5  ?      ?    3052.84 -123.77      2538.32  -123.77     1244.24   -123.77      
1 1 1 1  21 40 o 0 1127.6  68.8  ?      ?    3480.16 36.4584      2217.38  36.4584     767.493   36.4584      
1 1 1 1  23 40 f 1 200     60.1  ?      ?    2775.74 24.8309      182.462  24.8309     940.307   -155.169     
1 1 1 1  25 40 o 0 638.1   79.8  ?      ?    2217.48 -164.809     1546.7   -164.809    694.777   -164.809     
1 1 1 1  27 40 o 0 748.9   96.1  ?      ?    3582.34 61.0066      1305.33  61.0066     6.07867   -118.993     
1 1 1 1  29 40 o 0 819.2   119   ?      ?    2943.73 153.95       1564.29  153.95      553.215   153.95       
1 1 1 1  31 40 o 0 -163.8  147   ?      ?    1306.36 -162.495     184.589  17.5053     610.877   17.5053      
1 1 1 0  40 2  f 1 -34.3   29.8  ?      ?    349.231 180          7.56216  180         164.399   -3.04161e-14 
1 1 1 2  40 2  o 0 636.6   30.3  ?      ?    2137.76 120.848      2148.37  120.848     1115.08   120.848      
1 1 1 2  4  40 o 0 1277.1  47.5  ?      ?    4818.57 6.50787      2356.6   6.50787     125.977   6.50787      
1 1 1 2  6  40 o 0 1544.5  56.2  ?      ?    4783.88 -85.5637     2785.82  -85.5637    534.189   -85.5637     
1 1 1 2  8  40 f 1 3356.1  108.4 ?      ?    8279.38 118.406      3599.63  118.406     299.918   -61.5935     
1 1 1 2  10 40 f 1 1636.3  62.8  ?      ?    4639.59 -101.038     2947.52  -101.038    781.703   -101.038     
1 1 1 2  12 40 o 0 1177.9  50.6  ?      ?    4193.54 47.4327      2327.13  47.4327     405.513   47.4327      
1 1 1 2  14 40 o 0 1054.2  46.9  ?      ?    2871.45 -131.434     2582.49  -131.434    1288.79   -131.434     
1 1 1 2  16 40 o 0 588.1   39.4  ?      ?    3631.45 -3.71473     1204.05  -3.71473    395.748   176.285      
1 1 1 2  18 40 o 0 464.3   40.8  ?      ?    2451.1  150.595      1260.83  150.595     207.656   150.595      
1 1 1 2  20 40 o 0 3014.3  120.4 ?      ?    8005.01 -10.4685     2930.86  -10.4685    456.795   169.531      
1 1 1 2  22 40 o 0 1859.7  93.3  ?      ?    4830.02 -147.483     2753.58  -147.483    775.958   -147.483     
1 1 1 2  24 40 o 0 1405.2  90.1  ?      ?    5720.49 -53.4854     1742.88  -53.4854    469.393   126.515      
1 1 1 2  26 40 o 0 103.7   80.5  ?      ?    2260.23 174.263      129.934  -5.73672    980.159   -5.73672     
1 1 1 2  28 40 f 1 307.6   99.6  ?      ?    3370.89 -80.8285     293.784  -80.8285    919.06    99.1715      
1 1 1 2  30 40 o 0 2701.4  175.1 ?      ?    5743.23 99.9926      2940     99.9926     1015.6    99.9926      
1 1 1 1  40 3  f 1 32.5    20.7  ?      ?    557.777 49.0291      131.093  -130.971    404.717   -130.971     
1 1 1 3  40 3  o 0 176.9   22.8  ?      ?    2586.67 -112.432     327.633  -112.432    916.261   67.5684      
1 1 1 3  5  40 o 0 449.9   28.7  ?      ?    2475.3  -142.416     1360.78  -142.416    195.735   -142.416     
1 1 1 3  7  40 o 0 2186.3  72.2  ?      ?    6883.93 61.7296      2808.33  61.7296     421.599   -118.27      
1 1 1 3  9  40 o 0 52.5    25.4  ?      ?    938.456 -5.28374     132.072  174.716     569.297   174.716      
1 1 1 3  11 40 f 1 1871.6  70    ?      ?    4145.76 123.13       3500.83  123.13      1579.67   123.13       
1 1 1 3  13 40 o 0 2109.5  77.6  ?      ?    5654.7  -105.994     3151.1   -105.994    584.143   -105.994     
1 1 1 3  15 40 o 0 291.6   34.2  ?      ?    2428.47 94.9906      747.823  94.9906     332.271   -85.0094     
1 1 1 3  17 40 f 1 824.2   46.7  ?      ?    4591.33 -25.6049     1342.38  -25.6049    664.62    154.395      
1 1 1 3  19 40 o 0 242.4   40.6  ?      ?    786.555 -151.815     585.626  -151.815    252.819   -151.815     
1 1 1 3  21 40 o 0 714     60.3  ?      ?    2006.29 165.899      1887.34  165.899     1052.86   165.899      
1 1 1 3  23 40 f 1 564.8   66.6  ?      ?    3494.54 128.705      1039.39  128.705     344.11    -51.2949     
1 1 1 3  25 40 o 0 1393.4  98.4  ?      ?    4801.08 -133.728     2035.66  -133.728    193.285   -133.728     
1 1 1 3  27 40 o 0 972.6   95.2  ?      ?    3644.06 67.3783      1687.97  67.3783     355.118   67.3783      
1 1 1 3  29 40 o 0 224.2   107.4 ?      ?    2770.1  -76.1596     193.202  -76.1596    757.727   103.84       
1 1 1 3  31 40 o 0 152.7   146   ?      ?    777.677 74.149       128.445  74.149      125.275   -105.851     
1 1 1 0  40 4  o 0 556.3   40.5  ?      ?    2039.42 -1.58279e-14 1633.48  0           631.293   2.5127e-14   
1 1 1 2  40 4  o 0 160.1   23.6  ?      ?    609.848 -149.851     420.688  -149.851    124.812   -149.851     
1 1 1 4  40 4  o 0 1228.2  46.7  ?      ?    3542.19 142.928      2855.08  142.928     1133.19   142.928      
1 1 1 4  6  40 o 0 126.2   23.3  ?      ?    1563.03 -86.9745     257.987  -86.9745    475.552   93.0255      
1 1 1 4  8  40 o 0 361.5   27.9  ?      ?    2670.74 -40.3115     989.703  -40.3115    257.127   139.688      
1 1 1 4  10 40 o 0 1478.6  57.6  ?      ?    3895.04 33.1412      3009.78  33.1412     1207.96   33.1412      
1 1 1 4  12 40 o 0 1461    59.3  ?      ?    4393.77 139.601      2731.7   139.601     725.583   139.601      
1 1 1 4  14 40 f 1 65.6    29.7  ?      ?    1446.91 -3.8823      179.68   176.118     831.855   176.118      
1 1 1 4  16 40 o 0 336.1   36.5  ?      ?    2756.95 -2.27199     788.018  -2.27199    422.008   177.728      
1 1 1 4  18 40 o 0 623.7   44.4  ?      ?    3589.05 -72.4438     1271.89  -72.4438    264.541   107.556      
1 1 1 4  20 40 o 0 2888.1  112   ?      ?    5464.18 94.2712      3820.38  94.2712     1516.31   94.2712      
1 1 1 4  22 40 o 0 1670    88.9  ?      ?    4779.48 -87.061      2509.3   -87.061     559.146   -87.061      
1 1 1 4  24 40 o 0 1983.4  106.2 ?      ?    4911.07 95.4538      2830.76  95.4538     912.277   95.4538      
1 1 1 4  26 40 o 0 21.2    65.6  ?      ?    1894.32 107.656      357.498  -72.3436    1064.3    -72.3436     
1 1 1 4  28 40 o 0 -80.7   126.3 ?      ?    1675.31 -45.4288     242.931  134.571     840.627   134.571      
1 1 1 4  30 40 o 0 -448.2  173.4 ?      ?    1006.33 176.013      186.695  -3.98713    523.029   -3.98713     
1 1 1 1  40 5  o 0 340.1   25.4  ?      ?    1807.4  -15.4331     1320     -15.4331    436.929   -15.4331     
1 1 1 3  40 5  o 0 273.7   23.7  ?      ?    1835.88 -173.153     971.018  -173.153    70.9279   -173.153     
1 1 1 5  40 5  o 0 1575.7  53.7  ?      ?    3776.43 93.5996      3356.1   93.5996     1535.81   93.5996      
1 1 1 5  7  40 f 1 1392.2  51.9  ?      ?    4556.52 -91.6452     2593.54  -91.6452    453.333   -91.6452     
1 1 1 5  9  40 o 0 50.4    27.2  ?      ?    521.847 46.0663      72.1463  -133.934    314.094   -133.934     
1 1 1 5  11 40 o 0 2782.2  96.5  ?      ?    6618.27 -59.2363     3627.18  -59.2363    593.02    -59.2363     
1 1 1 5  13 40 o 0 2276.6  82.1  ?      ?    5857.47 108.879      3271.38  108.879     626.391   108.879      
1 1 1 5  15 40 o 0 560     40.8  ?      ?    3050.92 14.9882      1355.46  14.9882     5.82914   14.9882      
1 1 1 5  17 40 f 1 777.6   47.6  ?      ?    1942.78 171.928      2181.41  171.928     1336.79   171.928      
1 1 1 5  19 40 f 1 321     45.6  ?      ?    1470.1  30.7263      950.119  30.7263     319.338   30.7263      
1 1 1 5  21 40 o 0 101.5   56.7  ?      ?    1846.26 179.743      68.1794  -0.256849   831.95    -0.256849    
1 1 1 5  23 40 o 0 120.4   78.5  ?      ?    2926.44 -147.414     243.783  32.586      1389.76   32.586       
1 1 1 5  25 40 o 0 1424    114.5 ?      ?    4733.23 -35.5255     2084.55  -35.5255    277.605   -35.5255     
1 1 1 5  27 40 o 0 586.3   122.3 ?      ?    4790.15 106.862      556.141  106.862     1187.14   -73.1375     
1 1 1 5  29 40 o 0 1219.3  155.5 ?      ?    3523.37 -94.9796     1999.28  -94.9796    795.592   -94.9796     
1 1 1 5  31 40 o 0 62.2    199.5 ?      ?    316.202 106.351      39.4134  106.351     63.2741   -73.649      
1 1 1 0  40 6  o 0 744.2   49.4  ?      ?    3316.92 180          1902.01  180         244.14    -180         
1 1 1 2  40 6  o 0 65.8    23.6  ?      ?    983.777 -2.97947     65.8836  177.021     551.453   177.021      
1 1 1 4  40 6  o 0 123.9   22.8  ?      ?    1702.22 -32.9351     228.732  -32.9351    598.543   147.065      
1 1 1 6  40 6  o 0 2449.2  79.8  ?      ?    4832.56 36.95        4158.42  36.95       1852.58   36.95        
1 1 1 6  8  40 o 0 2550.5  85.5  ?      ?    5014.88 -159.649     4094.46  -159.649    1767.77   -159.649     
1 1 1 6  10 40 o 0 456     31.6  ?      ?    2433.26 -167.829     1361.66  -167.829    243.367   -167.829     
1 1 1 6  12 40 o 0 2617    94.2  ?      ?    5769.25 -61.5761     3758.59  -61.576     1142.25   -61.576      
1 1 1 6  14 40 o 0 1197    55.1  ?      ?    3380.46 140.831      2605.09  140.831     1100.49   140.831      
1 1 1 6  16 40 o 0 478.8   41.1  ?      ?    2834.31 -25.1928     1192.33  -25.1928    42.8274   154.807      
1 1 1 6  18 40 o 0 180     47.1  ?      ?    1504.76 26.4688      438.86   26.4688     200.686   -153.531     
1 1 1 6  20 40 o 0 164.2   48.5  ?      ?    1465.01 -83.2764     322.202  -83.2764    291.085   96.7236      
1 1 1 6  22 40 o 0 1582.6  96.5  ?      ?    5182.52 64.5082      2213.65  64.5082     114.308   64.5082      
1 1 1 6  24 40 o 0 815.7   90.9  ?      ?    3163.07 -98.5567     1656.69  -98.5567    429.914   -98.5567     
1 1 1 6  26 40 o 0 394     106.6 ?      ?    3327.1  123.715      575.531  123.715     657.063   -56.2853     
1 1 1 6  28 40 o 0 1296.9  150.5 ?      ?    3883.72 -92.2801     2035.78  -92.2801    659.868   -92.2801     
1 1 1 6  30 40 o 0 383.6   181.2 ?      ?    2009.3  48.8631      690.486  48.8631     23.5414   48.8631      
1 1 1 1  40 7  o 0 1034.2  40.1  ?      ?    4234.88 159.563      2200.91  159.563     100.566   159.563      
1 1 1 3  40 7  o 0 -1.9    23.8  ?      ?    1151.17 -2.37939     438.919  177.621     1001.97   177.621      
1 1 1 5  40 7  f 1 368.3   27.5  ?      ?    3289.1  -44.8553     788.507  -44.8553    802.316   135.145      
1 1 1 7  40 7  o 0 275.1   28.6  ?      ?    3070.38 2.08971      522.511  2.08971     925.251   -177.91      
1 1 1 7  9  40 o 0 2613.9  89.6  ?      ?    5336.49 107.88       3999.35  107.88      1544.57   107.88       
1 1 1 7  11 40 o 0 775.6   41    ?      ?    2673.43 -74.4267     2091.61  -74.4267    875.982   -74.4267     
1 1 1 7  13 40 o 0 2815.6  104.5 ?      ?    5639.55 138.894      3993.23  138.894     1471.92   138.894      
1 1 1 7  15 40 o 0 242.2   38.4  ?      ?    2401.22 -115.817     553.231  -115.817    499.787   64.1832      
1 1 1 7  17 40 o 0 479.6   47.6  ?      ?    2016.62 -124.739     1418.06  -124.739    553.966   -124.739     
1 1 1 7  19 40 f 1 1633.7  83.6  ?      ?    3118.72 -23.3303     3171.96  -23.3303    1845.8    -23.3303     
1 1 1 7  21 40 o 0 53.1    65.4  ?      ?    1548.24 -83.5547     192.217  96.4453     826.907   96.4453      
1 1 1 7  23 40 o 0 47.3    80.6  ?      ?    1058.76 134.567      97.025   -45.4333    507.862   -45.4333     
1 1 1 7  25 40 o 0 158.8   99.2  ?      ?    2022.49 65.7646      134.564  65.7646     630.521   -114.235     
1 1 1 7  27 40 o 0 201.2   126   ?      ?    1445.41 -169.375     309.751  -169.375    211.51    10.6252      
1 1 1 7  29 40 o 0 152.6   166.9 ?      ?    1069.4  -167.719     206.332  -167.719    155.718   12.2811      
1 1 1 0  40 8  o 0 124.8   32.1  ?      ?    3068.52 -180         709.214  180         817.024   2.64643e-14  
1 1 1 2  40 8  f 1 314.4   27.3  ?      ?    3176.69 13.7461      651.513  13.7461     918.066   -166.254     
1 1 1 4  40 8  o 0 466.1   29.2  ?      ?    2212.47 -115.433     1542.74  -115.433    472.164   -115.433     
1 1 1 6  40 8  o 0 154.3   28.2  ?      ?    2119.37 -113.484     299.033  -113.484    707.998   66.5155      
1 1 1 8  40 8  o 0 158.3   28.9  ?      ?    666.602 -79.014      352.883  -79.014     42.8002   -79.014      
1 1 1 8  10 40 o 0 1858.2  72    ?      ?    4705.58 -5.36269     3211.06  -5.36269    1069.07   -5.36269     
1 1 1 8  12 40 o 0 1627.4  67.8  ?      ?    3929.25 -127.188     3127.32  -127.188    1365.64   -127.188     
1 1 1 8  14 40 o 0 1023.2  55    ?      ?    3271.04 83.358       2296.48  83.358      855.384   83.358       
1 1 1 8  16 40 o 0 510.7   43.8  ?      ?    2567.5  -156.992     1356.33  -156.992    249.11    -156.992     
1 1 1 8  18 40 f 1 111.5   49.2  ?      ?    1651.52 -17.3228     16.9803  -17.3228    691.105   162.677      
1 1 1 8  20 40 o 0 391.5   69.8  ?      ?    1218.8  149.443      1116.83  149.443     612.119   149.443      
1 1 1 8  22 40 o 0 228.9   79.5  ?      ?    1385.17 85.6197      478.535  85.6197     65.4354   -94.3803     
1 1 1 8  24 40 o 0 1877.3  118   ?      ?    5307.8  177.538      2496.8   177.538     460.874   177.538      
1 1 1 8  26 40 o 0 1846.5  145.8 ?      ?    5603.34 -51.2972     2241.28  -51.2972    188.372   -51.2972     
1 1 1 8  28 40 o 0 1746.8  165.6 ?      ?    5832.13 106.834      1986.02  106.834     23.7812   -73.1664     
1 1 1 8  30 40 o 0 146     187.8 ?      ?    2810.4  -61.5883     0.973812 118.412     923.484   118.412      
1 1 1 1  40 9  o 0 32.8    26.2  ?      ?    1164.77 -34.2923     302.56   145.708     876.288   145.708      
1 1 1 3  40 9  o 0 281.1   31    ?      ?    2587.44 -38.3352     751.87   -38.3352    505.401   141.665      
1 1 1 5  40 9  o 0 488.8   33.9  ?      ?    2360.34 168.593      1542.68  168.593     414.63    168.593      
1 1 1 7  40 9  o 0 1316.9  58.1  ?      ?    3140.87 -0.335326    3078.77  -0.335326   1606.84   -0.335326    
1 1 1 9  40 9  o 0 4575.8  150.9 ?      ?    8989.19 -137.898     4460.92  -137.898    342.997   -137.898     
1 1 1 9  11 40 o 0 141.5   31.8  ?      ?    1394.92 128.893      347.604  128.893     279.531   -51.107      
1 1 1 9  13 40 o 0 192.9   36.9  ?      ?    2662.88 -130.948     263.684  -130.948    912.992   49.0521      
1 1 1 9  15 40 o 0 1185.6  58.8  ?      ?    5130.63 30.896       1824     30.896      399.084   -149.104     
1 1 1 9  17 40 f 1 128.9   45.2  ?      ?    1810.84 -59.3953     123.166  -59.3953    647.6     120.605      
1 1 1 9  19 40 o 0 1579.8  83.2  ?      ?    4980.53 -138.245     2363.17  -138.245    283.475   -138.245     
1 1 1 9  21 40 o 0 680.3   80    ?      ?    4600.38 82.121       897.016  82.121      964.971   -97.879      
1 1 1 9  23 40 o 0 52.3    81.8  ?      ?    1415.87 -0.0362829   134.767  179.964     684.41    179.964      
1 1 1 9  25 40 o 0 951.3   116   ?      ?    2170.11 72.4504      2069.29  72.4504     1263.12   72.4504      
1 1 1 9  27 40 o 0 189.5   141.7 ?      ?    723.648 167.901      225.042  167.901     32.5119   -12.0994     
1 1 1 9  29 40 f 1 -127    177.5 ?      ?    3064.68 -10.52       427.96   169.48      1457.64   169.48       
1 1 1 0  40 10 o 0 241.1   43.6  ?      ?    1146.39 7.37325e-15  771.133  0           206.17    -2.02048e-14 
1 1 1 2  40 10 f 1 43      29.6  ?      ?    2109.59 173.212      510.68   -6.78813    1543.85   -6.78813     
1 1 1 4  40 10 o 0 603.1   37    ?      ?    3139.53 90.1001      1578.03  90.1001     71.7503   90.1001      
1 1 1 6  40 10 o 0 3052.5  110.4 ?      ?    6772.12 -94.6075     3984.43  -94.6075    793.166   -94.6075     
1 1 1 8  40 10 o 0 774.4   43.6  ?      ?    3410.26 44.0491      1831.48  44.0491     257.936   44.0491      
1 1 1 10 40 10 o 0 1413.7  64.1  ?      ?    5087.67 153.531      2320.88  153.531     29.7585   153.531      
1 1 1 10 12 40 o 0 312.7   42.1  ?      ?    1912.66 54.8082      954.394  54.8082     108.043   54.8082      
1 1 1 10 14 40 o 0 47.7    39.5  ?      ?    1704.57 146.359      318.931  -33.6406    1059.81   -33.6406     
1 1 1 10 16 40 o 0 784     56.3  ?      ?    3826.5  -119.995     1531.32  -119.995    96.1009   60.0048      
1 1 1 10 18 40 o 0 687.5   61    ?      ?    2853.99 65.4719      1599.29  65.4719     399.679   65.4719      
1 1 1 10 20 40 o 0 123.7   74.4  ?      ?    556.809 -173.861     86.5645  -173.861    140.696   6.1392       
1 1 1 10 22 40 o 0 1302.7  101.7 ?      ?    4751.15 -25.7136     1937.64  -25.7136    99.1153   -25.7136     
1 1 1 10 24 40 o 0 1.2     95.4  ?      ?    1232.66 -163.246     160.33   16.7538     626.123   16.7538      
1 1 1 10 26 40 o 0 1147.2  143   ?      ?    2717.65 40.8924      2188.4   40.8924     1207.69   40.8924      
1 1 1 10 28 40 f 1 1031.9  180.3 ?      ?    2232.85 -104.908     2002.76  -104.908    1240.71   -104.908     
1 1 1 1  40 11 o 0 410.8   34.1  ?      ?    2283.79 118.97       1346     118.97      233.581   118.97       
1 1 1 3  40 11 f 1 211     30.4  ?      ?    433.762 68.8155      411.408  68.8155     201.719   68.8155      
1 1 1 5  40 11 o 0 499.9   36.7  ?      ?    1694.41 -115.817     1752.59  -115.817    951.242   -115.817     
1 1 1 7  40 11 o 0 859.7   45.8  ?      ?    4801.67 -131.277     1443.77  -131.277    783.546   48.7228      
1 1 1 9  40 11 o 0 4000.8  141.6 ?      ?    8137.59 59.6203      4239.37  59.6203     548.895   59.6203      
1 1 1 11 40 11 o 0 595.6   45    ?      ?    2993.1  -71.2211     1464     -71.2211    143.357   -71.2211     
1 1 1 11 13 40 o 0 129.1   37.9  ?      ?    332.673 -176.662     96.8963  -176.662    47.9159   3.3376       
1 1 1 11 15 40 o 0 3074.6  119.2 ?      ?    6464.37 177.856      3752.98  177.856     994.862   177.856      
1 1 1 11 17 40 o 0 1826.2  92.7  ?      ?    4651.3  -32.2985     2866.64  -32.2985    901.954   -32.2985     
1 1 1 11 19 40 o 0 1613.4  89.6  ?      ?    4265.1  94.1999      2641.95  94.1999     889.561   94.1999      
1 1 1 11 21 40 f 1 1933.8  118.8 ?      ?    4032.18 -66.1395     3062.83  -66.1395    1480.49   -66.1395     
1 1 1 11 23 40 o 0 753     103.4 ?      ?    3659.7  147.92       1338.31  147.92      58.7214   -32.0801     
1 1 1 11 25 40 f 1 48.3    117.9 ?      ?    962.678 69.2215      21.7462  -110.778    375.304   -110.778     
1 1 1 11 27 40 o 0 432.3   159.1 ?      ?    2078.23 -76.8851     881.211  -76.8851    166.144   -76.8851     
1 1 1 11 29 40 o 0 369.4   209.2 ?      ?    3505.74 78.5868      261.486  78.5868     889.44    -101.413     
1 1 1 0  40 12 o 0 80.2    41.9  ?      ?    273.596 -3.84117e-13 57.4246  0           75.5852   180          
1 1 1 2  40 12 o 0 232.4   33.3  ?      ?    1606.96 32.3259      813.287  32.3259     40.8974   32.3259      
1 1 1 4  40 12 o 0 19      31.1  ?      ?    899.277 28.8563      251.998  -151.144    677.996   -151.144     
1 1 1 6  40 12 o 0 839.1   45.1  ?      ?    2739.18 161.89       2261.46  161.89      986.589   161.89       
1 1 1 8  40 12 o 0 76      34.3  ?      ?    1823.05 -131.556     194.149  48.4436     1023.9    48.4436      
1 1 1 10 40 12 o 0 543.5   44.8  ?      ?    4017.19 -9.50504     942.874  -9.50504    841.899   170.495      
1 1 1 12 40 12 o 0 6.5     39.6  ?      ?    1059.27 -13.6072     290.907  166.393     748.677   166.393      
1 1 1 12 14 40 o 0 478.5   48.6  ?      ?    2950.23 -168.629     1126.52  -168.63     134.218   11.3705      
1 1 1 12 16 40 o 0 1453.8  80.2  ?      ?    5215.01 60.5301      2115.86  60.5301     94.0922   -119.47      
1 1 1 12 18 40 o 0 987.7   73.3  ?      ?    4956.6  -134.301     1396.07  -134.301    650.497   45.699       
1 1 1 12 20 40 o 0 111.5   60.3  ?      ?    688.84  -11.7041     41.7885  -11.7041    228.804   168.296      
1 1 1 12 22 40 o 0 952.8   110.9 ?      ?    2684.48 142.961      2028.45  142.961     995.082   142.961      
1 1 1 12 24 40 f 1 -7.6    110.4 ?      ?    2681.78 -148.426     448.15   31.5739     1443.09   31.5739      
1 1 1 12 26 40 o 0 1087.6  163.7 ?      ?    4640.9  2.48382      1476.98  2.48382     165.838   -177.516     
1 1 1 12 28 40 o 0 114.3   182.2 ?      ?    2054.3  42.6284      112.807  42.6284     570.887   -137.372     
1 1 1 1  40 13 o 0 657.3   41.4  ?      ?    1651.49 -124.803     2232.28  -124.803    1440.25   -124.803     
1 1 1 3  40 13 o 0 397.6   38.2  ?      ?    3070.22 -64.311      970.594  -64.311     483.231   115.689      
1 1 1 5  40 13 o 0 519.6   40.8  ?      ?    2693.63 94.7198      1473.92  94.7198     218.539   94.7198      
1 1 1 7  40 13 o 0 936.9   50.6  ?      ?    3704.38 92.6156      2032.23  92.6156     340.933   92.6156      
1 1 1 9  40 13 o 0 159.1   38.5  ?      ?    318.058 -9.87539     150.404  -9.87539    8.39939   -9.87539     
1 1 1 11 40 13 o 0 1504.4  68.4  ?      ?    6333.12 -121.663     1861.41  -121.663    894.162   58.3373      
1 1 1 13 40 13 o 0 15.5    42    ?      ?    557.509 -47.2157     132.007  132.784     367.537   132.784      
1 1 1 13 15 40 o 0 2804    113.6 ?      ?    5750.5  21.865       3637.35  21.865      1196.57   21.865       
1 1 1 13 17 40 o 0 644.2   64.7  ?      ?    3359.8  165.671      1305.28  165.671     86.495    -14.3292     
1 1 1 13 19 40 o 0 290.6   65.7  ?      ?    2150.6  -33.7068     687.748  -33.7068    178.413   146.293      
1 1 1 13 21 40 o 0 780.3   97.9  ?      ?    3371.42 112.493      1515.62  112.493     209.21    112.493      
1 1 1 13 23 40 o 0 137     112.2 ?      ?    2089.17 22.7507      36.8527  22.7507     740.303   -157.249     
1 1 1 13 25 40 o 0 -40.4   137.1 ?      ?    680.668 -82.5219     45.6255  97.4781     289.002   97.4781      
1 1 1 13 27 40 o 0 667.3   166.7 ?      ?    2454.11 -75.2736     1325.36  -75.2736    498.94    -75.2736     
1 1 1 0  40 14 o 0 846.5   63.7  ?      ?    2280.9  -3.16779e-14 1933.24  0           844.21    4.08647e-14  
1 1 1 2  40 14 o 0 2008.1  74.8  ?      ?    4468.39 124.824      3661.85  124.824     1551.25   124.824      
1 1 1 4  40 14 f 1 2308.4  90.1  ?      ?    4827.57 -93.6708     3847.82  -93.6708    1590.08   -93.6708     
1 1 1 6  40 14 o 0 290.5   40.3  ?      ?    1924.44 -103.079     899.579  -103.079    19.9581   -103.079     
1 1 1 8  40 14 o 0 1847    71.6  ?      ?    4849.94 59.1378      3073.55  59.1378     901.821   59.1378      
1 1 1 10 40 14 o 0 89      38.6  ?      ?    692.297 -14.1424     20.6335  -14.1424    282.034   165.858      
1 1 1 12 40 14 o 0 2755.3  106.3 ?      ?    6579.46 -167.586     3345.65  -167.586    547.23    -167.586     
1 1 1 14 40 14 o 0 2906.6  115.6 ?      ?    5763.12 18.2635      3687.08  18.2635     1278.53   18.2635      
1 1 1 14 16 40 o 0 940.6   72.3  ?      ?    4374.11 -155.861     1540.22  -155.861    274.597   24.1387      
1 1 1 14 18 40 f 1 1207.2  83.1  ?      ?    4706.62 23.5507      1818.03  23.5507     94.4357   -156.449     
1 1 1 14 20 40 o 0 178.1   68.6  ?      ?    2086.4  165.822      219.05   165.822     593.37    -14.1777     
1 1 1 14 22 40 o 0 1084.5  121.1 ?      ?    3520.25 -32.5023     1944.81  -32.5023    620.02    -32.5023     
1 1 1 14 24 40 o 0 803.4   140.3 ?      ?    4108.94 31.9342      1193.99  31.9342     287.311   -148.066     
1 1 1 14 26 40 o 0 2232.3  198.7 ?      ?    5183.92 -131.076     2681.98  -131.076    918.89    -131.076     
1 1 1 14 28 40 o 0 14.4    218.6 ?      ?    1231.64 62.7401      71.8941  62.7401     328.343   -117.26      
1 1 1 1  40 15 o 0 -24.7   38.5  ?      ?    595.126 -138.061     209.474  41.9393     488.834   41.9393      
1 1 1 3  40 15 o 0 692.8   45.7  ?      ?    2408.19 95.192       1999.19  95.192      882.38    95.192       
1 1 1 5  40 15 o 0 1099.3  59.8  ?      ?    3436.72 -150.46      2463.96  -150.46     894.554   -150.46      
1 1 1 7  40 15 o 0 344.3   41.8  ?      ?    1891.01 0.975667     1083.9   0.975667    236.366   0.975667     
1 1 1 9  40 15 o 0 1042.5  56.7  ?      ?    3714.6  14.0766      2152.7   14.0766     524.2     14.0766      
1 1 1 11 40 15 o 0 331.5   48.3  ?      ?    1209.96 170.545      1026.7   170.545     509.651   170.545      
1 1 1 13 40 15 o 0 455     50.6  ?      ?    1704.54 -89.8339     1329.44  -89.8339    612.255   -89.8339     
1 1 1 15 40 15 o 0 -25.5   58    ?      ?    282.568 177.883      71.0944  -2.11692    186.088   -2.11692     
1 1 1 15 17 40 o 0 321.1   69.9  ?      ?    962.771 -163.598     811.403  -163.598    421.798   -163.598     
1 1 1 15 19 40 o 0 67.9    73.6  ?      ?    1917.54 43.2644      198.31   -136.736    937.391   -136.736     
1 1 1 15 21 40 o 0 270.8   81.3  ?      ?    1293.65 -135.615     626.549  -135.615    137.367   -135.615     
1 1 1 15 23 40 o 0 6.6     138.4 ?      ?    1569.18 115.377      95.6864  -64.6234    665.034   -64.6234     
1 1 1 15 25 40 o 0 30.6    167.9 ?      ?    2564.53 -153.363     134.486  26.6373     1013.79   26.6373      
1 1 1 15 27 40 o 0 291     203.9 ?      ?    1417.65 111.089      473.168  111.089     7.96255   111.089      
1 1 1 0  40 16 o 0 10.1    54.5  ?      ?    939.518 4.93064e-15  57.9661  0           379.967   -180         
1 1 1 2  40 16 o 0 -4.9    40.8  ?      ?    446.027 -112.758     136.653  67.2418     342.474   67.2418      
1 1 1 4  40 16 o 0 65.1    42.7  ?      ?    1740.63 111.278      239.113  -68.7223    1031.57   -68.7223     
1 1 1 6  40 16 o 0 60.1    41.4  ?      ?    913.928 86.4682      105.276  -93.5318    514.42    -93.5318     
1 1 1 8  40 16 o 0 3655.4  126.1 ?      ?    7755.23 -64.261      3928.86  -64.261     526.436   -64.261      
1 1 1 10 40 16 o 0 1110.6  59.5  ?      ?    4526.23 118.636      1910.33  118.636     28.9928   -61.3639     
1 1 1 12 40 16 o 0 -17.5   52.2  ?      ?    808.628 51.6002      220.248  -128.4      562.061   -128.4       
1 1 1 14 40 16 o 0 1912.7  87.1  ?      ?    5440.5  -128.858     2593.23  -128.858    364.147   -128.858     
1 1 1 16 40 16 o 0 640     72.8  ?      ?    3135.36 82.8335      1307.13  82.8335     67.146    82.8335      
1 1 1 16 18 40 f 1 1060.3  89.3  ?      ?    4013.64 -152.187     1801.3   -152.187    243.353   -152.187     
1 1 1 16 20 40 o 0 689.4   89.1  ?      ?    4302.54 2.45132      995.562  2.45132     636.34    -177.549     
1 1 1 16 22 40 o 0 260.9   93.4  ?      ?    814.164 73.7622      413.971  73.7622     117.192   73.7622      
1 1 1 16 24 40 o 0 1012.7  158.7 ?      ?    3389.02 -111.142     1737.79  -111.142    549       -111.142     
1 1 1 16 26 40 o 0 994     202.6 ?      ?    4157.59 55.276       1375.32  55.276      0.149312  55.276       
1 1 1 1  40 17 o 0 311.4   47.2  ?      ?    2737.13 -47.5163     735.639  -47.5163    518.264   132.484      
1 1 1 3  40 17 f 1 21.7    41    ?      ?    1957.95 -18.7163     524.814  161.284     1416.58   161.284      
1 1 1 5  40 17 f 1 171.9   45.4  ?      ?    2614.82 98.0586      173.713  98.0586     999.653   -81.9414     
1 1 1 7  40 17 o 0 799.3   54.5  ?      ?    3323.51 170.761      1806.63  170.761     350.481   170.761      
1 1 1 9  40 17 f 1 709.2   53.8  ?      ?    4958.08 -146.917     922.824  -146.917    1214.78   33.0826      
1 1 1 11 40 17 o 0 899     64.4  ?      ?    3339.39 37.8776      1885.06  37.8776     469.846   37.8776      
1 1 1 13 40 17 o 0 247.3   58    ?      ?    3597.21 0.656797     105.113  0.656797    1375.59   -179.343     
1 1 1 15 40 17 o 0 198.3   62.6  ?      ?    1007.47 -104.17      410.889  -104.17     9.71851   -104.17      
1 1 1 17 40 17 f 1 1093.4  88.5  ?      ?    5292.47 123.13       1364.86  123.13      636.002   -56.8699     
1 1 1 17 19 40 o 0 -114    85.8  ?      ?    854.848 60.6758      209.563  -119.324    534.213   -119.324     
1 1 1 17 21 40 o 0 29.5    101.2 ?      ?    2757.13 -161.66      415.724  18.34       1423.65   18.34        
1 1 1 17 23 40 f 1 2570.5  173.1 ?      ?    4800.28 -7.23704     3194.17  -7.23704    1493.24   -7.23704     
1 1 1 17 25 40 f 1 -55.4   188   ?      ?    3270.94 -79.2879     371.156  100.712     1465.81   100.712      
1 1 1 0  40 18 o 0 823.4   80.2  ?      ?    3001.78 1.50701e-14  1812.5   0           450.607   -4.55471e-14 
1 1 1 2  40 18 o 0 147.8   44.8  ?      ?    1676.57 74.8144      287.289  74.8144     466.347   -105.186     
1 1 1 4  40 18 o 0 646.2   54.1  ?      ?    1414.5  -76.199      2008.57  -76.199     1380.83   -76.199      
1 1 1 6  40 18 o 0 731.4   55.3  ?      ?    3521.31 153.768      1572.7   153.768     35.244    153.768      
1 1 1 8  40 18 f 1 688.6   62.6  ?      ?    3940.8  101.964      1242.8   101.964     477.219   -78.0357     
1 1 1 10 40 18 o 0 556.6   62.7  ?      ?    2878.63 -84.5148     1293.47  -84.5148    72.9459   -84.5148     
1 1 1 12 40 18 o 0 -110.3  64    ?      ?    808.467 179.487      249.486  -0.512901   583.114   -0.512901    
1 1 1 14 40 18 f 1 254.6   74.3  ?      ?    2503.38 30.112       458.862  30.112      548.297   -149.888     
1 1 1 16 40 18 f 1 540.2   85.7  ?      ?    2617.33 -39.8693     1201.12  -39.8693    204.72    -39.8693     
1 1 1 18 40 18 o 0 358.6   96.8  ?      ?    2748.99 10.2572      664.616  10.2572     348.984   -169.743     
1 1 1 18 20 40 o 0 -28     117.3 ?      ?    1606.7  -75.6335     212.559  104.367     800.566   104.367      
1 1 1 18 22 40 f 1 831.1   150.3 ?      ?    3065.79 -145.75      1533.32  -145.75     444.076   -145.75      
1 1 1 18 24 40 o 0 77.6    188.1 ?      ?    915.274 174.181      122.44   174.181     183.446   -5.81857     
1 1 1 1  40 19 o 0 4366.8  155.7 ?      ?    7353.82 -28.4105     4845.14  -28.4105    1572.08   -28.4105     
1 1 1 3  40 19 o 0 1004.2  70.6  ?      ?    4393.46 146.711      1810.96  146.711     123.772   -33.2888     
1 1 1 5  40 19 f 1 817.1   64.9  ?      ?    2130.42 -38.4454     2189.73  -38.4454    1246.66   -38.4454     
1 1 1 7  40 19 f 1 363.4   58.4  ?      ?    1921.91 81.6488      1043.55  81.6488     207.76    81.6488      
1 1 1 9  40 19 o 0 185.4   59.2  ?      ?    801.599 -68.3979     347.352  -68.3979    8.0352    -68.3979     
1 1 1 11 40 19 o 0 961.5   73.8  ?      ?    2798.4  -142.072     2133.72  -142.072    978.445   -142.072     
1 1 1 13 40 19 o 0 376.3   70.6  ?      ?    2345.16 -172.812     902.757  -172.812    37.8262   7.18839      
1 1 1 15 40 19 o 0 296     82.3  ?      ?    1139.07 113.663      692.604  113.663     259.353   113.663      
1 1 1 17 40 19 o 0 2462.7  136.2 ?      ?    5515.51 -111.98      2999.91  -111.98     951.765   -111.98      
1 1 1 19 40 19 o 0 -99.9   107.6 ?      ?    1392.35 92.7132      263.116  -87.2868    756.401   -87.2868     
1 1 1 19 21 40 o 0 1278.2  150.4 ?      ?    4090.33 35.5896      1935.35  35.5896     489.011   35.5896      
1 1 1 19 23 40 f 1 1468.1  199.2 ?      ?    3882.68 148.281      2147.33  148.281     839.223   148.281      
1 1 1 19 25 40 o 0 46.1    152.2 ?      ?    1093.47 -122.79      10.7046  -122.79     340.828   57.2097      
1 1 1 0  40 20 o 0 4.6     76    ?      ?    2117.08 -180         139.662  180         803.929   1.61139e-15  
1 1 1 2  40 20 o 0 39.9    57.6  ?      ?    938.812 -140.242     150.473  39.7584     565.422   39.7584      
1 1 1 4  40 20 o 0 641.2   67.7  ?      ?    2513.01 -146.3       1662.87  -146.3      565.443   -146.3       
1 1 1 6  40 20 o 0 36.1    63.1  ?      ?    1385.96 -18.8629     227.058  161.137     822.888   161.137      
1 1 1 8  40 20 o 0 860     78.8  ?      ?    2461.76 63.9363      2088.15  63.9363     1050.03   63.9363      
1 1 1 10 40 20 o 0 95.6    68.9  ?      ?    663.996 152.216      28.6543  152.216     244.991   -27.7843     
1 1 1 12 40 20 o 0 84.9    72.8  ?      ?    1321.42 -161.557     56.5973  18.4427     576.267   18.4427      
1 1 1 14 40 20 o 0 -7.5    84    ?      ?    586.191 13.8012      92.5645  -166.199    319.106   -166.199     
1 1 1 16 40 20 o 0 384.4   95.9  ?      ?    2906.44 178.94       703.836  178.94      380.713   -1.0603      
1 1 1 18 40 20 o 0 -67.9   112.2 ?      ?    1875.92 114.091      323.259  -65.9094    992.723   -65.9094     
1 1 1 20 40 20 f 1 454.4   139   ?      ?    1749.59 -12.3436     1007.17  -12.3436    406.477   -12.3436     
1 1 1 20 22 40 o 0 281.6   157.7 ?      ?    2448.72 23.8574      387.248  23.8574     433.603   -156.143     
1 1 1 20 24 40 o 0 -331.9  219.1 ?      ?    1816.71 -121.159     214.242  58.8414     799.543   58.8414      
1 1 1 1  40 21 o 0 289     60.2  ?      ?    763.259 -56.7675     685.166  -56.7675    352.029   -56.7675     
1 1 1 3  40 21 o 0 133.6   69.3  ?      ?    1110.23 166.357      162.968  166.357     316.895   -13.6434     
1 1 1 5  40 21 o 0 1257.4  88.1  ?      ?    4026.23 103.342      2278.54  103.342     561.649   103.342      
1 1 1 7  40 21 o 0 1974.6  103.4 ?      ?    6347.06 -29.5845     2364.26  -29.5845    296.222   150.415      
1 1 1 9  40 21 o 0 1213    92    ?      ?    4790.69 129.107      1830.71  129.107     135.914   -50.8933     
1 1 1 11 40 21 f 1 162.1   81.2  ?      ?    1350.5  132.817      220.298  132.817     312.853   -47.1828     
1 1 1 13 40 21 o 0 708.8   95.2  ?      ?    3984.03 4.68976      1164.61  4.68976     375.68    -175.31      
1 1 1 15 40 21 o 0 453     100.6 ?      ?    1975.57 177.422      1107.61  177.422     368.459   177.422      
1 1 1 17 40 21 o 0 2277.3  147.6 ?      ?    5724.15 38.0278      2638.25  38.0278     585.172   38.0278      
1 1 1 19 40 21 o 0 1057.6  154.1 ?      ?    3568.08 -70.4754     1717.08  -70.4753    489.728   -70.4753     
1 1 1 21 40 21 o 0 -189.4  162.7 ?      ?    643.751 68.0325      71.0021  -111.968    278.872   -111.968     
1 1 1 21 23 40 o 0 -59.4   188.2 ?      ?    1163.63 -48.4279     27.72    131.572     402.724   131.572      
1 1 1 0  40 22 o 0 -203.9  88.4  ?      ?    478.033 -180         12.6823  180         192.822   2.83767e-14  
1 1 1 2  40 22 o 0 1969.1  101.4 ?      ?    4531.25 -91.8863     3133.06  -91.8863    1199.4    -91.8863     
1 1 1 4  40 22 o 0 1269.4  90.8  ?      ?    4966.18 31.944       1907.14  31.944      188.493   -148.056     
1 1 1 6  40 22 o 0 827.8   82.1  ?      ?    2441.94 -121.151     1997.45  -121.151    982.311   -121.151     
1 1 1 8  40 22 o 0 52      80.1  ?      ?    1736.57 177.499      205.146  -2.50145    899.61    -2.50145     
1 1 1 10 40 22 o 0 969.5   94.3  ?      ?    4052.83 67.0164      1658.68  67.0164     74.0293   67.0164      
1 1 1 12 40 22 o 0 467.3   93.4  ?      ?    4113.7  -43.7227     564.164  -43.7227    1023.38   136.277      
1 1 1 14 40 22 o 0 1376.9  123   ?      ?    4004.61 -116.559     2220.56  -116.559    721.596   -116.559     
1 1 1 16 40 22 o 0 23.4    112.6 ?      ?    992.987 23.1074      65.9274  -156.893    423.071   -156.893     
1 1 1 18 40 22 f 1 271.9   136.9 ?      ?    1402.52 -10.0598     503.673  -10.0598    15.9713   -10.0598     
1 1 1 20 40 22 o 0 824.4   167.6 ?      ?    2272.9  144.871      1595.28  144.871     855.623   144.871      
1 1 1 22 40 22 o 0 1574.5  212.8 ?      ?    4340.32 -97.6425     1944.43  -97.6425    599.76    -97.6425     
1 1 1 1  40 23 f 1 5.3     68.6  ?      ?    680.676 52.6031      126.924  -127.397    414.596   -127.397     
1 1 1 3  40 23 f 1 1440.7  95.9  ?      ?    4544.39 -114.886     2327.03  -114.886    461.082   -114.886     
1 1 1 5  40 23 o 0 453.6   77.2  ?      ?    3171.95 143.213      887.992  143.213     390.781   -36.7872     
1 1 1 7  40 23 o 0 71.7    80.8  ?      ?    2026.42 -82.5015     194.172  97.4985     997.756   97.4985      
1 1 1 9  40 23 o 0 514.8   96.8  ?      ?    2875.12 -24.822      1106.76  -24.822     25.4584   155.178      
1 1 1 11 40 23 o 0 -5.2    87.4  ?      ?    2158.13 -72.2057     397.392  107.794     1226.9    107.794      
1 1 1 13 40 23 o 0 1765    131   ?      ?    4717.55 -157.646     2488.15  -157.646    734.387   -157.646     
1 1 1 15 40 23 o 0 132.2   123.1 ?      ?    1096.17 136.471      126.883  136.471     267.58    -43.5287     
1 1 1 17 40 23 f 1 165.3   141.3 ?      ?    1349.62 -42.7507     236.988  -42.7507    233.699   137.249      
1 1 1 19 40 23 f 1 290.5   172.3 ?      ?    2883.6  -91.0405     299.196  -91.0405    649.647   88.9595      
1 1 1 21 40 23 o 0 815.4   203.3 ?      ?    2927.69 52.0094      1290.75  52.0094     376.381   52.0094      
1 1 1 0  40 24 o 0 3506.8  201.5 ?      ?    7549.17 180          3360.05  180         305.85    -180         
1 1 1 2  40 24 o 0 3416.4  143.3 ?      ?    6814.83 48.0226      3758.38  48.0226     1018.59   48.0226      
1 1 1 4  40 24 o 0 1581.9  108.8 ?      ?    6740.95 179.626      1678.09  179.626     1040.32   -0.373766    
1 1 1 6  40 24 o 0 719.3   91.1  ?      ?    4261.88 -5.59594     1123.43  -5.59594    571.014   174.404      
1 1 1 8  40 24 o 0 2120.9  125.8 ?      ?    5004.97 173.911      2950.22  173.911     995.984   173.911      
1 1 1 10 40 24 o 0 248     108.5 ?      ?    2152    -84.8527     428.682  -84.8527    393.291   95.1473      
1 1 1 12 40 24 f 1 311.7   119.8 ?      ?    1774.7  127.253      631.787  127.253     29.0226   -52.7471     
1 1 1 14 40 24 o 0 -3.8    120.7 ?      ?    739.908 -32.6861     51.7374  147.314     317.54    147.314      
1 1 1 16 40 24 o 0 576.9   147.5 ?      ?    2478.69 -36.6025     1182.5   -36.6025    322.336   -36.6025     
1 1 1 18 40 24 o 0 2027.1  195.6 ?      ?    4510.42 171.439      2577.3   171.439     1096.86   171.439      
1 1 1 20 40 24 o 0 511.3   197.1 ?      ?    2233.55 -48.7812     823.188  -48.7812    121.62    -48.7812     
1 1 1 1  40 25 o 0 652.2   94.7  ?      ?    2671.23 -27.004      1512.46  -27.004     443.614   -27.004      
1 1 1 3  40 25 o 0 684.8   98.6  ?      ?    2230.68 93.335       1686.27  93.335      800.627   93.335       
1 1 1 5  40 25 o 0 -11.3   98    ?      ?    588.281 -85.224      77.0476  94.776      307.872   94.776       
1 1 1 7  40 25 o 0 52.7    96.7  ?      ?    2066.9  102.911      208.522  -77.0889    1006.83   -77.0889     
1 1 1 9  40 25 o 0 250.6   104.1 ?      ?    2579.51 -22.2271     309.804  -22.2271    662.095   157.773      
1 1 1 11 40 25 f 1 -156.3  134   ?      ?    3654.91 110.354      833.494  -69.6456    2185.85   -69.6456     
1 1 1 13 40 25 o 0 193.1   132.3 ?      ?    559.963 -115.425     182.568  -115.425    17.7898   64.5749      
1 1 1 15 40 25 o 0 905.6   159.1 ?      ?    2512.25 179.982      1779.12  179.982     922.983   179.982      
1 1 1 17 40 25 f 1 291     165.5 ?      ?    2091.16 21.7742      464.975  21.7742     225.845   -158.226     
1 1 1 19 40 25 o 0 -149.7  204.2 ?      ?    1192.95 97.9362      62.0029  -82.0638    437.976   -82.0638     
1 1 1 0  40 26 o 0 258.4   153.3 ?      ?    1276.47 -2.04319e-14 424.523  0           75.7053   180          
1 1 1 2  40 26 o 0 1613.5  122.8 ?      ?    4119.55 -134.395     2612.61  -134.395    1006.53   -134.395     
1 1 1 4  40 26 o 0 967.8   105.1 ?      ?    4643.01 17.9316      1419.17  17.9316     365.159   -162.068     
1 1 1 6  40 26 o 0 351.4   111.2 ?      ?    2923.82 134.68       547.586  134.68      561.143   -45.3197     
1 1 1 8  40 26 o 0 -235.4  107.4 ?      ?    1761.89 -64.3684     456.214  115.632     1112.83   115.632      
1 1 1 10 40 26 o 0 226.8   125.5 ?      ?    1793.8  -56.5757     369.063  -56.5757    285.267   123.424      
1 1 1 12 40 26 o 0 602.1   157.7 ?      ?    2656.5  -80.0518     1212.89  -80.0518    268.334   -80.0518     
1 1 1 14 40 26 o 0 2847.6  206.1 ?      ?    7149.48 64.857       2644.87  64.857      217.961   64.857       
1 1 1 16 40 26 o 0 -189    169.3 ?      ?    955.829 -95.5344     101.317  84.4656     414.838   84.4656      
1 1 1 1  40 27 o 0 1775.8  134.6 ?      ?    3842.5  157.625      2851.8   157.625     1392.17   157.625      
1 1 1 3  40 27 o 0 -8.7    115.7 ?      ?    1249.68 -27.7882     135.454  152.212     607       152.212      
1 1 1 5  40 27 o 0 848.5   131.1 ?      ?    3105.65 -72.1632     1643.4   -72.1632    484.178   -72.1632     
1 1 1 7  40 27 o 0 1594.4  146.9 ?      ?    3119.41 68.9581      2754.32  68.9581     1607.25   68.9581      
1 1 1 9  40 27 o 0 628.9   138   ?      ?    2786.44 -115.007     1265.49  -115.007    260.185   -115.007     
1 1 1 11 40 27 o 0 -21.3   154.6 ?      ?    2297.84 -126.189     195.396  53.8114     992.133   53.8114      
1 1 1 13 40 27 o 0 85.3    162   ?      ?    414.133 135.933      54.6261  135.933     85.0781   -44.0666     
1 1 1 15 40 27 o 0 -386.7  208.3 ?      ?    1684.89 -34.3836     230.279  145.616     780.839   145.616      
1 1 1 0  40 28 o 0 -68.2   179.5 ?      ?    1403.7  7.88125e-16  124.984  0           395.735   -180         
1 1 1 2  40 28 f 1 209     135.4 ?      ?    1460.36 106.301      346.393  106.301     196.255   -73.6991     
1 1 1 4  40 28 o 0 1301.5  143.5 ?      ?    3429.88 -130.908     2253.57  -130.908    996.647   -130.908     
1 1 1 6  40 28 o 0 363     133.8 ?      ?    2479.18 76.3895      676.231  76.3895     221.063   -103.61      
1 1 1 8  40 28 o 0 276.9   152.1 ?      ?    2251.62 -127.033     450.944  -127.033    337.436   52.9666      
1 1 1 10 40 28 f 1 275.8   167.7 ?      ?    3044.3  61.4458      236.216  61.4458     813.681   -118.554     
1 1 1 12 40 28 o 0 -71.9   185.4 ?      ?    1697.01 3.51507      77.7148  -176.485    645.289   -176.485     
1 1 1 14 40 28 o 0 -51.1   192.4 ?      ?    1769.2  147.297      77.315   -32.7029    651.88    -32.7029     
1 1 1 1  40 29 o 0 503.8   156.4 ?      ?    3528.07 -27.894      774.635  -27.894     477.505   152.106      
1 1 1 3  40 29 o 0 802.2   150.1 ?      ?    2936.07 143.699      1556.99  143.699     520.71    143.699      
1 1 1 5  40 29 o 0 155.6   154.8 ?      ?    1675.24 -30.9588     209.727  -30.9588    375.758   149.041      
1 1 1 7  40 29 o 0 186.9   165.9 ?      ?    1450.62 51.896       287.659  51.896      212.238   -128.104     
1 1 1 9  40 29 f 1 431.5   174.6 ?      ?    1320.83 -99.8273     853.872  -99.8273    404.436   -99.8273     
1 1 1 11 40 29 o 0 -97.1   191.1 ?      ?    582.689 -71.1128     11.6649  108.887     204.418   108.887      
1 1 1 0  40 30 o 0 -275.7  224   ?      ?    281.175 1.4398e-13   19.5141  0           77.6549   -180         
1 1 1 2  40 30 o 0 1578.5  173.5 ?      ?    4187.91 -142.076     2287.83  -142.076    844.473   -142.076     
1 1 1 4  40 30 o 0 2698    199.9 ?      ?    6511.71 79.075       2736.31  79.075      508.023   79.075       
1 1 1 6  40 30 o 0 1414.7  181.8 ?      ?    4507.15 -108.105     1928.24  -108.105    403.497   -108.105     
1 1 1 8  40 30 o 0 344.9   197   ?      ?    3115.1  -7.3756      320.318  -7.3756     717.021   172.624      
1 1 1 1  40 31 o 0 331.4   201.8 ?      ?    2143.79 114.71       503.838  114.71      215.593   -65.2899     
1 1 1 3  40 31 o 0 1142.2  192.6 ?      ?    3783.42 -59.2011     1695.29  -59.2011    431.101   -59.2011     
1 1 1 5  40 31 o 0 1442.9  206.4 ?      ?    5650.28 79.6339      1512.21  79.6339     359.291   -100.366     
1 1 1 0  1  41 f 1 813.7   56.2  ?      ?    3479.72 -90          1781.88  -90         214.368   -90          
1 1 1 0  3  41 o 0 1.3     35    ?      ?    292.873 -90          11.5793  -90         120.32    90           
1 1 1 0  5  41 o 0 6.6     35.4  ?      ?    284.53  -90          12.5961  -90         115.728   90           
1 1 1 0  7  41 o 0 1582.5  85.1  ?      ?    6079.8  90           2497.37  90          237.564   -90          
1 1 1 0  9  41 o 0 2748.9  141.2 ?      ?    7259.79 -90          3267.79  -90         23.6006   -90          
1 1 1 0  11 41 o 0 2158    111.5 ?      ?    5965.23 90           2865.75  90          228.38    90           
1 1 1 0  13 41 o 0 -54.7   43.1  ?      ?    1620.21 90           33.447   90          671.339   -90          
1 1 1 0  15 41 f 1 -30.3   46.8  ?      ?    3278.72 -90          91.0038  -90         1316.53   90           
1 1 1 0  17 41 o 0 244.6   57.8  ?      ?    1885.31 -90          778.472  -90         8.10615   90           
1 1 1 0  19 41 o 0 261.3   66.6  ?      ?    1152.32 90           594.939  90          120.476   90           
1 1 1 0  21 41 o 0 338.3   90.1  ?      ?    2215.93 -90          915.79   -90         31.2968   -90          
1 1 1 0  23 41 o 0 -173.7  102.1 ?      ?    49.1804 -90          1.55203  -90         17.2748   90           
1 1 1 0  25 41 o 0 1116.4  141.8 ?      ?    4748.14 90           1704.88  90          34.1129   -90          
1 1 1 0  27 41 o 0 2335.6  214.7 ?      ?    5150.45 -90          2378.11  -90         571.534   -90          
1 1 1 0  29 41 o 0 2183.6  225.6 ?      ?    5537.27 90           2185.73  90          363.408   90           
1 1 1 0  41 1  f 1 124.5   38    ?      ?    137.525 -90          55.0452  -90         10.9834   90           
1 1 1 1  2  41 o 0 70.7    24.3  ?      ?    1412.13 -154.011     92.5856  25.9891     727.969   25.9891      
1 1 1 1  4  41 f 1 250.3   28.1  ?      ?    1395.36 -85.2007     859.617  -85.2007    226.192   -85.2007     
1 1 1 1  6  41 f 1 2831.8  95.5  ?      ?    6469.31 -1.81556     3676.86  -1.81556    742.244   -1.81556     
1 1 1 1  8  41 o 0 3.1     27.5  ?      ?    1025.58 -82.2149     331.361  97.7851     791.801   97.7851      
1 1 1 1  10 41 o 0 537.3   35.5  ?      ?    3152.94 135.094      1287.1   135.094     116.136   -44.906      
1 1 1 1  12 41 o 0 25.1    31    ?      ?    581.252 62.3786      149.526  -117.621    404.56    -117.621     
1 1 1 1  14 41 o 0 427.5   38.3  ?      ?    3374.01 -156.578     841.56   -156.578    614.215   23.4217      
1 1 1 1  16 41 o 0 176.9   39.1  ?      ?    1396.33 128.651      433.933  128.651     156.122   -51.3485     
1 1 1 1  18 41 o 0 959     56.4  ?      ?    4420.6  16.6672      1573.37  16.6672     274.105   -163.333     
1 1 1 1  20 41 f 1 93.1    59.3  ?      ?    435.497 -171.747     14.2801  -171.747    163.537   8.25302      
1 1 1 1  22 41 o 0 276     67.8  ?      ?    1129.89 -173.827     642.893  -173.827    207.82    -173.827     
1 1 1 1  24 41 o 0 217.7   76.6  ?      ?    1593.47 163.6        417.77   163.6       181.484   -16.4003     
1 1 1 1  26 41 f 1 597.6   102.8 ?      ?    3237.01 5.82867      1075.05  5.82867     94.0349   -174.171     
1 1 1 1  28 41 o 0 586.5   134.1 ?      ?    3655.09 -167.276     890.886  -167.276    343.427   12.7236      
1 1 1 1  30 41 o 0 795.5   164.7 ?      ?    3625.38 -31.2851     1167.68  -31.2851    1.97352   -31.2851     
1 1 1 1  41 2  o 0 702.2   35.9  ?      ?    2548.87 -168.154     2056.98  -168.154    843.186   -168.154     
1 1 1 2  3  41 o 0 4093    129.7 ?      ?    8103.5  71.5972      4323.78  71.5972     668.61    71.5972      
1 1 1 2  5  41 o 0 2692.6  90.3  ?      ?    5324.75 -127.588     4026.86  -127.588    1622.5    -127.588     
1 1 1 2  7  41 o 0 1727    64    ?      ?    5606.59 -50.4548     2597.12  -50.4548    72.7118   -50.4548     
1 1 1 2  9  41 o 0 90.1    27.8  ?      ?    1418.94 -70.7106     48.151   -70.7106    586.397   109.289      
1 1 1 2  11 41 o 0 732.3   41.7  ?      ?    3709.39 48.598       1543.33  48.598      97.7047   -131.402     
1 1 1 2  13 41 o 0 469     39.1  ?      ?    2398.26 -115.977     1306.75  -115.978    262.892   -115.978     
1 1 1 2  15 41 o 0 7285    227   ?      ?    10065.2 91.7028      5812.13  91.7028     1512.75   91.7028      
1 1 1 2  17 41 o 0 3043.1  108.1 ?      ?    5895.89 -76.5038     3869.52  -76.5038    1407.84   -76.5038     
1 1 1 2  19 41 f 1 645.9   51.6  ?      ?    2886.81 -167.258     1463.12  -167.258    266.687   -167.258     
1 1 1 2  21 41 o 0 442     67.4  ?      ?    2216.48 -47.9759     1118.61  -47.9759    232.891   -47.9759     
1 1 1 2  23 41 o 0 1352.4  92.7  ?      ?    5705.75 10.9159      1653.25  10.9159     534.055   -169.084     
1 1 1 2  25 41 o 0 862.7   99    ?      ?    3437.66 -117.309     1559.39  -117.309    298.195   -117.309     
1 1 1 2  27 41 o 0 282     108.4 ?      ?    1579.9  -38.7046     568.549  -38.7046    13.2403   -38.7046     
1 1 1 2  29 41 o 0 887.5   148.1 ?      ?    3315.2  -170.626     1490.87  -170.626    397.182   -170.626     
1 1 1 0  41 3  o 0 18.8    32.7  ?      ?    792.212 -90          45.0717  -90         335.349   90           
1 1 1 2  41 3  o 0 250.4   27.7  ?      ?    3240.02 102.269      355.258  102.269     1181.08   -77.7309     
1 1 1 3  4  41 o 0 680.5   36.9  ?      ?    2503.67 -21.7008     1912.87  -21.7008    783.003   -21.7008     
1 1 1 3  6  41 o 0 1713.3  63.8  ?      ?    4440.4  153.623      3076.68  153.623     1074.91   153.623      
1 1 1 3  8  41 o 0 504.8   33.5  ?      ?    2003.68 -82.5803     1602.68  -82.5803    703.882   -82.5803     
1 1 1 3  10 41 o 0 1635.1  65    ?      ?    6219.77 -76.1359     2162.96  -76.1359    602.344   103.864      
1 1 1 3  12 41 o 0 866.7   47.3  ?      ?    4013.33 26.8899      1686.11  26.8899     72.7952   -153.11      
1 1 1 3  14 41 o 0 17.5    36    ?      ?    725.373 -90.383      187.803  89.617      500.407   89.617       
1 1 1 3  16 41 o 0 979.7   54    ?      ?    4610.7  65.3574      1611.12  65.3574     334.984   -114.643     
1 1 1 3  18 41 o 0 825.5   54    ?      ?    4117.17 -141.935     1428.85  -141.935    289.96    38.0649      
1 1 1 3  20 41 f 1 830.1   62.5  ?      ?    4713.93 -96.6656     1161.79  -96.6656    761.136   83.3344      
1 1 1 3  22 41 o 0 429.7   68    ?      ?    2094.21 158.748      1079.73  158.748     273.946   158.748      
1 1 1 3  24 41 o 0 1104.6  92.4  ?      ?    5370.19 -48.1907     1361.61  -48.1907    656.894   131.809      
1 1 1 3  26 41 o 0 646.2   102.2 ?      ?    4618.05 143.625      750.225  143.625     907.849   -36.3755     
1 1 1 3  28 41 f 1 750.4   120.6 ?      ?    1610.83 -108.123     1649.45  -108.123    1102.38   -108.123     
1 1 1 1  41 4  f 1 100.4   25.7  ?      ?    938.95  78.2306      145.748  78.2306     305.626   -101.769     
1 1 1 3  41 4  o 0 31.8    25.8  ?      ?    199.845 -170.803     48.0553  9.19716     142.251   9.19716      
1 1 1 4  5  41 o 0 955.2   42.8  ?      ?    3859.59 -40.3588     1996.45  -40.3588    257.186   -40.3588     
1 1 1 4  7  41 o 0 232.6   28    ?      ?    1108.22 -84.2889     767.275  -84.2889    269.454   -84.2889     
1 1 1 4  9  41 o 0 3313.9  109   ?      ?    7141.48 123.082      3902.28  123.082     716.876   123.082      
1 1 1 4  11 41 o 0 4188.5  140.3 ?      ?    6806.98 -67.8359     4872.22  -67.8359    1873.66   -67.8359     
1 1 1 4  13 41 f 1 2451    91.3  ?      ?    5210.34 114.459      3610.31  114.459     1336.28   114.459      
1 1 1 4  15 41 f 1 1782.6  74.6  ?      ?    4713.19 -89.2917     2877.34  -89.2917    858.698   -89.2917     
1 1 1 4  17 41 o 0 103.8   41.1  ?      ?    2273.51 41.2904      149.874  -138.71     1109.46   -138.71      
1 1 1 4  19 41 f 1 531.1   53.6  ?      ?    2039.99 171.982      1432.6   171.982     589.577   171.982      
1 1 1 4  21 41 o 0 612.9   68.2  ?      ?    2380.58 -28.8548     1482.02  -28.8548    552.205   -28.8548     
1 1 1 4  23 41 o 0 386.6   75.5  ?      ?    3352.6  -168.827     608.074  -168.827    673.748   11.173       
1 1 1 4  25 41 o 0 19.2    83.6  ?      ?    1911.91 109.823      300.841  -70.1771    1000.55   -70.1771     
1 1 1 4  27 41 o 0 873.5   105.8 ?      ?    2867.05 28.6495      1684.89  28.6495     679.422   28.6495      
1 1 1 4  29 41 f 1 314.7   169.2 ?      ?    1764.94 145.185      549.101  145.185     35.2764   -34.8151     
1 1 1 0  41 5  o 0 285.4   40.2  ?      ?    2560.09 90           1102.59  90          128.742   -90          
1 1 1 2  41 5  o 0 1177    50.1  ?      ?    4531.36 -108.08      2261.41  -108.08     108.847   -108.08      
1 1 1 4  41 5  o 0 510     31.3  ?      ?    2157.17 41.4521      1640.28  41.4521     631.288   41.4521      
1 1 1 5  6  41 o 0 347.3   30.9  ?      ?    2258.66 75.784       1042.14  75.784      27.7308   75.784       
1 1 1 5  8  41 o 0 220.4   31.2  ?      ?    1725.73 -74.0292     685.974  -74.0292    84.9981   105.971      
1 1 1 5  10 41 o 0 1348.2  55.7  ?      ?    3472.1  118.963      2834.03  118.963     1297.01   118.963      
1 1 1 5  12 41 o 0 616.6   42.2  ?      ?    2159.98 -165.278     1771.26  -165.278    828.886   -165.278     
1 1 1 5  14 41 o 0 1657.2  72    ?      ?    4030.86 31.716       2995.35  31.716      1266.31   31.716       
1 1 1 5  16 41 o 0 175.8   41.6  ?      ?    1263.21 55.7666      423.319  55.7666     107.339   -124.233     
1 1 1 5  18 41 o 0 748.4   53.6  ?      ?    3442.28 -174.166     1511.83  -174.166    81.6114   -174.166     
1 1 1 5  20 41 o 0 476.3   58.3  ?      ?    2372.01 50.2019      1185.08  50.2019     227.48    50.2019      
1 1 1 5  22 41 o 0 273     66.6  ?      ?    2334.5  -102.514     562.515  -102.514    343.556   77.4864      
1 1 1 5  24 41 o 0 84.2    102   ?      ?    293.689 -84.7484     14.006   -84.7484    95.8793   95.2516      
1 1 1 5  26 41 o 0 187.5   124.6 ?      ?    1656.78 21.8874      260.334  21.8874     331.885   -158.113     
1 1 1 5  28 41 o 0 19.3    158.7 ?      ?    1089.38 -67.6673     14.3486  -67.6673    351.981   112.333      
1 1 1 1  41 6  f 1 887.3   42.8  ?      ?    4490.51 69.715       1678.1   69.715      479.759   -110.285     
1 1 1 3  41 6  o 0 227.6   28    ?      ?    1340.43 -165.526     799.118  -165.526    167.412   -165.526     
1 1 1 5  41 6  o 0 1561.2  57.7  ?      ?    5000.89 19.0593      2675.85  19.0593     358.614   19.0593      
1 1 1 6  7  41 o 0 1719.6  65.5  ?      ?    4814.95 -141.507     2901.76  -141.507    750.685   -141.507     
1 1 1 6  9  41 o 0 1623.2  63.3  ?      ?    4714.22 -26.6968     2776.36  -26.6968    685.788   -26.6968     
1 1 1 6  11 41 o 0 245.9   37.8  ?      ?    1862    -162.074     701.629  -162.074    113.64    17.9262      
1 1 1 6  13 41 o 0 24      36.9  ?      ?    543.421 -26.6822     129.205  153.318     363.569   153.318      
1 1 1 6  15 41 o 0 -3.8    39.6  ?      ?    835.677 71.96        238.442  -108.04     592.063   -108.04      
1 1 1 6  17 41 o 0 4243.4  148   ?      ?    7944.1  38.6379      4109.64  38.6379     778.561   38.6379      
1 1 1 6  19 41 o 0 2386    105.7 ?      ?    4811.07 -114.236     3396.64  -114.236    1432.69   -114.236     
1 1 1 6  21 41 o 0 268     61.9  ?      ?    2642.66 128.86       468.374  128.86      556.987   -51.1399     
1 1 1 6  23 41 o 0 -89     102   ?      ?    1237.01 67.9224      245.43   -112.078    715.272   -112.078     
1 1 1 6  25 41 o 0 1849.9  139.7 ?      ?    4740.58 -155.85      2525.25  -155.85     801.633   -155.85      
1 1 1 6  27 41 o 0 780.2   150.3 ?      ?    3683.75 15.1825      1264.74  15.1825     2.19706   15.1825      
1 1 1 6  29 41 o 0 420.7   191.9 ?      ?    1814.21 140.387      746.35   140.387     152.804   140.387      
1 1 1 0  41 7  o 0 25.8    41.1  ?      ?    303.698 90           22.6892  90          122.997   -90          
1 1 1 2  41 7  o 0 1829.5  67.1  ?      ?    4366.42 11.5532      3449.73  11.5532     1380.4    11.5532      
1 1 1 4  41 7  o 0 223.2   31.1  ?      ?    1819.89 59.249       710.084  59.249      139.339   -120.751     
1 1 1 6  41 7  o 0 2945.1  95.3  ?      ?    7392.35 -91.706      3476.74  -91.706     89.1761   -91.706      
1 1 1 7  8  41 o 0 1825.4  67.5  ?      ?    5876.5  123.996      2588.28  123.996     18.1619   -56.0039     
1 1 1 7  10 41 o 0 287.3   36.2  ?      ?    1042.64 -66.5393     865.944  -66.5393    408.545   -66.5393     
1 1 1 7  12 41 o 0 611.7   45.8  ?      ?    3944.67 -99.7057     1119.29  -99.7057    588.285   80.2943      
1 1 1 7  14 41 f 1 221     45.3  ?      ?    1902.74 134.105      569.094  134.105     245.102   -45.8946     
1 1 1 7  16 41 o 0 24.3    46.3  ?      ?    1857.96 -89.8127     441.896  90.1873     1226.74   90.1873      
1 1 1 7  18 41 o 0 344.9   58.9  ?      ?    1741.95 -72.3292     967.841  -72.3292    250.134   -72.3292     
1 1 1 7  20 41 o 0 1030.2  75.1  ?      ?    3251.62 -165.325     2040.45  -165.325    738.839   -165.325     
1 1 1 7  22 41 o 0 -39     89    ?      ?    2395.85 -27.3686     512.769  152.631     1434.74   152.631      
1 1 1 7  24 41 o 0 404.1   106.8 ?      ?    3001.15 96.837       694.518  96.837      413.173   -83.163      
1 1 1 7  26 41 o 0 751.2   129.8 ?      ?    2508.86 163.875      1557.98  163.875     668.822   163.875      
1 1 1 7  28 41 o 0 1217.4  178   ?      ?    2946.06 34.7411      2085.78  34.7411     1103.49   34.7411      
1 1 1 1  41 8  o 0 1255.5  49.3  ?      ?    3892.51 -92.8523     2695.36  -92.8523    843.914   -92.8523     
1 1 1 3  41 8  o 0 2856.8  96.4  ?      ?    6000.71 -62.4627     4085.18  -62.4627    1269.4    -62.4627     
1 1 1 5  41 8  o 0 379.5   32.6  ?      ?    3555    -135.346     693.499  -135.346    947.057   44.6536      
1 1 1 7  41 8  o 0 425.2   36.1  ?      ?    3069.62 122.136      1014.75  122.136     373.989   -57.8637     
1 1 1 8  9  41 o 0 2369.9  87.5  ?      ?    7086.1  111.811      2773.16  111.811     336.473   -68.189      
1 1 1 8  11 41 f 1 855.8   51.4  ?      ?    3951.3  -88.1078     1660.4   -88.1078    63.2869   91.8922      
1 1 1 8  13 41 o 0 422.4   45.7  ?      ?    2327.97 -79.0277     1167.9   -79.0277    173.526   -79.0277     
1 1 1 8  15 41 o 0 -53.8   48.2  ?      ?    844.237 122.945      264.138  -57.0552    617.867   -57.0552     
1 1 1 8  17 41 o 0 89.9    50.2  ?      ?    1258.69 28.4843      36.1117  -151.516    558.595   -151.516     
1 1 1 8  19 41 o 0 254.3   63.3  ?      ?    3352.67 150.592      207.684  150.592     1146.94   -29.408      
1 1 1 8  21 41 o 0 176.8   83.6  ?      ?    2673.16 -81.6645     66.9987  -81.6645    959.446   98.3355      
1 1 1 8  23 41 o 0 79.6    96.7  ?      ?    1419.47 -177.317     30.3118  2.68287     563.814   2.68287      
1 1 1 8  25 41 o 0 1007.8  134.9 ?      ?    4629.8  8.45313      1380.04  8.45313     285.58    -171.547     
1 1 1 8  27 41 o 0 789.7   163.9 ?      ?    2496.32 169.9        1561.3   169.9       714.761   169.9        
1 1 1 8  29 41 o 0 57.1    206.2 ?      ?    2659.1  -74.024      83.7468  105.976     944.52    105.976      
1 1 1 0  41 9  o 0 2457.7  132.1 ?      ?    8242.66 90           3293.79  90          632.919   -90          
1 1 1 2  41 9  o 0 2709.5  96.8  ?      ?    5553.13 -159.666     4117     -159.666    1502.5    -159.666     
1 1 1 4  41 9  o 0 1648.4  68.2  ?      ?    5397.71 -159.542     2643.08  -159.542    139.483   -159.542     
1 1 1 6  41 9  o 0 230.4   34.2  ?      ?    2450.66 126.264      545.666  126.264     570.605   -53.7363     
1 1 1 8  41 9  o 0 641.7   46.3  ?      ?    3897.78 -3.9407      1245.32  -3.9407     490.008   176.059      
1 1 1 9  10 41 o 0 456.7   43.3  ?      ?    2454.3  42.9112      1249.17  42.9112     184.044   42.9112      
1 1 1 9  12 41 o 0 1671.2  75.5  ?      ?    5745.26 -176.374     2323.4   -176.374    136.046   3.62614      
1 1 1 9  14 41 f 1 801.1   58.9  ?      ?    5747.56 95.5075      785.032  95.5075     1646.34   -84.4925     
1 1 1 9  16 41 o 0 1242.3  71.9  ?      ?    4010.02 -69.1045     2218.03  -69.1045    543.914   -69.1045     
1 1 1 9  18 41 o 0 362.9   61    ?      ?    2141.6  -108.255     933.629  -108.255    61.797    -108.255     
1 1 1 9  20 41 o 0 10.2    65.2  ?      ?    572.401 53.272       105.724  -126.728    327.58    -126.728     
1 1 1 9  22 41 o 0 640.7   100.8 ?      ?    2299.12 -169.312     1501.52  -169.312    627.678   -169.312     
1 1 1 9  24 41 o 0 -202.1  106.6 ?      ?    1926.78 29.0061      473.971  -150.994    1176.26   -150.994     
1 1 1 9  26 41 o 0 -118.5  142   ?      ?    1677.31 -99.0661     227.044  80.9339     814.02    80.9339      
1 1 1 9  28 41 o 0 -152.2  183.2 ?      ?    1596.4  59.0874      139.882  -120.913    665.425   -120.913     
1 1 1 1  41 10 o 0 7240.8  256.5 ?      ?    11091.6 78.9798      5883.42  78.9798     654.506   78.9798      
1 1 1 3  41 10 o 0 36.3    34.3  ?      ?    1226.93 141.939      258.761  -38.0613    829.603   -38.0613     
1 1 1 5  41 10 o 0 2185.3  82.5  ?      ?    6083.43 59.9701      3091.92  59.9701     307.507   59.9701      
1 1 1 7  41 10 o 0 795.9   47.1  ?      ?    3460.02 -171.66      1789.66  -171.66     239.041   -171.66      
1 1 1 9  41 10 o 0 924.1   50.8  ?      ?    3064.28 -52.3281     2164.94  -52.3281    822.783   -52.3281     
1 1 1 10 11 41 o 0 431.4   48.2  ?      ?    3105.43 140.164      941.214  140.164     388.929   -39.8359     
1 1 1 10 13 41 o 0 431.6   51.6  ?      ?    1632.77 118.554      1326.83  118.554     638.437   118.554      
1 1 1 10 15 41 f 1 1697.1  81.1  ?      ?    4300.63 30.9167      2795.99  30.9167     983.12    30.9167      
1 1 1 10 17 41 o 0 2825.4  124.7 ?      ?    6269.42 -169.115     3323.63  -169.115    756.589   -169.115     
1 1 1 10 19 41 f 1 1060.5  80.1  ?      ?    4181.02 58.9094      1764.76  58.9094     122.729   58.9094      
1 1 1 10 21 41 o 0 239.7   94.1  ?      ?    2037.3  87.4468      437.239  87.4468     344.371   -92.5532     
1 1 1 10 23 41 f 1 -40.6   116.4 ?      ?    2636.6  -106.106     471.427  73.8943     1448.72   73.8943      
1 1 1 10 25 41 o 0 429.6   140.7 ?      ?    1831.65 -47.6844     943.786  -47.6844    294.405   -47.6844     
1 1 1 10 27 41 o 0 72.8    170.2 ?      ?    1070.67 44.3481      97.8335  44.3481     259.912   -135.652     
1 1 1 0  41 11 o 0 5173.1  235.3 ?      ?    10558.5 -90          4721.61  -90         251.818   90           
1 1 1 2  41 11 o 0 1917.7  73.7  ?      ?    6210.08 24.399       2705.72  24.399      186.596   -155.601     
1 1 1 4  41 11 o 0 1240.8  59    ?      ?    4572.15 9.89635      2270.69  9.89635     175.194   9.89635      
1 1 1 6  41 11 o 0 268.4   37.5  ?      ?    2180.38 -119.061     738.635  -119.061    243.021   60.9387      
1 1 1 8  41 11 f 1 194.6   39.6  ?      ?    1038.84 -87.5129     507.762  -87.5129    47.2348   -87.5129     
1 1 1 10 41 11 o 0 271.4   43.9  ?      ?    2760.12 113.648      541.44   113.648     645.776   -66.3524     
1 1 1 11 12 41 o 0 841.9   59.3  ?      ?    3588.63 -64.8422     1728.65  -64.8422    214.639   -64.8422     
1 1 1 11 14 41 o 0 298.2   52.1  ?      ?    2950.72 -172.499     518.722  -172.499    721.041   7.50089      
1 1 1 11 16 41 o 0 748.9   63.5  ?      ?    3225.01 67.0436      1569.98  67.0436     244.099   67.0436      
1 1 1 11 18 41 o 0 -73.4   64.4  ?      ?    246.186 126.282      67.5655  -53.7177    166.225   -53.7177     
1 1 1 11 20 41 o 0 -181.5  62.8  ?      ?    797.38  103.062      257.272  -76.9382    565.508   -76.9382     
1 1 1 11 22 41 o 0 -39.5   25.1  ?      ?    1695.98 -74.0729     571.97   105.927     1206.14   105.927      
1 1 1 11 24 41 f 1 283.8   131.5 ?      ?    1879.3  68.5999      522.459  68.5999     155.073   -111.4       
1 1 1 11 26 41 o 0 964.3   171.8 ?      ?    2810.73 -60.9164     1771.57  -60.9164    820.193   -60.9164     
1 1 1 11 28 41 o 0 101.1   220.2 ?      ?    2905.82 -106.091     61.0277  73.9094     1001.5    73.9094      
1 1 1 1  41 12 o 0 352.6   39.2  ?      ?    2479.79 -158.367     988.251  -158.367    163.722   21.6332      
1 1 1 3  41 12 o 0 175.8   42.2  ?      ?    330.142 -94.0728     191.744  -94.0728    40.315    -94.0728     
1 1 1 5  41 12 o 0 45.9    38    ?      ?    1447.71 -141.171     280.233  38.829      933.725   38.829       
1 1 1 7  41 12 o 0 160.6   40.6  ?      ?    1466.8  -130.295     371.193  -130.295    278.26    49.7049      
1 1 1 9  41 12 o 0 419.1   44.4  ?      ?    2867.41 -4.14839     999.935  -4.14839    241.191   175.852      
1 1 1 11 41 12 o 0 558.1   52.8  ?      ?    1625.21 178.057      1674.15  178.057     988.901   178.057      
1 1 1 12 13 41 o 0 283.3   48.8  ?      ?    1790.8  56.4322      775.203  56.4322     22.2603   56.4322      
1 1 1 12 15 41 f 1 13.4    53.9  ?      ?    1609.79 -151.965     366.445  28.0353     1033.6    28.0353      
1 1 1 12 17 41 o 0 63.3    64.6  ?      ?    1567.63 -1.67703     160.727  178.323     791.531   178.323      
1 1 1 12 19 41 o 0 252.8   71.9  ?      ?    2289.05 24.4057      492.614  24.4057     385.574   -155.594     
1 1 1 12 21 41 o 0 161.4   103   ?      ?    2193.51 -98.9257     111.853  -98.9257    714.56    81.0743      
1 1 1 12 23 41 f 1 56      124.8 ?      ?    1726.52 -157.423     71.777   22.5768     700.028   22.5768      
1 1 1 12 25 41 o 0 -285.4  150.8 ?      ?    1400.98 -177.826     256.186  2.17388     735.657   2.17388      
1 1 1 12 27 41 o 0 -27.8   184.8 ?      ?    1504.46 155.626      23.7315  -24.3736    516.938   -24.3736     
1 1 1 0  41 13 o 0 -23.3   54.7  ?      ?    1418.87 90           59.4859  90          597.465   -90          
1 1 1 2  41 13 o 0 80.9    38.8  ?      ?    1527    -96.3189     102.895  83.6811     802.362   83.6811      
1 1 1 4  41 13 f 1 755.2   50.2  ?      ?    3214.8  -143.894     1797.6   -143.894    337.456   -143.894     
1 1 1 6  41 13 o 0 720.1   51.6  ?      ?    3518.12 75.865       1576.13  75.865      14.6924   75.865       
1 1 1 8  41 13 o 0 484     48.4  ?      ?    2425.58 -1.43813     1336.9   -1.43813    282.544   -1.43813     
1 1 1 10 41 13 o 0 930.5   56.7  ?      ?    3636.55 -115.532     1898.5   -115.532    355.721   -115.532     
1 1 1 12 41 13 o 0 1284.2  69.6  ?      ?    4875.9  99.706       1959.01  99.706      80.4204   -80.294      
1 1 1 13 14 41 o 0 216.3   55.1  ?      ?    3113.84 -48.5276     155.333  -48.5276    1128.81   131.472      
1 1 1 13 16 41 o 0 137.5   66.1  ?      ?    1553.93 -168.923     143.099  -168.923    483.679   11.0772      
1 1 1 13 18 41 o 0 135     67.4  ?      ?    2746.91 29.899       126.755  -150.101    1184.89   -150.101     
1 1 1 13 20 41 o 0 -6.9    78.2  ?      ?    1793.55 -143.914     344.095  36.0865     1023.72   36.0865      
1 1 1 13 22 41 o 0 -153.5  119.9 ?      ?    956.137 62.7422      184.759  -117.258    533.318   -117.258     
1 1 1 13 24 41 o 0 194     147.1 ?      ?    2040.9  167.761      264.762  167.761     451.906   -12.2394     
1 1 1 13 26 41 o 0 -52.7   178.4 ?      ?    1953.92 -71.9833     111.095  108.017     758.688   108.017      
1 1 1 1  41 14 o 0 -73.8   40.8  ?      ?    1088.58 47.6592      413.318  -132.341    910.193   -132.341     
1 1 1 3  41 14 o 0 -20.6   42.9  ?      ?    839.685 -166.683     267.088  13.317      645.727   13.317       
1 1 1 5  41 14 o 0 27.4    44.5  ?      ?    643.013 75.3667      135.347  -104.633    420.826   -104.633     
1 1 1 7  41 14 f 1 1052    57.7  ?      ?    3408    -116.323     2267.37  -116.323    774.314   -116.323     
1 1 1 9  41 14 f 1 -57.1   46.2  ?      ?    2334.27 9.57636      787.097  -170.424    1787.09   -170.424     
1 1 1 11 41 14 o 0 395.1   52.8  ?      ?    1649.22 94.4765      1160.35  94.4765     466.323   94.4765      
1 1 1 13 41 14 o 0 650.8   61.7  ?      ?    3334.16 131.371      1311.87  131.371     50.0148   -48.6292     
1 1 1 14 15 41 o 0 808.2   72.4  ?      ?    2905.58 -69.5136     1762.26  -69.5136    589.487   -69.5136     
1 1 1 14 17 41 o 0 329.7   74    ?      ?    3602.69 155.98       368.273  155.98      1022.75   -24.02       
1 1 1 14 19 41 o 0 97.1    75.3  ?      ?    920.942 -90.4733     11.8996  -90.4733    338.469   89.5267      
1 1 1 14 21 41 o 0 378.7   89.3  ?      ?    2533.41 73.7026      768.057  73.7026     160.75    -106.297     
1 1 1 14 23 41 o 0 -29.3   34.8  ?      ?    640.526 177.978      186.137  -2.0224     412.722   -2.0224      
1 1 1 14 25 41 o 0 -124.5  188   ?      ?    2425.55 -13.7337     246.099  166.266     1057.33   166.266      
1 1 1 0  41 15 f 1 718     72.2  ?      ?    1342.35 -90          1586.06  -90         973.495   -90          
1 1 1 2  41 15 o 0 2069.5  83.2  ?      ?    6193.74 21.0314      2825.17  21.0314     42.7607   21.0314      
1 1 1 4  41 15 f 1 342.1   50.7  ?      ?    1123.18 173.66       1087.79  173.66      587.218   173.66       
1 1 1 6  41 15 o 0 643.8   53.5  ?      ?    3368.28 108.565      1424.17  108.565     43.3716   -71.4348     
1 1 1 8  41 15 o 0 1092.9  62.5  ?      ?    3886.33 -174.568     2119.81  -174.568    460.873   -174.568     
1 1 1 10 41 15 f 1 766.8   58.2  ?      ?    4011.77 9.73905      1354.39  9.73905     350.223   -170.261     
1 1 1 12 41 15 f 1 322.7   52.7  ?      ?    3577.53 69.0705      365.586  69.0704     1112.89   -110.93      
1 1 1 14 41 15 o 0 -13.5   58.1  ?      ?    246.25  -31.058      56.8767  148.942     154.913   148.942      
1 1 1 15 16 41 o 0 104     67.7  ?      ?    2339.76 61.4159      166.457  -118.584    1070.41   -118.584     
1 1 1 15 18 41 o 0 262.9   82    ?      ?    2293.19 -137.142     511.272  -137.142    363.13    42.8577      
1 1 1 15 20 41 o 0 71.5    85.5  ?      ?    1486.78 80.3992      104.063  -99.6008    651.281   -99.6008     
1 1 1 15 22 41 o 0 119.7   150.4 ?      ?    1576.21 -141.671     135.05   -141.671    425.635   38.3289      
1 1 1 15 24 41 o 0 -59.6   31.7  ?      ?    1739.95 -165.275     523.256  14.7252     1109.4    14.7252      
1 1 1 15 26 41 o 0 -448.5  209   ?      ?    1727.7  -138.395     265.324  41.6052     823.57    41.6052      
1 1 1 1  41 16 o 0 1953.8  80.4  ?      ?    5607.78 -98.8784     2896.79  -98.8784    392.874   -98.8784     
1 1 1 3  41 16 o 0 330     49.4  ?      ?    3237    -54.7834     594.747  -54.7834    834.074   125.217      
1 1 1 5  41 16 o 0 274.8   51.4  ?      ?    1478.86 -41.5292     847.73   -41.5292    204.69    -41.5292     
1 1 1 7  41 16 o 0 2124.6  93    ?      ?    5084.86 39.603       3165.32  39.603      964.716   39.603       
1 1 1 9  41 16 o 0 -55.2   48.5  ?      ?    1625.53 146.946      530.685  -33.0538    1218.82   -33.0538     
1 1 1 11 41 16 o 0 1351.3  74.4  ?      ?    4262.89 -61.8592     2270.17  -61.8592    511.408   -61.8592     
1 1 1 13 41 16 o 0 1746.5  85    ?      ?    5604.19 -48.0027     2256.57  -48.0027    11.875    -48.0027     
1 1 1 15 41 16 o 0 983.9   84.7  ?      ?    4207.15 -175.322     1584.36  -175.322    12.5966   4.67816      
1 1 1 16 17 41 o 0 857.9   97    ?      ?    3669.17 31.9701      1541.55  31.9701     141.781   31.9701      
1 1 1 16 19 41 o 0 91      94.3  ?      ?    1344.8  -4.1368      17.6852  175.863     513.699   175.863      
1 1 1 16 21 41 o 0 971.1   122   ?      ?    4974.54 126.534      1207.94  126.534     568.252   -53.4662     
1 1 1 16 23 41 o 0 608.1   181.2 ?      ?    3760.54 -51.894      863.024  -51.894     410.671   128.106      
1 1 1 16 25 41 o 0 3805.7  282.4 ?      ?    8129.46 144.098      2934.3   144.098     288.967   144.098      
1 1 1 0  41 17 o 0 121.9   75.2  ?      ?    929.691 90           213.306  90          198.307   -90          
1 1 1 2  41 17 o 0 2008.4  83.8  ?      ?    7080.6  -176.061     2296.8   -176.061    809.017   3.93894      
1 1 1 4  41 17 o 0 714.4   59    ?      ?    2436.75 -115.484     1872.18  -115.484    802.414   -115.484     
1 1 1 6  41 17 o 0 680.7   59.8  ?      ?    3244.13 -38.1098     1490.09  -38.1098    89.1733   -38.1098     
1 1 1 8  41 17 o 0 642.9   63    ?      ?    4162.74 -30.5733     1031.1   -30.5733    730.788   149.427      
1 1 1 10 41 17 o 0 112.1   62.2  ?      ?    3093.28 125.137      348.289  -54.863     1626.85   -54.863      
1 1 1 12 41 17 o 0 793.5   67.7  ?      ?    3560.45 -156.514     1507.24  -156.514    75.5311   -156.514     
1 1 1 14 41 17 o 0 751     76.9  ?      ?    2080.97 -143.156     1804.49  -143.156    1009.74   -143.156     
1 1 1 16 41 17 o 0 1956.5  115.8 ?      ?    3550.25 -118.753     3124.47  -118.753    1798.63   -118.753     
1 1 1 17 18 41 o 0 -134.8  89.1  ?      ?    2814.44 129.992      739.206  -50.0076    1777.65   -50.0076     
1 1 1 17 20 41 o 0 983.9   122.4 ?      ?    3724.07 -57.7828     1631.68  -57.7828    299.359   -57.7828     
1 1 1 17 22 41 f 1 1938.4  164.1 ?      ?    6151.3  76.8254      2065.59  76.8254     37.142    -103.175     
1 1 1 17 24 41 o 0 152     189.9 ?      ?    1824.57 138.273      204.234  138.273     392.58    -41.7271     
1 1 1 1  41 18 o 0 1021    64    ?      ?    3142.74 -131.763     2275.78  -131.763    890.16    -131.763     
1 1 1 3  41 18 o 0 1038.5  67.4  ?      ?    3700.86 81.0227      2073.64  81.0227     459.419   81.0227      
1 1 1 5  41 18 o 0 1444.2  78.3  ?      ?    3653.81 -147.385     2747.28  -147.385    1176.37   -147.385     
1 1 1 7  41 18 o 0 -43.1   56.6  ?      ?    1157.83 152.372      335.208  -27.6278    824.115   -27.6278     
1 1 1 9  41 18 o 0 885     71.9  ?      ?    3395.71 -80.7734     1787.33  -80.7734    384.191   -80.7734     
1 1 1 11 41 18 o 0 2768.9  116   ?      ?    6487.23 74.5592      3127.76  74.5592     514.477   74.5592      
1 1 1 13 41 18 o 0 2451.3  111.4 ?      ?    6312.86 101.952      2809.03  101.952     388.565   101.952      
1 1 1 15 41 18 o 0 300.9   83.4  ?      ?    885.573 166.752      619.724  166.752     286.951   166.752      
1 1 1 17 41 18 o 0 -292.2  97.3  ?      ?    1682.04 84.8158      466.629  -95.1842    1072.11   -95.1842     
1 1 1 18 19 41 o 0 14.4    111.7 ?      ?    680.931 -176.717     45.9001  3.28307     289.549   3.28307      
1 1 1 18 21 41 o 0 402.4   139.3 ?      ?    4079.72 -78.4984     321.046  -78.4984    1068.15   101.502      
1 1 1 18 23 41 f 1 940.9   162.9 ?      ?    2152.27 -2.3024      1824.23  -2.3024     1113.86   -2.3024      
1 1 1 0  41 19 o 0 2847.7  156.7 ?      ?    5449.62 90           3201.86  90          825.792   90           
1 1 1 2  41 19 f 1 1540    83.4  ?      ?    4523.77 -77.5725     2559.78  -77.5725    592.956   -77.5725     
1 1 1 4  41 19 f 1 855.7   75    ?      ?    4040.48 109.426      1536.88  109.426     198.486   -70.5742     
1 1 1 6  41 19 o 0 1723    95    ?      ?    4863.51 129.358      2625.19  129.358     580.851   129.358      
1 1 1 8  41 19 o 0 107.1   73.9  ?      ?    694.211 -143.295     60.141   -143.295    226.007   36.7053      
1 1 1 10 41 19 f 1 1481.2  93.2  ?      ?    4816.2  -41.7558     2210.42  -41.7558    298.751   -41.7558     
1 1 1 12 41 19 o 0 419.4   80.7  ?      ?    4299.61 -13.2685     385.173  -13.2685    1266.3    166.731      
1 1 1 14 41 19 o 0 203.5   91.4  ?      ?    1729.42 58.2875      335.229  58.2875     317.241   -121.713     
1 1 1 16 41 19 o 0 476     108.1 ?      ?    2457.97 92.8779      1012.66  92.8779     122.252   92.8779      
1 1 1 18 41 19 o 0 323.5   127.2 ?      ?    1367.71 -30.9315     640.889  -30.9315    164.906   -30.9315     
1 1 1 19 20 41 o 0 522.2   150.6 ?      ?    3253.34 102.558      866.326  102.558     241.407   -77.4418     
1 1 1 19 22 41 o 0 2694.3  227.5 ?      ?    5888.71 -114.457     2800.1   -114.457    864.487   -114.457     
1 1 1 1  41 20 f 1 397.7   68.4  ?      ?    3329.45 67.9574      698.668  67.9574     732.611   -112.043     
1 1 1 3  41 20 f 1 -157.6  71.9  ?      ?    584.758 26.4599      187.968  -153.54     436.862   -153.54      
1 1 1 5  41 20 o 0 1360.7  95.3  ?      ?    4710.6  40.9683      2130.43  40.9683     163.836   40.9683      
1 1 1 7  41 20 o 0 201.2   72.4  ?      ?    2188.4  -25.2239     317.679  -25.2239    580.141   154.776      
1 1 1 9  41 20 o 0 972.1   85.8  ?      ?    3177.51 -158.174     1972.04  -158.174    721.1     -158.174     
1 1 1 11 41 20 o 0 -86.6   83.4  ?      ?    828.535 42.748       197.645  -137.252    520.031   -137.252     
1 1 1 13 41 20 o 0 761.3   100.5 ?      ?    3460.41 -114.605     1407.68  -114.605    99.7999   -114.605     
1 1 1 15 41 20 o 0 71.2    103.5 ?      ?    1620.76 46.8907      84.4472  -133.109    673.975   -133.109     
1 1 1 17 41 20 o 0 49      131   ?      ?    684.951 -95.4385     12.5723  -95.4385    227.35    84.5615      
1 1 1 19 41 20 o 0 90.4    148.3 ?      ?    148.847 -138.006     19.4156  -138.006    29.7404   41.994       
1 1 1 20 21 41 o 0 -79.3   186.9 ?      ?    1412.88 -124.225     46.1762  55.7747     510.432   55.7747      
1 1 1 0  41 21 o 0 902.4   114.5 ?      ?    3955.74 -90          1729.31  -90         61.6639   -90          
1 1 1 2  41 21 o 0 187.3   76.9  ?      ?    2319.33 144.5        224.358  144.5       746.092   -35.4995     
1 1 1 4  41 21 o 0 15.7    76.9  ?      ?    1977.85 -90.0154     368.675  89.9846     1170.62   89.9846      
1 1 1 6  41 21 o 0 441.5   87.9  ?      ?    2201.84 -45.552      1114.86  -45.552     235.597   -45.552      
1 1 1 8  41 21 o 0 18.1    83.8  ?      ?    1609.82 177.093      240.589  -2.90674    871.32    -2.90674     
1 1 1 10 41 21 o 0 -76.8   80    ?      ?    665.806 -168.423     159.029  11.5767     417.419   11.5767      
1 1 1 12 41 21 o 0 574.6   90.3  ?      ?    2287.49 -135.908     1358.56  -135.908    494.356   -135.908     
1 1 1 14 41 21 o 0 306.9   111.1 ?      ?    2285.26 141.358      544.391  141.358     288.384   -38.6418     
1 1 1 16 41 21 o 0 389.4   120.5 ?      ?    1244.87 160.882      865.872  160.882     427.979   160.882      
1 1 1 18 41 21 o 0 1137.1  155.7 ?      ?    3972.26 -40.454      1705.31  -40.454     384.7     -40.454      
1 1 1 20 41 21 o 0 -132.4  169.1 ?      ?    1517.15 118.904      136.642  -61.0963    618.977   -61.0963     
1 1 1 1  41 22 o 0 326     82.1  ?      ?    2860.68 -45.8014     609.609  -45.8014    547.276   134.199      
1 1 1 3  41 22 o 0 4662.8  180   ?      ?    7732.19 156.283      4491.75  156.283     1392.85   156.283      
1 1 1 5  41 22 o 0 1195.1  99.6  ?      ?    4264.03 -11.6665     2013.12  -11.6665    303.462   -11.6665     
1 1 1 7  41 22 o 0 817.6   104.3 ?      ?    2764.17 -164.951     1803.88  -164.951    714.05    -164.951     
1 1 1 9  41 22 o 0 444.4   101.7 ?      ?    2830    20.6943      909.426  20.6943     183.518   -159.306     
1 1 1 11 41 22 o 0 246.1   102.2 ?      ?    2712.5  142.674      286.581  142.674     735.482   -37.3258     
1 1 1 13 41 22 o 0 -156.3  114.8 ?      ?    1956.36 -2.84204     424.701  177.158     1137.35   177.158      
1 1 1 15 41 22 o 0 361.6   137.4 ?      ?    3558.17 102.672      346.314  102.672     907.741   -77.3279     
1 1 1 17 41 22 f 1 1040    166.4 ?      ?    4008.78 -131.246     1542.64  -131.246    196.483   -131.246     
1 1 1 19 41 22 o 0 -285    179.2 ?      ?    1364.16 -81.5683     181.035  98.4317     617.738   98.4317      
1 1 1 0  41 23 o 0 892.5   136.4 ?      ?    3448.8  90           1668.19  90          278.057   90           
1 1 1 2  41 23 o 0 1820.1  114.1 ?      ?    4611.68 -54.6373     2795.16  -54.6373    948.344   -54.6373     
1 1 1 4  41 23 o 0 836.2   96.8  ?      ?    2503.07 77.1019      1927.69  77.1019     935.806   77.1019      
1 1 1 6  41 23 o 0 93.1    94.5  ?      ?    1048.17 -108.436     23.3804  -108.436    386       71.564       
1 1 1 8  41 23 o 0 1385.1  121   ?      ?    4646.33 83.1156      2067.16  83.1156     285.566   83.1156      
1 1 1 10 41 23 f 1 237.6   108.5 ?      ?    2093.7  -88.2173     356.297  -88.2173    429.18    91.7827      
1 1 1 12 41 23 f 1 765.1   134.3 ?      ?    2881.54 -18.2598     1500.88  -18.2598    448.07    -18.2598     
1 1 1 14 41 23 o 0 -11.2   142.5 ?      ?    2104.31 174.237      181.61   -5.76335    923.03    -5.76335     
1 1 1 16 41 23 o 0 663.1   167.7 ?      ?    2072.06 -33.2311     1386.64  -33.2311    693.296   -33.2311     
1 1 1 18 41 23 f 1 1060.5  183.6 ?      ?    3457.26 139.929      1643     139.929     524.89    139.929      
1 1 1 1  41 24 o 0 1167.7  108   ?      ?    2461.45 173.827      2510.93  173.827     1541.6    173.827      
1 1 1 3  41 24 o 0 524.8   99.9  ?      ?    2264.62 -36.9934     1283.24  -36.9934    398.549   -36.9934     
1 1 1 5  41 24 o 0 -111.3  96    ?      ?    2397.87 123.765      587.551  -56.235     1513.04   -56.235      
1 1 1 7  41 24 o 0 -291.1  104.6 ?      ?    632.983 7.38607      175.467  -172.614    414.661   -172.614     
1 1 1 9  41 24 o 0 33.6    118.4 ?      ?    628.888 103.845      20.1464  -76.155     253.067   -76.155      
1 1 1 11 41 24 f 1 198.9   129   ?      ?    1281.73 -81.3634     303.761  -81.3634    162.238   98.6366      
1 1 1 13 41 24 o 0 88.7    149.2 ?      ?    1214.64 167.818      105.988  167.818     320.864   -12.1819     
1 1 1 15 41 24 o 0 -45.5   169.5 ?      ?    1094.4  44.8059      27.2382  -135.194    393.364   -135.194     
1 1 1 17 41 24 o 0 406.5   188.5 ?      ?    2347.16 163.04       654.985  163.04      101.555   -16.9599     
1 1 1 0  41 25 o 0 -43.5   154.6 ?      ?    1163.89 90           97.5921  90          349.638   -90          
1 1 1 2  41 25 o 0 35.4    105.7 ?      ?    1496.54 154.306      137.996  -25.6937    709.948   -25.6937     
1 1 1 4  41 25 o 0 -303.2  112.4 ?      ?    960.021 104.072      258.045  -75.9284    621.45    -75.9284     
1 1 1 6  41 25 o 0 131.5   122.5 ?      ?    2552    58.6875      59.4849  -121.312    1012.4    -121.312     
1 1 1 8  41 25 o 0 526.8   125.9 ?      ?    1902.06 -31.9028     1247.2   -31.9028    549.456   -31.9028     
1 1 1 10 41 25 o 0 114.1   134.2 ?      ?    1541.34 -122.677     106.228  -122.677    446.983   57.323       
1 1 1 12 41 25 o 0 1303.7  162.2 ?      ?    3358.66 113.978      2179.88  113.978     1024.59   113.978      
1 1 1 14 41 25 o 0 2357.8  200.5 ?      ?    4711.77 -73.1782     2901.07  -73.1782    1328.73   -73.1782     
1 1 1 16 41 25 o 0 1246.9  197.9 ?      ?    4669.61 81.3927      1532.99  81.3927     27.9747   81.3927      
1 1 1 1  41 26 f 1 -134.7  115.5 ?      ?    12.2101 -93.8015     2.3374   86.1985     6.93936   86.1985      
1 1 1 3  41 26 o 0 123.4   122.8 ?      ?    1716.27 15.8477      79.415   15.8477     559.341   -164.152     
1 1 1 5  41 26 o 0 -36.5   127.6 ?      ?    1859.43 -82.9759     232.161  97.0241     916.513   97.0241      
1 1 1 7  41 26 o 0 1372.2  150.8 ?      ?    4515.65 1.77526      1980.54  1.77526     343.815   1.77526      
1 1 1 9  41 26 o 0 1648.5  159.9 ?      ?    4203.44 -157.172     2404.2   -157.172    909.957   -157.172     
1 1 1 11 41 26 o 0 391.4   176.9 ?      ?    546.501 20.6179      459.995  20.6179     273.369   20.6179      
1 1 1 13 41 26 o 0 401.5   185.1 ?      ?    3157.22 82.1316      495.043  82.1316     553.457   -97.8684     
1 1 1 15 41 26 o 0 -91.6   202.2 ?      ?    3412.06 -70.5384     425.975  109.462     1523.05   109.462      
1 1 1 0  41 27 o 0 312.9   182.5 ?      ?    2931.66 -90          689.825  -90         384.633   90           
1 1 1 2  41 27 o 0 589.3   143.5 ?      ?    3204.93 48.2039      1072.93  48.2039     96.6983   -131.796     
1 1 1 4  41 27 o 0 601.7   140.1 ?      ?    4137.91 -145.698     808.882  -145.698    688.357   34.3022      
1 1 1 6  41 27 o 0 446.4   155   ?      ?    1912.61 -2.11392     967.349  -2.11391    295.291   -2.11391     
1 1 1 8  41 27 o 0 92.7    143.5 ?      ?    1119.12 -116.991     86.342   -116.991    300.278   63.0094      
1 1 1 10 41 27 o 0 142     177.6 ?      ?    707.392 41.3561      160.983  41.3561     78.2725   -138.644     
1 1 1 12 41 27 o 0 -223    187.6 ?      ?    2364.86 -112.396     321.662  67.6038     1101.39   67.6038      
1 1 1 1  41 28 o 0 745.3   167.2 ?      ?    1633.42 -110.169     1668.23  -110.169    1094.87   -110.169     
1 1 1 3  41 28 f 1 452.4   153.6 ?      ?    2870.02 80.7733      769.478  80.7733     237.74    -99.2267     
1 1 1 5  41 28 o 0 723.1   153   ?      ?    4115    -173.233     1024.45  -173.233    397.024   6.76699      
1 1 1 7  41 28 o 0 -6.2    165.2 ?      ?    2351.96 -42.9555     158.781  137.044     959.576   137.044      
1 1 1 9  41 28 o 0 1956.7  200.5 ?      ?    5236.61 130.295      2311.46  130.295     561.551   130.295      
1 1 1 11 41 28 o 0 -30     210.8 ?      ?    2693.38 27.5115      182.797  -152.488    1062.36   -152.488     
1 1 1 0  41 29 o 0 -164.3  244.2 ?      ?    1877.39 -90          165.942  -90         476.648   90           
1 1 1 2  41 29 o 0 172.4   191.3 ?      ?    716.924 -150.896     208.962  -150.896    35.6805   29.1043      
1 1 1 4  41 29 f 1 1892.8  194   ?      ?    5311.65 29.0001      2246.51  29          437.326   29           
1 1 1 6  41 29 o 0 181.4   178.9 ?      ?    1445.21 141.968      256.258  141.968     227.461   -38.0318     
1 1 1 8  41 29 o 0 -367.5  205.8 ?      ?    1311.49 -33.2347     174.491  146.765     606.414   146.765      
1 1 1 1  41 30 o 0 -213    210.5 ?      ?    972.639 103.616      65.9795  -76.3843    389.612   -76.3843     
1 1 1 0  42 0  o 0 2923.7  215.7 ?      ?    7893.18 -180         3430.09  180         172.657   1.71598e-12  
1 1 1 0  2  42 o 0 -31.4   39.9  ?      ?    692.972 -2.82103e-13 18.5669  0           279.28    180          
1 1 1 0  4  42 o 0 298.9   47.5  ?      ?    3415.82 -180         1026.47  180         446.814   2.69673e-14  
1 1 1 0  6  42 o 0 4327.6  197.1 ?      ?    7686.05 -7.86014e-15 3954.36  0           640.925   4.06351e-14  
1 1 1 0  8  42 f 1 170.4   48.3  ?      ?    2715.01 180          694.308  180         475.694   7.70928e-15  
1 1 1 0  10 42 o 0 659.5   63.9  ?      ?    2041.58 -180         1499.03  180         631.615   180          
1 1 1 0  12 42 o 0 55.8    49.7  ?      ?    1905.28 1.19919e-14  179.679  0           619.705   -180         
1 1 1 0  14 42 o 0 772.8   72.9  ?      ?    3767.1  -7.24185e-15 1597.41  0           42.9744   2.61947e-13  
1 1 1 0  16 42 o 0 350.4   63.1  ?      ?    2739.04 180          1020.08  180         102.358   -3.97838e-14 
1 1 1 0  18 42 o 0 228.9   76    ?      ?    2169    -1.276e-14   685.203  0           181.878   180          
1 1 1 0  20 42 o 0 171.4   75.9  ?      ?    466.266 -180         133.677  180         43.8253   5.07672e-13  
1 1 1 0  22 42 o 0 132.6   114.9 ?      ?    1634.56 180          264.46   180         345.757   -6.58305e-14 
1 1 1 0  24 42 o 0 -262.2  140.1 ?      ?    678.003 -2.0963e-14  24.4561  0           218.243   180          
1 1 1 0  26 42 o 0 49.9    180.1 ?      ?    1469.39 180          179.583  180         325.282   -2.00024e-14 
1 1 1 0  28 42 o 0 -361.5  213.1 ?      ?    1778.68 180          87.259   180         487.409   -3.08956e-14 
1 1 1 1  42 1  o 0 852.7   43.3  ?      ?    2761.47 106.651      2236.71  106.651     978.013   106.651      
1 1 1 1  3  42 o 0 284.6   31.9  ?      ?    3305.55 6.16067      425.832  6.16067     1000.41   -173.839     
1 1 1 1  5  42 o 0 462.8   37.2  ?      ?    2656.14 124.162      1224.16  124.162     76.5812   124.162      
1 1 1 1  7  42 o 0 2632.5  92.3  ?      ?    6980.51 -73.9445     3079.55  -73.9445    76.0026   -73.9445     
1 1 1 1  9  42 o 0 1085.3  54.9  ?      ?    4797.68 145.501      1754.82  145.501     295.928   -34.4987     
1 1 1 1  11 42 o 0 2288.3  87.4  ?      ?    4818.08 22.7373      3488.25  22.7373     1450.5    22.7373      
1 1 1 1  13 42 f 1 1193.5  58.4  ?      ?    5410.79 -115.635     1645.65  -115.635    622.289   64.3649      
1 1 1 1  15 42 f 1 211.8   43    ?      ?    1999.85 8.92546      456.601  8.92546     377.579   -171.075     
1 1 1 1  17 42 o 0 12.9    48.3  ?      ?    1800    -3.90699     434.306  176.093     1164.16   176.093      
1 1 1 1  19 42 f 1 38.3    52.3  ?      ?    2333.41 137.743      469.218  -42.2572    1395.61   -42.2572     
1 1 1 1  21 42 o 0 353.2   76.9  ?      ?    2548.45 35.0243      744.028  35.0243     225.093   -144.976     
1 1 1 1  23 42 o 0 866.6   97.2  ?      ?    4853.82 -132.704     1107.83  -132.704    665.857   47.2962      
1 1 1 1  25 42 o 0 773.1   108.9 ?      ?    4223.43 92.2475      1101.62  92.2475     382.967   -87.7525     
1 1 1 1  27 42 o 0 147.9   133.7 ?      ?    2179.2  -45.1871     87.9299  -45.1871    633.951   134.813      
1 1 1 0  42 2  o 0 293.9   49.7  ?      ?    2573.5  2.42879e-14  1067.3   0           116.758   -180         
1 1 1 2  42 2  o 0 126.9   29.7  ?      ?    2145.2  -114.43      126.16   -114.43     848.569   65.5699      
1 1 1 2  4  42 o 0 451.3   32.4  ?      ?    3665.62 8.1222       821.246  8.1222      763.271   -171.878     
1 1 1 2  6  42 o 0 -36.3   31.4  ?      ?    1108.28 -166.152     391.168  13.8478     869.862   13.8478      
1 1 1 2  8  42 f 1 740.1   43.6  ?      ?    485.423 116.124      1526.66  116.124     1317.12   116.124      
1 1 1 2  10 42 o 0 275.4   39.9  ?      ?    1147.27 -161.991     818.752  -161.991    330.546   -161.991     
1 1 1 2  12 42 o 0 372.9   38.4  ?      ?    3309.48 -84.3629     681.416  -84.3629    709.183   95.6371      
1 1 1 2  14 42 o 0 4011.7  133.5 ?      ?    7570.84 178.618      4101.07  178.618     972.414   178.618      
1 1 1 2  16 42 o 0 4111.8  140.7 ?      ?    6219.88 -17.4374     4594.16  -17.4374    2041.34   -17.4374     
1 1 1 2  18 42 o 0 296.4   50.5  ?      ?    1842.58 -10.1902     772.898  -10.1902    35.0635   -10.1902     
1 1 1 2  20 42 o 0 1185.2  79.8  ?      ?    3756.46 -156.951     2078.03  -156.951    645.316   -156.951     
1 1 1 2  22 42 o 0 278     77.5  ?      ?    1585.31 -178.725     652.832  -178.725    59.7558   -178.725     
1 1 1 2  24 42 o 0 406.8   96.5  ?      ?    2738.07 29.2832      773.653  29.2832     208.798   -150.717     
1 1 1 2  26 42 o 0 912.6   122.6 ?      ?    4542.99 -128.339     1236.99  -128.339    302.476   51.6607      
1 1 1 2  28 42 o 0 106.3   188.2 ?      ?    1194.6  -31.3571     150.48   -31.3571    236.647   148.643      
1 1 1 1  42 3  o 0 135.8   32.2  ?      ?    1238.94 60.9003      330.553  60.9003     237.557   -119.1       
1 1 1 3  42 3  o 0 405.2   34    ?      ?    2468.41 -2.52481     1171.13  -2.52481    55.0041   -2.52481     
1 1 1 3  5  42 o 0 -15.5   31.4  ?      ?    395.688 70.5926      129.081  -109.407    300.098   -109.407     
1 1 1 3  7  42 f 1 783.4   41    ?      ?    2063.5  -75.9059     2154.64  -75.9059    1261.69   -75.9059     
1 1 1 3  9  42 o 0 209     35.1  ?      ?    1513.61 -32.7929     577.047  -32.7929    69.8466   147.207      
1 1 1 3  11 42 o 0 1327.3  60.9  ?      ?    4903.01 -163.35      2106.68  -163.35     33.6002   -163.35      
1 1 1 3  13 42 o 0 134.2   39.3  ?      ?    1761.47 113.076      186.299  113.076     547.615   -66.9239     
1 1 1 3  15 42 o 0 1636.2  74.4  ?      ?    5839.99 99.0374      2093.12  99.0374     328.292   -80.9626     
1 1 1 3  17 42 f 1 2997    112.1 ?      ?    4696.69 -58.2918     4067.75  -58.2918    2153.22   -58.2918     
1 1 1 3  19 42 o 0 231.9   57.3  ?      ?    2181.68 -13.1312     465.717  -13.1312    395.387   166.869      
1 1 1 3  21 42 o 0 3967    163.4 ?      ?    7446.42 151.382      3800.84  151.382     969.303   151.382      
1 1 1 3  23 42 f 1 736.6   92.2  ?      ?    2662.85 6.9194       1544.85  6.91939     566.155   6.91939      
1 1 1 3  25 42 o 0 142.7   99.4  ?      ?    2084.18 -116.698     58.2816  -116.698    674.606   63.3016      
1 1 1 3  27 42 o 0 469.6   126.9 ?      ?    2866.08 116.06       834.667  116.06      115.358   -63.9399     
1 1 1 0  42 4  o 0 449.4   48.4  ?      ?    1455.89 4.09759e-14  1261.61  0           589.202   -4.67623e-14 
1 1 1 2  42 4  o 0 157.1   31.5  ?      ?    1603.94 -22.8424     413.754  -22.8424    317.976   157.158      
1 1 1 4  42 4  o 0 14      31.5  ?      ?    2179.68 -3.02022     650.838  176.98      1629.91   176.98       
1 1 1 4  6  42 o 0 323.4   36.4  ?      ?    2198.63 -80.5843     900.444  -80.5843    46.383    99.4157      
1 1 1 4  8  42 o 0 4017.2  131.4 ?      ?    7442.05 -172.815     4315.91  -172.815    1127      -172.815     
1 1 1 4  10 42 o 0 1136.7  54.9  ?      ?    4975.25 31.8137      1764.63  31.8137     348.391   -148.186     
1 1 1 4  12 42 o 0 511.6   44.5  ?      ?    2000.22 18.6255      1479.15  18.6255     640.45    18.6255      
1 1 1 4  14 42 o 0 502.1   47.7  ?      ?    600.776 77.647       1082.28  77.6469     831.109   77.6469      
1 1 1 4  16 42 o 0 291.6   50    ?      ?    2301.24 -29.4881     676.365  -29.4881    266.036   150.512      
1 1 1 4  18 42 o 0 827.5   59.8  ?      ?    1234.25 -129.659     2114.73  -129.659    1621.57   -129.659     
1 1 1 4  20 42 o 0 1216.6  81.3  ?      ?    5078.5  37.8666      1666.87  37.8666     265.968   -142.133     
1 1 1 4  22 42 o 0 422.2   86.3  ?      ?    1903.06 38.5129      1046.2   38.5129     335.676   38.5129      
1 1 1 4  24 42 o 0 1876.7  127.8 ?      ?    5957.9  -152.374     2120.71  -152.374    13.1252   27.6264      
1 1 1 4  26 42 o 0 3405.3  188.6 ?      ?    6137.9  17.8208      3468.02  17.8208     1391.51   17.8208      
1 1 1 4  28 42 o 0 3519.9  213.1 ?      ?    6039.22 -172.61      3399.56  -172.61     1445.26   -172.61      
1 1 1 1  42 5  o 0 165.7   33.8  ?      ?    1862.33 -129.519     412.963  -129.519    442.573   50.4806      
1 1 1 3  42 5  o 0 37.6    33    ?      ?    1506.07 -179.347     320.595  0.653098    1002.99   0.653098     
1 1 1 5  42 5  o 0 1340.5  55.9  ?      ?    4040.81 -87.5695     2594.57  -87.5695    797.286   -87.5695     
1 1 1 5  7  42 f 1 1650.8  63.5  ?      ?    5604.16 107.25       2345.16  107.25      72.0193   -72.7496     
1 1 1 5  9  42 o 0 63.4    36.6  ?      ?    171.722 152.079      14.4074  -27.921     87.5386   -27.921      
1 1 1 5  11 42 o 0 641.4   46.4  ?      ?    3023.24 -92.8446     1496.5   -92.8446    223.028   -92.8446     
1 1 1 5  13 42 o 0 871.2   55.5  ?      ?    3853.35 50.0229      1661.58  50.0229     62.3778   50.0229      
1 1 1 5  15 42 o 0 1187.2  66.9  ?      ?    4044.83 -160.3       2092.15  -160.3      421.809   -160.3       
1 1 1 5  17 42 o 0 26.7    51.5  ?      ?    2556.48 -62.6139     587.375  117.386     1619.41   117.386      
1 1 1 5  19 42 o 0 496.9   63.2  ?      ?    3067.73 121.22       998.097  121.22      183.869   -58.7804     
1 1 1 5  21 42 o 0 1704.6  98.5  ?      ?    6389.96 -37.8925     1867.09  -37.8925    552.923   142.107      
1 1 1 5  23 42 o 0 -70.4   88.1  ?      ?    1631.35 172.106      354.457  -7.89419    948.31    -7.89419     
1 1 1 5  25 42 o 0 483.7   136.6 ?      ?    2725.19 77.4935      930.878  77.4935     23.7418   -102.507     
1 1 1 5  27 42 o 0 790.6   177.2 ?      ?    3018.99 -113.661     1383.36  -113.661    386.335   -113.661     
1 1 1 0  42 6  o 0 -0.9    44.9  ?      ?    825.199 1.91353e-13  40.9846  0           339.981   -180         
1 1 1 2  42 6  o 0 67.5    31    ?      ?    1181.73 -163.096     81.991   16.9041     621.038   16.9041      
1 1 1 4  42 6  o 0 921.8   46    ?      ?    4629.15 -112.437     1589.02  -112.437    487.421   67.5628      
1 1 1 6  42 6  f 1 -43     32.8  ?      ?    1978.33 -28.3537     739.337  151.646     1615.36   151.646      
1 1 1 6  8  42 o 0 1712.2  69.4  ?      ?    5629.98 1.96495      2421.32  1.96495     21.1193   1.96495      
1 1 1 6  10 42 o 0 150.5   37.8  ?      ?    1433.85 178.99       309.641  178.99      296.071   -1.00977     
1 1 1 6  12 42 o 0 454.9   47.4  ?      ?    3253.87 159.857      929.873  159.857     426.884   -20.1428     
1 1 1 6  14 42 f 1 492.1   50.5  ?      ?    1741.69 165.897      1407.64  165.897     679.578   165.897      
1 1 1 6  16 42 o 0 215.2   49.9  ?      ?    1060.48 2.36687      499.985  2.36687     68.25     2.36687      
1 1 1 6  18 42 o 0 287.4   58.5  ?      ?    2608.81 -102.123     553.474  -102.123    482.692   77.8766      
1 1 1 6  20 42 o 0 50.3    70.2  ?      ?    326.249 136.622      30.1104  -43.3775    155.195   -43.3775     
1 1 1 6  22 42 o 0 -31.8   100.9 ?      ?    1984.7  114.729      338.984  -65.2711    1075.56   -65.2711     
1 1 1 6  24 42 o 0 199.4   130   ?      ?    2773.34 -26.7952     96.3486  -26.7952    891.035   153.205      
1 1 1 6  26 42 o 0 75.4    155.3 ?      ?    857.734 -25.1024     73.8975  -25.1024    214.581   154.898      
1 1 1 6  28 42 o 0 78.9    204.7 ?      ?    1794    14.8088      82.0416  14.8088     495.159   -165.191     
1 1 1 1  42 7  o 0 1184.3  53.2  ?      ?    4361.64 -146.326     2253.39  -146.326    257.429   -146.326     
1 1 1 3  42 7  f 1 112.8   35.5  ?      ?    608.794 119.782      115.444  119.782     160.966   -60.2183     
1 1 1 5  42 7  f 1 203.1   34    ?      ?    1675.1  75.9587      556.46   75.9587     191.429   -104.041     
1 1 1 7  42 7  o 0 683.8   44.5  ?      ?    2695.77 -134.738     1761.19  -134.738    588.141   -134.738     
1 1 1 7  9  42 o 0 2.3     38.6  ?      ?    788.552 34.9528      219.072  -145.047    552.584   -145.047     
1 1 1 7  11 42 f 1 498     44.9  ?      ?    2483.22 -69.4877     1302.86  -69.4877    258.478   -69.4877     
1 1 1 7  13 42 o 0 476.6   50    ?      ?    2860.87 -157.991     1080.11  -157.991    114.785   22.0089      
1 1 1 7  15 42 o 0 1269.4  74.7  ?      ?    4612.44 93.4472      1994.44  93.4472     104.156   93.4472      
1 1 1 7  17 42 o 0 168.3   57    ?      ?    514.592 -69.1989     184.698  -69.1989    21.4309   110.801      
1 1 1 7  19 42 o 0 236.5   69    ?      ?    1627.01 -32.0577     530.127  -32.0577    91.8218   147.942      
1 1 1 7  21 42 f 1 53.1    71.4  ?      ?    1620.06 -164.441     194.589  15.559      806.714   15.559       
1 1 1 7  23 42 o 0 77.2    114.4 ?      ?    1759.69 25.1719      58.4765  -154.828    693.951   -154.828     
1 1 1 7  25 42 o 0 823.9   150.9 ?      ?    3298.77 -154.47      1438.22  -154.47     291.879   -154.47      
1 1 1 7  27 42 o 0 -157.7  172.3 ?      ?    273.894 164.234      20.9431  -15.7665    110.679   -15.7665     
1 1 1 0  42 8  f 1 66.2    49.8  ?      ?    3293.69 1.14972e-14  331.371  0           1188.39   -180         
1 1 1 2  42 8  f 1 917.8   47.9  ?      ?    4293.23 99.5422      1727.97  99.5423     230.021   -80.4577     
1 1 1 4  42 8  o 0 487.2   41.1  ?      ?    2965.55 -23.1076     1199.6   -23.1076    125.277   156.892      
1 1 1 6  42 8  o 0 108.2   35.8  ?      ?    586.602 91.8128      83.5872  91.8128     173.732   -88.1872     
1 1 1 8  42 8  f 1 242     39.2  ?      ?    1243.62 -166.556     712.198  -166.556    175.337   -166.556     
1 1 1 8  10 42 f 1 90      42.2  ?      ?    653.561 -25.1777     23.1238  -25.1777    252.109   154.822      
1 1 1 8  12 42 o 0 769.1   58    ?      ?    3920.33 164.344      1421.71  164.344     198.242   -15.6564     
1 1 1 8  14 42 o 0 2646.5  109.9 ?      ?    5913.1  27.9066      3293.5   27.9066     858.336   27.9066      
1 1 1 8  16 42 o 0 645     65.6  ?      ?    2859.62 170.341      1437.5   170.341     284.337   170.341      
1 1 1 8  18 42 o 0 55.9    66.7  ?      ?    641.874 33.937       60.8817  -146.063    308.35    -146.063     
1 1 1 8  20 42 o 0 488.6   78.9  ?      ?    2544.88 -122.604     1103.85  -122.604    137.692   -122.604     
1 1 1 8  22 42 o 0 177.9   112.8 ?      ?    1342.64 90.6652      223.884  90.6652     266.975   -89.3348     
1 1 1 8  24 42 o 0 572.1   142.9 ?      ?    832.402 113.44       1131.8   113.44      838.396   113.44       
1 1 1 8  26 42 o 0 399.9   179.9 ?      ?    2279.53 128.612      699.7    128.612     59.2808   -51.3883     
1 1 1 1  42 9  o 0 5997    192.1 ?      ?    9837.87 -13.1147     5286.46  -13.1147    814.201   -13.1147     
1 1 1 3  42 9  o 0 1916.6  82.3  ?      ?    4814.26 135.121      3192.7   135.121     1032.74   135.121      
1 1 1 5  42 9  o 0 1433.1  61.9  ?      ?    4347.36 -86.9289     2602.85  -86.9289    684.245   -86.9289     
1 1 1 7  42 9  o 0 51.5    39.5  ?      ?    2040.41 53.6367      384.818  -126.363    1267.63   -126.363     
1 1 1 9  42 9  o 0 204.2   45.7  ?      ?    2226.41 148.068      423.402  148.068     517.736   -31.9316     
1 1 1 9  11 42 o 0 659.6   53.1  ?      ?    3218    60.7619      1440.68  60.7619     109.074   60.7619      
1 1 1 9  13 42 f 1 693.5   60.6  ?      ?    2634.16 87.161       1651.07  87.161      556.675   87.161       
1 1 1 9  15 42 f 1 4165.8  158.1 ?      ?    7282.23 -56.2579     4144.91  -56.2579    1177.09   -56.2579     
1 1 1 9  17 42 o 0 682.2   73.3  ?      ?    4425.79 105.495      947.911  105.495     804.71    -74.5051     
1 1 1 9  19 42 o 0 545.9   75.4  ?      ?    2785.38 169.821      1189.38  169.821     122.839   169.821      
1 1 1 9  21 42 o 0 186.9   104.4 ?      ?    1907.42 -45.1832     240.794  -45.1832    467.411   134.817      
1 1 1 9  23 42 o 0 298.2   124.3 ?      ?    2303.92 97.7526      502.618  97.7526     319.464   -82.2474     
1 1 1 9  25 42 o 0 1345.6  169   ?      ?    2958.4  -163.574     2295.41  -163.574    1296.38   -163.574     
1 1 1 9  27 42 o 0 438.7   195.9 ?      ?    2959.43 10.7833      534.705  10.7833     423.128   -169.217     
1 1 1 0  42 10 o 0 2935.2  147.5 ?      ?    9258.69 180          3440.13  180         769.935   1.89942e-14  
1 1 1 2  42 10 o 0 1569.8  71.8  ?      ?    4315.81 -47.1179     2885.02  -47.1179    944.464   -47.1179     
1 1 1 4  42 10 o 0 1834    74.4  ?      ?    4448.49 67.5558      3187     67.5558     1215.82   67.5558      
1 1 1 6  42 10 o 0 963.8   56.1  ?      ?    3975.69 -130.428     1883.16  -130.428    152.888   -130.428     
1 1 1 8  42 10 f 1 388.5   45.7  ?      ?    205.289 76.1107      356.526  76.1107     268.579   76.1107      
1 1 1 10 42 10 f 1 356.3   47.2  ?      ?    2142.38 73.7747      980.812  73.7747     85.6014   73.7747      
1 1 1 10 12 42 o 0 116     52.7  ?      ?    1147.72 8.58887      86.5051  8.58887     388.354   -171.411     
1 1 1 10 14 42 o 0 522.5   60    ?      ?    3282.93 38.6906      1023.63  38.6906     311.073   -141.309     
1 1 1 10 16 42 o 0 97.7    60.5  ?      ?    2108    -124.165     135.846  55.8351     974.781   55.8351      
1 1 1 10 18 42 o 0 -54.3   75.1  ?      ?    1504.27 137.525      354.015  -42.475     926.216   -42.475      
1 1 1 10 20 42 o 0 618.1   87.8  ?      ?    2796.6  90.3029      1311.93  90.3029     264.674   90.3029      
1 1 1 10 22 42 f 1 381.1   120.9 ?      ?    1466.06 -134.947     844.619  -134.947    313.068   -134.947     
1 1 1 10 24 42 f 1 390.9   160.1 ?      ?    1453.01 51.4633      819.145  51.4633     311.326   51.4633      
1 1 1 10 26 42 o 0 -60.1   198   ?      ?    655.02  142.072      17.8988  142.072     197.1     -37.9277     
1 1 1 1  42 11 o 0 2510.1  93.4  ?      ?    6869.72 109.525      3112.2   109.525     23.1723   109.525      
1 1 1 3  42 11 o 0 4402.9  151.9 ?      ?    7872.61 -95.8414     4648.63  -95.8414    1153.33   -95.8414     
1 1 1 5  42 11 o 0 1595.1  72    ?      ?    4971.61 19.3662      2576.9   19.3662     404.876   19.3662      
1 1 1 7  42 11 f 1 1103.5  62.8  ?      ?    4315.74 -168.804     1971.98  -168.804    112.515   -168.804     
1 1 1 9  42 11 o 0 318.4   51.7  ?      ?    2627.35 -104.777     727.412  -104.777    372.634   75.223       
1 1 1 11 42 11 o 0 389.5   55    ?      ?    3387.85 15.4436      645.768  15.4436     754.566   -164.556     
1 1 1 11 13 42 f 1 1169    76.3  ?      ?    4998.97 -81.5213     1661.54  -81.5213    385.423   98.4787      
1 1 1 11 15 42 o 0 163.5   62.7  ?      ?    2329.78 38.2976      122.809  38.2976     807.4     -141.702     
1 1 1 11 17 42 o 0 323.2   72.7  ?      ?    3354.63 -124.375     426.399  -124.375    856.022   55.6251      
1 1 1 11 19 42 o 0 465.2   88.1  ?      ?    2812.76 -16.8158     956.959  -16.8158    103.473   163.184      
1 1 1 11 21 42 o 0 2665.9  155.1 ?      ?    4913.82 65.1826      3351.79  65.1826     1565.05   65.1826      
1 1 1 11 23 42 o 0 1407.9  163.3 ?      ?    4179.85 126.475      2068.8   126.475     601.133   126.475      
1 1 1 11 25 42 o 0 569.5   180.2 ?      ?    2090.15 -35.6959     1128.62  -35.6959    434.205   -35.6959     
1 1 1 0  42 12 o 0 456.5   68.8  ?      ?    2194.09 -1.42011e-14 1294.96  0           310.523   4.50211e-14  
1 1 1 2  42 12 o 0 1910.6  77.5  ?      ?    4743.32 126.611      3182.04  126.611     1076.46   126.611      
1 1 1 4  42 12 o 0 1392.3  68.8  ?      ?    4091.02 -118.337     2616.74  -118.337    826.292   -118.337     
1 1 1 6  42 12 o 0 611.9   53.5  ?      ?    2966.82 92.8223      1473.21  92.8223     197.459   92.8223      
1 1 1 8  42 12 o 0 1206.1  66.4  ?      ?    3091    127.677      2579.03  127.677     1277.63   127.677      
1 1 1 10 42 12 o 0 575.1   58.6  ?      ?    2705.78 -85.0474     1373.87  -85.0474    247.005   -85.0474     
1 1 1 12 42 12 o 0 3.4     58.3  ?      ?    972.076 -87.2855     208.805  92.7145     602.289   92.7145      
1 1 1 12 14 42 o 0 931.5   70.8  ?      ?    4409.87 -126.652     1454.21  -126.652    309.209   53.3479      
1 1 1 12 16 42 o 0 104.8   65.5  ?      ?    1707.08 108.333      42.5345  -71.6671    697.24    -71.6671     
1 1 1 12 18 42 o 0 394.7   81.4  ?      ?    1001.11 52.5312      931.17   52.5312     551.869   52.5312      
1 1 1 12 20 42 o 0 1559.3  120.2 ?      ?    5139.49 -34.6526     2044.85  -34.6526    163.499   -34.6526     
1 1 1 12 22 42 o 0 801.1   141.3 ?      ?    2080.47 -89.5676     1728.21  -89.5676    991.497   -89.5676     
1 1 1 12 24 42 o 0 768.5   181.7 ?      ?    2692.73 32.4741      1439.17  32.4741     535.376   32.4741      
1 1 1 12 26 42 o 0 -413.7  204.8 ?      ?    2265.6  -145.181     366.331  34.8194     1096.31   34.8194      
1 1 1 1  42 13 f 1 293     46.8  ?      ?    3274.55 30.2466      446.428  30.2466     1011.89   -149.753     
1 1 1 3  42 13 o 0 258.3   49.1  ?      ?    2835.34 105.911      472.178  105.911     768.245   -74.0892     
1 1 1 5  42 13 o 0 192.6   50.2  ?      ?    2075.88 163.962      410.097  163.962     483.943   -16.0384     
1 1 1 7  42 13 o 0 573.6   53.4  ?      ?    1987.13 68.9493      1617.48  68.9493     766.247   68.9493      
1 1 1 9  42 13 f 1 1389.9  71.7  ?      ?    4741.34 -18.359      2170.18  -18.359     173.539   -18.359      
1 1 1 11 42 13 f 1 1397.2  76.9  ?      ?    4592.45 156.064      2180.1   156.064     296.585   156.064      
1 1 1 13 42 13 o 0 189.7   64    ?      ?    1013.5  17.5109      355.934  17.5109     45.0621   -162.489     
1 1 1 13 15 42 o 0 800.6   74    ?      ?    3820.5  -176.481     1404.18  -176.481    63.282    3.51874      
1 1 1 13 17 42 o 0 809.3   89.7  ?      ?    3434.19 56.9464      1525.47  56.9464     220.152   56.9464      
1 1 1 13 19 42 o 0 28.6    89    ?      ?    1182.45 159.356      133.448  -20.6438    568.42    -20.6438     
1 1 1 13 21 42 f 1 179.8   102.5 ?      ?    2437.41 -83.1712     105.109  -83.1712    768.63    96.8288      
1 1 1 13 23 42 o 0 -9.5    35    ?      ?    1583.56 -77.2116     418.166  102.788     954.133   102.788      
1 1 1 13 25 42 o 0 -163.2  204.9 ?      ?    1230.21 116.021      64.7933  -63.9786    465.189   -63.9786     
1 1 1 0  42 14 o 0 31.6    67.5  ?      ?    1399.76 -1.7932e-14  118.108  0           498.868   180          
1 1 1 2  42 14 o 0 2380    94.5  ?      ?    7404.24 -55.6058     2630.39  -55.6059    600.493   124.394      
1 1 1 4  42 14 o 0 1723.6  78.8  ?      ?    5857.85 139.161      2322.93  139.161     233.513   -40.8388     
1 1 1 6  42 14 f 1 1000.5  68.8  ?      ?    2304.91 25.402       2447.56  25.402      1453.24   25.402       
1 1 1 8  42 14 o 0 226.7   53.5  ?      ?    2763.74 -32.3429     315.099  -32.3429    846.116   147.657      
1 1 1 10 42 14 o 0 -1.7    55.3  ?      ?    1044.49 -169.441     245.819  10.5594     674.093   10.5594      
1 1 1 12 42 14 o 0 354.7   61.2  ?      ?    3156.61 -12.7038     595.306  -12.7038    662.99    167.296      
1 1 1 14 42 14 o 0 8.9     64.4  ?      ?    2147.46 161.548      451.564  -18.4515    1263.99   -18.4515     
1 1 1 14 16 42 o 0 -9.5    81.3  ?      ?    1217    -0.372213    213.278  179.628     676.524   179.628      
1 1 1 14 18 42 o 0 172.9   87.7  ?      ?    1822.67 -51.2157     206.596  -51.2157    469.399   128.784      
1 1 1 14 20 42 o 0 2       96    ?      ?    2779.87 120.649      483.801  -59.3514    1479.48   -59.3514     
1 1 1 14 22 42 o 0 891     163.8 ?      ?    2384    -17.7672     1780.53  -17.7672    968.382   -17.7672     
1 1 1 14 24 42 o 0 1345.8  219.2 ?      ?    4903.31 111.31       1629.23  111.31      20.1898   111.31       
1 1 1 1  42 15 f 1 1280.6  68.7  ?      ?    2953.65 -142.138     2802.31  -142.138    1494.58   -142.138     
1 1 1 3  42 15 o 0 1138.9  67.4  ?      ?    3475.69 -87.4836     2338.82  -87.4836    826.188   -87.4836     
1 1 1 5  42 15 o 0 142.9   59.8  ?      ?    1849.55 113.378      141.221  113.378     651.589   -66.6222     
1 1 1 7  42 15 o 0 -54.5   57.3  ?      ?    969.959 -73.7119     286.769  106.288     694.818   106.288      
1 1 1 9  42 15 f 1 -7.4    58.3  ?      ?    772.089 21.9326      180.539  -158.067    499.949   -158.067     
1 1 1 11 42 15 o 0 497.4   64.3  ?      ?    2946.42 -114.79      1055.07  -114.79     125.73    65.2097      
1 1 1 13 42 15 o 0 -60.7   68    ?      ?    1343.29 -165.201     344.327  14.7993     856.345   14.7993      
1 1 1 15 42 15 o 0 827.9   88.5  ?      ?    3614.97 118.491      1476.56  118.491     127.119   118.491      
1 1 1 15 17 42 o 0 80.2    90.7  ?      ?    2885.77 -11.9516     336.478  168.048     1408.21   168.048      
1 1 1 15 19 42 o 0 -94.3   101   ?      ?    541.165 -132.335     103.333  47.665      297.75    47.665       
1 1 1 15 21 42 o 0 421.9   117.1 ?      ?    2045.38 -21.9764     938.094  -21.9764    226.371   -21.9764     
1 1 1 15 23 42 o 0 691.6   206.7 ?      ?    2091.33 -83.7621     1371.51  -83.7621    680.858   -83.7621     
1 1 1 0  42 16 o 0 151.4   81.8  ?      ?    2054.51 -2.18838e-14 460.672  0           437.296   180          
1 1 1 2  42 16 o 0 809.2   65.9  ?      ?    3485.7  105.57       1685.81  105.57      176.497   105.57       
1 1 1 4  42 16 o 0 8.1     61.9  ?      ?    698.399 -66.1113     142.367  113.889     440.852   113.889      
1 1 1 6  42 16 o 0 55.7    57.6  ?      ?    340.584 20.6254      32.8722  -159.375    176.021   -159.375     
1 1 1 8  42 16 o 0 113.9   61.1  ?      ?    1421.36 -126.492     54.615   -126.492    530.755   53.5081      
1 1 1 10 42 16 o 0 -6.5    60.2  ?      ?    2074.53 -45.9178     500.614  134.082     1334.66   134.082      
1 1 1 12 42 16 o 0 216.5   65.1  ?      ?    1617.39 164.423      458.386  164.423     161.403   -15.5773     
1 1 1 14 42 16 o 0 89.6    75.1  ?      ?    749.824 124.882      2.33242  124.882     279.693   -55.1185     
1 1 1 16 42 16 o 0 1019.5  109.6 ?      ?    4501.26 54.569       1463.37  54.569      169.292   -125.431     
1 1 1 16 18 42 o 0 517     106.3 ?      ?    4224.81 -72.8272     593.076  -72.8272    926.576   107.173      
1 1 1 16 20 42 o 0 272.2   126.3 ?      ?    974.562 -159.009     462.598  -159.009    122.51    -159.009     
1 1 1 16 22 42 o 0 117.9   134.8 ?      ?    839.579 -169.499     99.5141  -169.499    179.011   10.5011      
1 1 1 1  42 17 o 0 232.6   61    ?      ?    2581.28 -78.7291     399.311  -78.7291    710.104   101.271      
1 1 1 3  42 17 f 1 2352.2  101.1 ?      ?    5385.52 38.906       3257.51  38.906      954.922   38.906       
1 1 1 5  42 17 o 0 -27.7   61.8  ?      ?    1754.28 130.895      464.52   -49.1052    1199.56   -49.1052     
1 1 1 7  42 17 o 0 73      64.9  ?      ?    221.472 17.3567      5.58765  -162.643    96.704    -162.643     
1 1 1 9  42 17 o 0 680.3   73.7  ?      ?    3234.41 -95.97       1383.74  -95.97      82.0164   -95.97       
1 1 1 11 42 17 o 0 460.7   74.6  ?      ?    2228.92 43.7522      1129.09  43.7522     272.252   43.7522      
1 1 1 13 42 17 o 0 -53.3   80.3  ?      ?    656.473 -72.7426     140.086  107.257     388.326   107.257      
1 1 1 15 42 17 o 0 794.3   95.4  ?      ?    4755.84 11.0413      1006.38  11.0413     731.86    -168.959     
1 1 1 17 42 17 o 0 1426.7  120.9 ?      ?    5774.85 -108.733     1579.2   -108.733    441.613   71.2672      
1 1 1 17 19 42 o 0 1930.6  160.3 ?      ?    3632.37 176.218      2870.54  176.218     1601.63   176.218      
1 1 1 17 21 42 o 0 197.4   153.8 ?      ?    3419.4  89.6497      50.6101  -90.3503    1188.02   -90.3503     
1 1 1 17 23 42 o 0 213.5   164.4 ?      ?    2515.13 -99.2616     154.516  -99.2616    652.322   80.7384      
1 1 1 0  42 18 o 0 -211.1  93.9  ?      ?    1732.31 -180         48.2824  180         688.908   2.13207e-14  
1 1 1 2  42 18 o 0 991.3   75.6  ?      ?    4668.54 -159.556     1544.66  -159.556    425.144   20.4437      
1 1 1 4  42 18 o 0 405.2   75.7  ?      ?    3191.86 14.6447      753.01   14.6447     577.168   -165.355     
1 1 1 6  42 18 o 0 1419.9  90.1  ?      ?    4250.34 -22.2597     2358.93  -22.2597    615.98    -22.2597     
1 1 1 8  42 18 o 0 1269.6  86.1  ?      ?    2321.74 164.593      2723.7   164.593     1808.88   164.593      
1 1 1 10 42 18 o 0 1016.9  85.6  ?      ?    4049.9  -157.993     1718.95  -157.993    160.555   -157.993     
1 1 1 12 42 18 o 0 360.4   80.2  ?      ?    3105.45 144.991      601.266  144.991     576.757   -35.0094     
1 1 1 14 42 18 o 0 954.4   97.5  ?      ?    4543.78 -28.2099     1363.84  -28.2099    305.915   151.79       
1 1 1 16 42 18 o 0 450.5   112.4 ?      ?    3242.97 -141.155     716.638  -141.155    427.037   38.8447      
1 1 1 18 42 18 o 0 3631.1  186.2 ?      ?    7151.36 97.5242      3240.54  97.5242     818.978   97.5242      
1 1 1 18 20 42 o 0 1456.9  169.2 ?      ?    4477.01 -34.8989     1972.47  -34.8989    481.995   -34.8989     
1 1 1 18 22 42 o 0 492.6   179.1 ?      ?    3041.9  116.651      664.079  116.651     314.147   -63.3493     
1 1 1 1  42 19 f 1 959.9   81.8  ?      ?    5063.87 44.0376      1302.78  44.0376     824.391   -135.962     
1 1 1 3  42 19 o 0 748.4   75.1  ?      ?    2612.63 -138.573     1774.29  -138.573    693.907   -138.573     
1 1 1 5  42 19 o 0 888.9   81.4  ?      ?    4469.93 -117.854     1397.08  -117.854    389.634   62.1458      
1 1 1 7  42 19 o 0 1094.6  91    ?      ?    2677.78 23.2226      2333.05  23.2226     1281.49   23.2226      
1 1 1 9  42 19 o 0 1114.8  89.7  ?      ?    4322.2  130.466      1807.75  130.466     124.261   130.466      
1 1 1 11 42 19 o 0 273.6   94.5  ?      ?    2844.77 -2.83972     362.536  -2.83972    717.642   177.16       
1 1 1 13 42 19 o 0 -109.1  101   ?      ?    2125.37 12.8442      472.916  -167.156    1252.49   -167.156     
1 1 1 15 42 19 o 0 239.8   116.1 ?      ?    2446.51 165.297      287.196  165.297     580.373   -14.7026     
1 1 1 17 42 19 o 0 407.8   147.6 ?      ?    2997.74 56.4896      610.853  56.4896     412.315   -123.51      
1 1 1 19 42 19 o 0 1273.1  179   ?      ?    3244.29 -81.9971     2006.32  -81.9971    962.898   -81.9971     
1 1 1 19 21 42 o 0 69.1    199.7 ?      ?    2330.76 -98.5983     5.86802  81.4017     755.852   81.4017      
1 1 1 0  42 20 o 0 -66.4   117.1 ?      ?    694.597 -180         43.3849  180         237.435   2.5731e-15   
1 1 1 2  42 20 o 0 183.7   82.4  ?      ?    1928.85 -106.988     262.346  -106.988    511.525   73.0116      
1 1 1 4  42 20 o 0 444.3   81.7  ?      ?    1707.16 95.1939      1204.52  95.1939     527.495   95.1939      
1 1 1 6  42 20 o 0 240.8   91.8  ?      ?    1617.9  100.968      512.952  100.968     127.309   -79.0317     
1 1 1 8  42 20 o 0 372.7   91    ?      ?    3277.17 1.96375      589.663  1.96375     682.382   -178.036     
1 1 1 10 42 20 o 0 -154.5  91.6  ?      ?    881.474 -153.45      222.597  26.5504     556.876   26.5504      
1 1 1 12 42 20 o 0 164.6   101.3 ?      ?    2662.66 -101.685     13.9185  78.3147     991.523   78.3147      
1 1 1 14 42 20 o 0 -53.2   114.3 ?      ?    287.256 -2.2686      36.4476  177.731     138.647   177.731      
1 1 1 16 42 20 o 0 704.2   140.4 ?      ?    2628.14 16.1952      1390.95  16.1952     488.851   16.1952      
1 1 1 18 42 20 o 0 583.5   164   ?      ?    3083.07 -142.184     966.766  -142.184    32.895    37.8158      
1 1 1 20 42 20 f 1 208.7   203   ?      ?    3085.5  -157.266     48.8701  -157.266    912.716   22.7342      
1 1 1 1  42 21 o 0 381.5   87    ?      ?    2681.79 -172.028     827.125  -172.028    249.513   7.97209      
1 1 1 3  42 21 o 0 514.1   93.8  ?      ?    1926.58 93.1036      1355.29  93.1036     588.927   93.1036      
1 1 1 5  42 21 o 0 1216.9  111.6 ?      ?    3626.85 -64.065      2217.38  -64.065     793.551   -64.065      
1 1 1 7  42 21 f 1 -70.7   105.3 ?      ?    2529.3  -104.941     536.461  75.0592     1518.1    75.0592      
1 1 1 9  42 21 o 0 -116.6  110.6 ?      ?    1777.26 -32.6852     366.246  147.315     1037.87   147.315      
1 1 1 11 42 21 o 0 685.7   113   ?      ?    2966.82 -44.0019     1351.85  -44.0019    263.961   -44.0019     
1 1 1 13 42 21 f 1 1211.4  139.8 ?      ?    4015.17 162.688      1867.62  162.688     429.586   162.688      
1 1 1 15 42 21 o 0 417.5   151.2 ?      ?    2582.53 9.26128      745.585  9.26128     143.862   -170.739     
1 1 1 17 42 21 o 0 269.3   164.9 ?      ?    2676.12 134.382      300.845  134.382     571.933   -45.6178     
1 1 1 19 42 21 o 0 47      203.6 ?      ?    4220.65 74.2408      469.143  -105.759    1788.09   -105.759     
1 1 1 0  42 22 o 0 60.1    129.5 ?      ?    723.309 180          90.5041  180         195.452   -1.00759e-13 
1 1 1 2  42 22 o 0 383.7   95.3  ?      ?    2767.2  -99.8676     779.479  -99.8676    307.229   80.1324      
1 1 1 4  42 22 o 0 1455.7  121.9 ?      ?    3553.26 97.9643      2575.2   97.9643     1194.74   97.9643      
1 1 1 6  42 22 o 0 -77.3   110.2 ?      ?    1494.86 -152.446     267.62   27.5538     839.867   27.5538      
1 1 1 8  42 22 o 0 803.7   116   ?      ?    2213.87 -94.3729     1803.04  -94.3729    975.489   -94.3729     
1 1 1 10 42 22 f 1 603.1   127.4 ?      ?    2781.52 -170.32      1211.52  -170.32     189.442   -170.32      
1 1 1 12 42 22 o 0 992     134.2 ?      ?    4431.81 152.247      1409.62  152.247     166.751   -27.7526     
1 1 1 14 42 22 o 0 673.6   158.4 ?      ?    3765.45 -41.4717     1023.95  -41.4717    253.057   138.528      
1 1 1 16 42 22 o 0 -192.6  162.8 ?      ?    616.933 34.3243      69.2605  -145.676    271.173   -145.676     
1 1 1 18 42 22 o 0 1487.1  219.3 ?      ?    5204.71 28.98        1604.42  28.98       31.8696   -151.02      
1 1 1 1  42 23 o 0 156.3   99.5  ?      ?    1659.78 44.4713      156.92   44.4713     481.658   -135.529     
1 1 1 3  42 23 f 1 -276.1  113.1 ?      ?    1848.1  79.5884      499.344  -100.412    1208.51   -100.412     
1 1 1 5  42 23 o 0 127.1   117.4 ?      ?    537.554 92.2809      73.589   92.2809     129.008   -87.7191     
1 1 1 7  42 23 o 0 -196.7  124.6 ?      ?    1175.93 91.7127      246.216  -88.2873    682.201   -88.2873     
1 1 1 9  42 23 o 0 102.5   123.7 ?      ?    1324.9  -34.7036     66.9895  -34.7036    414.283   145.296      
1 1 1 11 42 23 o 0 3065.3  183.8 ?      ?    5643.18 80.7186      3409.43  80.7186     1409.28   80.7186      
1 1 1 13 42 23 o 0 1326.8  172   ?      ?    3530.55 -99.0709     2120.27  -99.0709    924.36    -99.0709     
1 1 1 15 42 23 o 0 637     184.2 ?      ?    2121.52 -162.852     1276.08  -162.852    580.898   -162.852     
1 1 1 17 42 23 o 0 338.8   203.6 ?      ?    1861.13 37.8089      496.718  37.8088     90.5599   -142.191     
1 1 1 0  42 24 o 0 188.8   169.8 ?      ?    490.569 -180         117.545  180         67.8003   5.87902e-14  
1 1 1 2  42 24 o 0 -364.9  106.9 ?      ?    305.543 93.3178      87.5429  -86.6822    202.333   -86.6822     
1 1 1 4  42 24 o 0 1867.4  140.7 ?      ?    4880.24 -9.38578     2559.4   -9.38578    743.893   -9.38578     
1 1 1 6  42 24 o 0 79.3    130.9 ?      ?    1777.09 170.633      11.2032  -9.36718    663.123   -9.36718     
1 1 1 8  42 24 o 0 73.9    142.3 ?      ?    2181.69 -74.2328     52.3204  105.767     838.328   105.767      
1 1 1 10 42 24 f 1 716     157.1 ?      ?    2431    43.6794      1481.88  43.6794     620.458   43.6794      
1 1 1 12 42 24 o 0 2811.3  202.5 ?      ?    6065.49 -63.343      2944.19  -63.343     896.799   -63.343      
1 1 1 14 42 24 o 0 2882.8  215.6 ?      ?    6615.1  124.69       2737.98  124.69      572.728   124.69       
1 1 1 1  42 25 o 0 603.2   131.9 ?      ?    2956.44 150.163      1187.89  150.163     97.2239   150.163      
1 1 1 3  42 25 o 0 942.4   139.8 ?      ?    3051.1  -72.584      1800.67  -72.584     683.202   -72.584      
1 1 1 5  42 25 o 0 24.3    134.2 ?      ?    531.963 148.065      3.60787  148.065     189.003   -31.935      
1 1 1 7  42 25 o 0 86.1    148   ?      ?    2243.99 169.336      19.2419  -10.6639    819.127   -10.6639     
1 1 1 9  42 25 o 0 379.7   172.7 ?      ?    1257.64 -142.889     735.4    -142.889    303.102   -142.889     
1 1 1 11 42 25 o 0 322.2   170.1 ?      ?    2212.85 -128.828     533.94   -128.828    208.64    51.1719      
1 1 1 13 42 25 o 0 504.4   194.3 ?      ?    2983.86 -2.00218     716.941  -2.00218    256.38    177.998      
1 1 1 0  42 26 o 0 516.7   208   ?      ?    776.304 1.14799e-13  562.132  0           281.688   -1.14292e-13 
1 1 1 2  42 26 o 0 261.9   156.3 ?      ?    3162.57 11.0311      202.167  11.0311     916.533   -168.969     
1 1 1 4  42 26 o 0 1493    162.4 ?      ?    5022.42 166.904      1963.61  166.904     202.703   166.904      
1 1 1 6  42 26 o 0 807.4   167.7 ?      ?    3308.21 5.76742      1410.07  5.76742     265.307   5.76742      
1 1 1 8  42 26 o 0 129.5   185.2 ?      ?    2067.94 127.84       148.351  127.84      554.929   -52.1603     
1 1 1 10 42 26 o 0 -110.6  190.8 ?      ?    2312.64 -155.877     205.676  24.1227     975.372   24.1227      
1 1 1 12 42 26 o 0 -20.9   230.8 ?      ?    2805.52 55.627       159.161  -124.373    1069.01   -124.373     
1 1 1 1  42 27 o 0 -231.9  159.9 ?      ?    762.68  -120.46      110.273  59.5401     374.448   59.5401      
1 1 1 3  42 27 o 0 912.8   180.1 ?      ?    3301.98 -89.2676     1575.74  -89.2676    439.033   -89.2676     
1 1 1 5  42 27 o 0 1139.5  178.7 ?      ?    3583.62 77.4475      1838.85  77.4475     618.102   77.4475      
1 1 1 7  42 27 o 0 559.2   187.8 ?      ?    2039.39 -84.0557     1100.46  -84.0557    415.966   -84.0557     
1 1 1 9  42 27 o 0 1357.9  222.6 ?      ?    5370.98 27.5172      1454.98  27.5172     313.601   -152.483     
1 1 1 0  42 28 o 0 564.2   248.9 ?      ?    2185.43 180          892.317  180         153.166   -180         
1 1 1 2  42 28 o 0 -361.5  189.3 ?      ?    644.449 -97.5967     90.9717  82.4033     308.206   82.4033      
1 1 1 4  42 28 o 0 -278.9  194   ?      ?    1112.56 164.345      130.05   -15.6552    502.154   -15.6552     
1 1 1 6  42 28 o 0 220.5   198.4 ?      ?    1324.29 -49.1742     307.542  -49.1743    130.004   130.826      
1 1 1 0  1  43 o 0 926.9   68.4  ?      ?    4735.22 90           1737.09  90          198.315   -90          
1 1 1 0  3  43 o 0 -37.2   52.1  ?      ?    1430.07 -90          43.5284  -90         544.219   90           
1 1 1 0  5  43 o 0 66.4    53    ?      ?    1169.84 90           134.199  90          347.35    -90          
1 1 1 0  7  43 o 0 490.6   60.9  ?      ?    4131.17 -90          1263.27  -90         433.186   90           
1 1 1 0  9  43 o 0 -29.3   57.4  ?      ?    849.892 -90          31.8678  -90         314.908   90           
1 1 1 0  11 43 o 0 479.9   66.2  ?      ?    1724.16 -90          1157.82  -90         461.627   -90          
1 1 1 0  13 43 o 0 1622.6  106.9 ?      ?    2558.82 -90          2236.33  -90         1203.83   -90          
1 1 1 0  15 43 o 0 -23     72.8  ?      ?    836.515 90           39.8413  90          291.5     -90          
1 1 1 0  17 43 o 0 2943.5  168.6 ?      ?    5654.41 -90          2888.61  -90         742.378   -90          
1 1 1 0  19 43 o 0 -49.4   89.1  ?      ?    496.447 90           22.3825  90          163.566   -90          
1 1 1 0  21 43 o 0 417.2   120.2 ?      ?    3409.55 -90          976.833  -90         261.646   90           
1 1 1 0  23 43 o 0 75.3    155.8 ?      ?    145.355 90           19.1695  90          31.5688   -90          
1 1 1 0  25 43 o 0 359.8   188.2 ?      ?    2600    -90          674.349  -90         184.398   90           
1 1 1 0  27 43 o 0 -426.1  224.2 ?      ?    560.421 90           26.63    90          150.717   -90          
1 1 1 0  43 1  o 0 42.2    54.6  ?      ?    709.211 -90          63.2366  -90         248.279   90           
1 1 1 1  2  43 o 0 50.1    35.9  ?      ?    1206.37 23.8197      191.568  -156.18     687.305   -156.18      
1 1 1 1  4  43 o 0 236.3   38.3  ?      ?    1637.24 96.0562      654.994  96.0562     20.0849   -83.9438     
1 1 1 1  6  43 o 0 532.3   42.3  ?      ?    2409.13 -83.103      1398.19  -83.103     405.376   -83.103      
1 1 1 1  8  43 o 0 49.5    40.5  ?      ?    2441.65 176.923      481.491  -3.07658    1483.18   -3.07658     
1 1 1 1  10 43 o 0 240.1   42.5  ?      ?    2110.51 50.4386      576.557  50.4386     281.965   -129.561     
1 1 1 1  12 43 o 0 973.2   59.3  ?      ?    4856.42 -106.796     1394.23  -106.796    583.881   73.2038      
1 1 1 1  14 43 o 0 973.1   63.6  ?      ?    3566.36 77.3325      1838.81  77.3325     409.937   77.3325      
1 1 1 1  16 43 o 0 299     55.6  ?      ?    1800.92 157.645      769.796  157.645     62.9081   157.645      
1 1 1 1  18 43 o 0 2155.2  100   ?      ?    6330.54 177.142      2419.76  177.142     43.278    177.142      
1 1 1 1  20 43 o 0 540     73    ?      ?    3239.5  96.5354      1001.37  96.5354     196.378   -83.4646     
1 1 1 1  22 43 o 0 252.3   98    ?      ?    1516.3  -85.2881     468.537  -85.2881    71.3671   94.7119      
1 1 1 1  24 43 o 0 3067.7  174.9 ?      ?    5926.8  -159.845     3218.39  -159.845    1183.92   -159.845     
1 1 1 1  26 43 o 0 389.2   135.3 ?      ?    2680.03 40.5521      627.689  40.5521     241.178   -139.448     
1 1 1 1  43 2  o 0 2410.7  89.7  ?      ?    6610.03 -86.9046     3021.76  -86.9046    124.761   -86.9046     
1 1 1 2  3  43 o 0 544.6   42.6  ?      ?    2378.59 -15.4591     1438.78  -15.4591    458.08    -15.4591     
1 1 1 2  5  43 o 0 43.9    35.4  ?      ?    1120.16 140.405      201.058  -39.5949    663.493   -39.5949     
1 1 1 2  7  43 o 0 155.6   38.3  ?      ?    2180.79 179.492      207.761  179.492     690.153   -0.508362    
1 1 1 2  9  43 o 0 443.3   43.7  ?      ?    2357.83 27.3006      1168.8   27.3006     204.361   27.3006      
1 1 1 2  11 43 o 0 68.3    44.2  ?      ?    448.939 -146.742     25.1448  33.2584     206.851   33.2584      
1 1 1 2  13 43 o 0 65.3    48.1  ?      ?    1216.94 -161.332     130.251  18.6684     622.447   18.6684      
1 1 1 2  15 43 o 0 978.9   64.1  ?      ?    4840.02 55.8847      1373.02  55.8847     548.655   -124.115     
1 1 1 2  17 43 o 0 1678.6  85.3  ?      ?    3058.17 -101.762     2999.56  -101.762    1835.91   -101.762     
1 1 1 2  19 43 o 0 1415.4  85.9  ?      ?    5510.28 28.6425      1781.51  28.6425     287.814   -151.357     
1 1 1 2  21 43 o 0 353.4   90.2  ?      ?    1982.77 49.3738      802.514  49.3738     83.9247   49.3738      
1 1 1 2  23 43 o 0 1052.9  120.6 ?      ?    4478.36 169.586      1474.95  169.586     93.046    -10.4142     
1 1 1 2  25 43 o 0 -88     127.3 ?      ?    1324.91 61.2737      175.324  -118.726    614.38    -118.726     
1 1 1 2  27 43 o 0 -185.7  153.1 ?      ?    1153.36 148.201      159.075  -31.7986    525.384   -31.7986     
1 1 1 0  43 3  o 0 587.6   60.9  ?      ?    461.857 90           723.164  90          519.075   90           
1 1 1 2  43 3  o 0 637.9   44.6  ?      ?    3684.13 -128.517     1294.97  -128.517    313.261   51.4827      
1 1 1 3  4  43 o 0 219.8   37.9  ?      ?    1427.79 -115.593     603.732  -115.593    14.2699   -115.593     
1 1 1 3  6  43 o 0 1040.5  53.1  ?      ?    2844.12 77.3821      2328.27  77.3821     1155.06   77.3821      
1 1 1 3  8  43 o 0 508     43.8  ?      ?    3235.33 -78.7535     1064.42  -78.7535    263.866   101.247      
1 1 1 3  10 43 o 0 155.1   41.7  ?      ?    1020.03 63.0944      306.352  63.0944     108.819   -116.906     
1 1 1 3  12 43 o 0 444.8   52.3  ?      ?    2924.89 166.673      947.976  166.673     243.947   -13.327      
1 1 1 3  14 43 o 0 48.1    48.6  ?      ?    2098.64 -114.962     382.271  65.0384     1223.46   65.0384      
1 1 1 3  16 43 o 0 422.8   57.6  ?      ?    1313.98 129.162      1163.13  129.162     647.142   129.162      
1 1 1 3  18 43 o 0 148     59.3  ?      ?    2988.5  -61.4657     124.111  118.534     1246.58   118.534      
1 1 1 3  20 43 o 0 4484.1  176.5 ?      ?    7234.66 -61.825      4182.75  -61.825     1506.15   -61.825      
1 1 1 3  22 43 o 0 1595.4  129.4 ?      ?    6406.48 130.605      1610.18  130.605     672.803   -49.3953     
1 1 1 3  24 43 o 0 855.4   126   ?      ?    3254.59 9.93814      1504.08  9.93814     385.754   9.93814      
1 1 1 3  26 43 o 0 166.1   138.5 ?      ?    1667.68 -153.233     190.583  -153.233    350.756   26.767       
1 1 1 1  43 4  o 0 41.9    36.9  ?      ?    698.267 64.9327      129.877  -115.067    437.148   -115.067     
1 1 1 3  43 4  o 0 651     43.8  ?      ?    3215.1  111.68       1495.55  111.68      100.098   111.68       
1 1 1 4  5  43 o 0 260.6   39.4  ?      ?    1342.22 30.5578      759.263  30.5578     205.506   30.5578      
1 1 1 4  7  43 o 0 1337.3  61.7  ?      ?    3507.46 -43.7478     2589.08  -43.7478    1146.25   -43.7478     
1 1 1 4  9  43 o 0 730.4   50.4  ?      ?    3545.43 176.175      1463.43  176.175     14.8716   176.175      
1 1 1 4  11 43 o 0 -1.4    44.9  ?      ?    1204.33 63.0858      322.205  -116.914    815.778   -116.914     
1 1 1 4  13 43 f 1 343.5   52.3  ?      ?    1016.64 -144.456     908.623  -144.456    495.703   -144.456     
1 1 1 4  15 43 o 0 107.3   53.2  ?      ?    1294.54 13.2613      35.5175  13.2613     477.707   -166.739     
1 1 1 4  17 43 o 0 949.5   68.5  ?      ?    3366.43 49.5391      1810.61  49.5391     531.557   49.5391      
1 1 1 4  19 43 o 0 1181.4  81.5  ?      ?    4433.21 -149.586     1809.12  -149.586    146.656   -149.586     
1 1 1 4  21 43 o 0 -78.5   83.2  ?      ?    1739.19 -110.148     403.312  69.8516     1032.78   69.8516      
1 1 1 4  23 43 o 0 1308.3  128   ?      ?    3764.08 10.7529      2066.96  10.7529     750.64    10.7529      
1 1 1 4  25 43 o 0 571.2   137.2 ?      ?    2461.18 -169.886     1136.48  -169.886    321.729   -169.886     
1 1 1 0  43 5  o 0 1689    97    ?      ?    4669.88 -90          2541.27  -90         473.958   -90          
1 1 1 2  43 5  o 0 299.4   40.9  ?      ?    1353.04 118.863      952.257  118.863     360.379   118.863      
1 1 1 4  43 5  o 0 3783.8  123.9 ?      ?    6906.95 12.8757      4337.67  12.8757     1362.24   12.8757      
1 1 1 5  6  43 o 0 3820.1  126.8 ?      ?    7293.54 -127.071     4024.3   -127.071    1023.21   -127.071     
1 1 1 5  8  43 o 0 154.6   40.8  ?      ?    948.323 93.7061      299.632  93.7061     88.6247   -86.2939     
1 1 1 5  10 43 o 0 906     55.7  ?      ?    3320.75 138.602      1881.43  138.602     533.891   138.602      
1 1 1 5  12 43 f 1 690.2   58.1  ?      ?    5722.45 3.92787      491.431  3.92787     1846.23   -176.072     
1 1 1 5  14 43 o 0 522.8   56.5  ?      ?    2038.52 -69.1508     1373.81  -69.1508    559.425   -69.1508     
1 1 1 5  16 43 o 0 -0.8    58.1  ?      ?    836.158 120.531      178.671  -59.4694    505.913   -59.4694     
1 1 1 5  18 43 o 0 638.9   67.5  ?      ?    2301.92 -120.588     1517.06  -120.588    643.832   -120.588     
1 1 1 5  20 43 o 0 1888    107   ?      ?    5684.13 89.2039      2289.28  89.2039     193.451   89.2039      
1 1 1 5  22 43 o 0 2171.2  140.2 ?      ?    4629.23 -100.774     2869.93  -100.774    1225.77   -100.774     
1 1 1 5  24 43 o 0 1422.6  139.2 ?      ?    3730.47 151.102      2200.01  151.102     943.245   151.102      
1 1 1 5  26 43 o 0 91      192.8 ?      ?    1252.39 -21.878      139.367  -21.878     265.908   158.122      
1 1 1 1  43 6  o 0 1102    57.7  ?      ?    2697.51 108.63       2649.52  108.63      1462.66   108.63       
1 1 1 3  43 6  o 0 2370.2  87.9  ?      ?    5329.91 -75.0719     3474.7   -75.0719    1161.03   -75.0719     
1 1 1 5  43 6  o 0 39      40    ?      ?    1780.32 156.938      371.621  -23.0617    1131.5    -23.0617     
1 1 1 6  7  43 o 0 41.1    39.5  ?      ?    897.061 145.425      155.226  -34.5754    522.633   -34.5754     
1 1 1 6  9  43 o 0 54.8    42.5  ?      ?    352.974 44.1276      38.9566  -135.872    182.501   -135.872     
1 1 1 6  11 43 o 0 102.1   46.3  ?      ?    863.823 -69.9377     39.0464  -69.9377    313.249   110.062      
1 1 1 6  13 43 o 0 -52.9   48.6  ?      ?    297.172 160.154      90.1122  -19.8463    209.526   -19.8463     
1 1 1 6  15 43 o 0 34.2    58.4  ?      ?    1838.57 20.4176      329.127  -159.582    1054.24   -159.582     
1 1 1 6  17 43 o 0 158.2   63.3  ?      ?    1233.9  -42.4978     210.951  -42.4978    255.375   137.502      
1 1 1 6  19 43 o 0 493.3   74.8  ?      ?    1447.85 -179.598     1263.26  -179.598    723.216   -179.598     
1 1 1 6  21 43 o 0 113     92.2  ?      ?    76.2013 102.107      6.2776   102.107     21.1541   -77.8929     
1 1 1 6  23 43 o 0 835.3   146   ?      ?    3680.86 127.728      1349.08  127.728     68.7393   127.728      
1 1 1 6  25 43 o 0 3371.9  221.7 ?      ?    5986.69 6.21914      3373.32  6.21914     1401.94   6.21914      
1 1 1 0  43 7  o 0 1295.6  88.5  ?      ?    3665.82 90           2218.94  90          600.055   90           
1 1 1 2  43 7  o 0 430.1   44.2  ?      ?    3898.43 -119.948     656.829  -119.948    1044.96   60.052       
1 1 1 4  43 7  o 0 3483.6  115.3 ?      ?    6958.6  173.784      4012.67  173.784     1020.36   173.784      
1 1 1 6  43 7  o 0 1337.7  63.9  ?      ?    3888.35 -38.9904     2514.18  -38.9904    872.716   -38.9904     
1 1 1 7  8  43 o 0 658.3   49.2  ?      ?    3315.32 102.803      1381.15  102.803     32.2594   102.803      
1 1 1 7  10 43 o 0 265.4   48    ?      ?    2951.62 -28.253      393.755  -28.253     812.726   151.747      
1 1 1 7  12 43 o 0 717.5   58.2  ?      ?    2614.36 -165.953     1674.84  -165.953    620.033   -165.953     
1 1 1 7  14 43 o 0 1396.4  85    ?      ?    5137.55 125.361      1923.14  125.361     115.016   -54.6392     
1 1 1 7  16 43 o 0 905.9   78.6  ?      ?    3368.14 -114.103     1732.8   -114.103    449.992   -114.103     
1 1 1 7  18 43 o 0 148.7   75.4  ?      ?    3327.21 67.3086      233.568  -112.691    1486.6    -112.691     
1 1 1 7  20 43 o 0 708.9   98.5  ?      ?    1674.55 -175.903     1676.18  -175.903    1066.36   -175.903     
1 1 1 7  22 43 o 0 519.7   129.6 ?      ?    3430.38 -20.6856     818.29   -20.6856    391.085   159.314      
1 1 1 7  24 43 o 0 660.6   158.5 ?      ?    4363.6  -55.5949     798.159  -55.5949    661.038   124.405      
1 1 1 7  26 43 o 0 -353.8  191.8 ?      ?    1296.08 -148.459     185.352  31.5409     601.673   31.5409      
1 1 1 1  43 8  o 0 1179.6  59.2  ?      ?    3424.81 139.574      2515.57  139.574     1015.27   139.574      
1 1 1 3  43 8  o 0 1825    76.4  ?      ?    5671.07 51.3491      2601.17  51.3491     149.281   51.3491      
1 1 1 5  43 8  o 0 321     45.6  ?      ?    1992.87 -157.183     927.631  -157.183    80.1892   -157.183     
1 1 1 7  43 8  o 0 275.9   44.8  ?      ?    3619.61 -97.5259     241.885  -97.5259    1266.74   82.4741      
1 1 1 8  9  43 o 0 566.8   53.1  ?      ?    3552.78 24.2914      1046.02  24.2914     406.999   -155.709     
1 1 1 8  11 43 o 0 190.6   53.4  ?      ?    989.775 -174.155     392.822  -174.155    7.44914   5.84453      
1 1 1 8  13 43 o 0 592     63.1  ?      ?    3153.61 43.7134      1207.51  43.7134     48.7412   -136.287     
1 1 1 8  15 43 o 0 725.3   74.2  ?      ?    3918.76 -150.123     1218.8   -150.123    282.598   29.877       
1 1 1 8  17 43 o 0 387.1   76.6  ?      ?    2150.44 63.3102      932.443  63.3102     116.274   63.3102      
1 1 1 8  19 43 o 0 1638.8  119.6 ?      ?    4437.59 42.5369      2406.46  42.5369     766.543   42.5369      
1 1 1 8  21 43 o 0 -41.1   90.4  ?      ?    1520.54 -138.699     281.085  41.3006     823.351   41.3006      
1 1 1 8  23 43 f 1 512.8   148   ?      ?    2205.06 -76.3372     1088.03  -76.3372    336.486   -76.3372     
1 1 1 8  25 43 o 0 1380.5  194.9 ?      ?    2392.96 145.664      2367.41  145.664     1586.89   145.664      
1 1 1 0  43 9  o 0 -83.5   63.1  ?      ?    708.166 90           21.206   90          289.438   -90          
1 1 1 2  43 9  o 0 635.1   54.2  ?      ?    3204.48 -13.2254     1457.94  -13.2254    67.8722   -13.2254     
1 1 1 4  43 9  o 0 464.5   50.1  ?      ?    3507.83 -22.6829     885.963  -22.6829    613.525   157.317      
1 1 1 6  43 9  o 0 329     48.5  ?      ?    1474.23 139.851      1011.78  139.851     392.935   139.851      
1 1 1 8  43 9  o 0 971.6   64    ?      ?    2667.56 -111.519     2218.4   -111.519    1107.42   -111.519     
1 1 1 9  10 43 o 0 87.5    53.9  ?      ?    670.193 130.364      0.881723 -49.6356    272.081   -49.6356     
1 1 1 9  12 43 o 0 1.9     57.7  ?      ?    1173.79 107.742      257.225  -72.2577    725.923   -72.2577     
1 1 1 9  14 43 o 0 1027.4  75.6  ?      ?    5532.02 -36.118      1180.74  -36.118     990.636   143.882      
1 1 1 9  16 43 o 0 1939.8  108.4 ?      ?    5006.9  127.334      2643.49  127.334     757.228   127.334      
1 1 1 9  18 43 o 0 3249.8  158.2 ?      ?    6510.24 -42.6337     3426.42  -42.6337    1001.79   -42.6337     
1 1 1 9  20 43 o 0 -194.1  97    ?      ?    2012.78 91.6764      515.598  -88.3236    1240.33   -88.3236     
1 1 1 9  22 43 o 0 156.3   142   ?      ?    2155.82 -107.881     139.643  -107.881    611.724   72.1188      
1 1 1 9  24 43 o 0 605.6   184.2 ?      ?    2459.94 12.7625      1159.51  12.7625     346.378   12.7625      
1 1 1 1  43 10 o 0 991     61.3  ?      ?    3617.32 -69.6691     2068.63  -69.6691    497.638   -69.6691     
1 1 1 3  43 10 o 0 1193.8  66.7  ?      ?    3520.55 -162.43      2446.83  -162.43     937.164   -162.43      
1 1 1 5  43 10 o 0 733.7   60.1  ?      ?    3493.78 -65.5383     1533.57  -65.5383    59.5102   -65.5383     
1 1 1 7  43 10 o 0 1094.2  64.8  ?      ?    3935.88 133.486      2006.6   133.486     355.883   133.486      
1 1 1 9  43 10 o 0 420.9   58.4  ?      ?    4020.08 144.697      500.63   144.697     1146.48   -35.3034     
1 1 1 10 11 43 o 0 1336.6  79.8  ?      ?    3559.97 -23.7005     2425.43  -23.7005    1002.97   -23.7005     
1 1 1 10 13 43 o 0 239.8   62.2  ?      ?    1577.44 164.046      586.054  164.046     34.6054   -15.9538     
1 1 1 10 15 43 o 0 7.8     74.3  ?      ?    1183.18 -78.8148     199.497  101.185     647.1     101.185      
1 1 1 10 17 43 o 0 227.9   75.7  ?      ?    1913.66 -151.224     423.827  -151.224    293.134   28.7763      
1 1 1 10 19 43 o 0 396.1   98.5  ?      ?    2082.13 -104.379     889.858  -104.379    134.328   -104.379     
1 1 1 10 21 43 o 0 275.6   143.4 ?      ?    1399.33 44.5507      509.185  44.5507     16.7943   44.5507      
1 1 1 10 23 43 o 0 629     171.1 ?      ?    2708.07 -31.7645     1178.67  -31.7645    273.272   -31.7645     
1 1 1 10 25 43 o 0 -357.6  209.9 ?      ?    1027.34 172.49       120.096  -7.51043    450.607   -7.51043     
1 1 1 0  43 11 o 0 869.2   87.6  ?      ?    4102.89 -90          1779.27  -90         0.716119  90           
1 1 1 2  43 11 o 0 2611.3  105   ?      ?    5871.29 56.4707      3499.02  56.4707     978.841   56.4707      
1 1 1 4  43 11 o 0 682.6   58.3  ?      ?    4713.22 -172.616     922.523  -172.616    1099.64   7.38418      
1 1 1 6  43 11 o 0 162.2   50.7  ?      ?    3689.38 31.0062      277.575  -148.994    1832.54   -148.994     
1 1 1 8  43 11 o 0 247.3   58.5  ?      ?    2189.41 67.6004      545.191  67.6004     358.056   -112.4       
1 1 1 10 43 11 o 0 469.7   62.7  ?      ?    2617.02 -61.3812     1092.27  -61.3812    39.3421   -61.3812     
1 1 1 11 12 43 o 0 642.5   68.3  ?      ?    1472.22 -160.577     1705.81  -160.577    1126.15   -160.577     
1 1 1 11 14 43 o 0 -64.7   71.8  ?      ?    1865.63 79.6549      473.625  -100.345    1181.11   -100.345     
1 1 1 11 16 43 o 0 29.9    75.7  ?      ?    849.998 -98.3929     107.336  81.6071     427.118   81.6071      
1 1 1 11 18 43 o 0 1746.1  124.7 ?      ?    4334.27 106.067      2553.24  106.067     971.152   106.067      
1 1 1 11 20 43 o 0 803.1   113.8 ?      ?    3353.31 -105.176     1425.62  -105.176    236.56    -105.176     
1 1 1 11 22 43 o 0 11      165.5 ?      ?    1260.6  -159.355     16.7491  -159.355    408.731   20.645       
1 1 1 11 24 43 o 0 250.8   205.5 ?      ?    1523.19 -59.4749     408.78   -59.4749    86.8192   120.525      
1 1 1 1  43 12 o 0 125.5   52.1  ?      ?    685.482 -80.9418     114.84   -80.9418    183.115   99.0582      
1 1 1 3  43 12 o 0 4.8     53.8  ?      ?    1334.29 97.5211      326.942  -82.4789    899.874   -82.4789     
1 1 1 5  43 12 f 1 193     56.6  ?      ?    1885.95 91.1681      397.812  91.1681     403.798   -88.8319     
1 1 1 7  43 12 o 0 540.7   60.4  ?      ?    3916.91 -33.4515     860.271  -33.4515    763.42    146.549      
1 1 1 9  43 12 o 0 -124.4  59.2  ?      ?    1316.41 24.0392      424.458  -155.961    957.717   -155.961     
1 1 1 11 43 12 o 0 717.5   70    ?      ?    3975.69 169.53       1180.59  169.53      387.259   -10.4701     
1 1 1 12 13 43 f 1 64.8    71    ?      ?    2665.06 -148.386     393.75   31.6138     1410.8    31.6138      
1 1 1 12 15 43 o 0 94.6    77.1  ?      ?    2804.06 11.0933      299.989  -168.907    1357.45   -168.907     
1 1 1 12 17 43 f 1 487.8   93.5  ?      ?    1977.13 113.443      1178.76  113.443     446.297   113.443      
1 1 1 12 19 43 o 0 115.7   130.5 ?      ?    1226.68 -141.061     101.223  -141.061    336.303   38.9392      
1 1 1 12 21 43 o 0 342     119.3 ?      ?    1361.88 -166.829     723.516  -166.829    252.623   -166.829     
1 1 1 12 23 43 o 0 -37     39.2  ?      ?    2028.52 153.215      546.273  -26.7855    1212.51   -26.7855     
1 1 1 0  43 13 o 0 316.9   78.5  ?      ?    3281.86 90           1016.12  90          405.345   -90          
1 1 1 2  43 13 o 0 743.7   64.7  ?      ?    2820.62 -1.31041     1766.82  -1.31041    557.367   -1.31041     
1 1 1 4  43 13 f 1 740.6   63.8  ?      ?    3347.98 24.0304      1545.89  24.0304     121.932   24.0304      
1 1 1 6  43 13 o 0 152.9   62    ?      ?    1391.12 144.278      236.871  144.278     341.333   -35.7224     
1 1 1 8  43 13 o 0 507.4   63.1  ?      ?    4205.61 -105.346     654.26   -105.346    1057.37   74.6536      
1 1 1 10 43 13 o 0 717.6   71.7  ?      ?    3679.39 103.06       1292.62  103.06      168.207   -76.9401     
1 1 1 12 43 13 f 1 781.1   74.6  ?      ?    2918.51 -13.2211     1625.2   -13.2211    515.318   -13.2211     
1 1 1 13 14 43 o 0 579     81.6  ?      ?    5416.64 -163.181     373.075  -163.181    1670.95   16.8187      
1 1 1 13 16 43 o 0 1258.2  99.8  ?      ?    3793.03 -20.2504     2100.86  -20.2504    700.283   -20.2504     
1 1 1 13 18 43 o 0 169.2   97.9  ?      ?    2630.2  160.996      19.9915  160.996     921.946   -19.0041     
1 1 1 13 20 43 o 0 823.6   131.8 ?      ?    2898.94 61.299       1561.82  61.299      553.656   61.299       
1 1 1 13 22 43 o 0 -15.5   172.1 ?      ?    1120.82 165.188      3.70581  165.188     367.188   -14.8122     
1 1 1 1  43 14 o 0 987.2   70.8  ?      ?    3610.75 -42.5439     1968.27  -42.5439    425.74    -42.5439     
1 1 1 3  43 14 o 0 584.8   64.9  ?      ?    3007.26 -116.445     1313.79  -116.445    43.915    -116.445     
1 1 1 5  43 14 o 0 242.1   63.5  ?      ?    1946.25 16.0498      578.417  16.0498     230.932   -163.95      
1 1 1 7  43 14 o 0 339.7   62.1  ?      ?    2245.76 101.15       837.816  101.15      78.5125   -78.8498     
1 1 1 9  43 14 o 0 770.8   71.2  ?      ?    4237.28 -117.671     1207.39  -117.671    482.704   62.3288      
1 1 1 11 43 14 o 0 62.6    69.4  ?      ?    1586.89 22.5607      164.924  -157.439    769.062   -157.439     
1 1 1 13 43 14 o 0 644.8   83.6  ?      ?    2622.35 92.7746      1419.8   92.7746     438.478   92.7746      
1 1 1 14 15 43 o 0 299.7   85.8  ?      ?    2252.5  40.4183      622.028  40.4183     210.187   -139.582     
1 1 1 14 17 43 f 1 82.9    106.1 ?      ?    1500.98 -83.6113     32.3417  96.3887     574.137   96.3887      
1 1 1 14 19 43 o 0 224.8   116.4 ?      ?    965.243 63.0152      337.595  63.0152     0.585821  63.0152      
1 1 1 14 21 43 o 0 32.6    136   ?      ?    966.873 -132.369     6.06967  47.6309     327.834   47.6309      
1 1 1 14 23 43 o 0 66      231.7 ?      ?    2504.45 -158.228     1.73339  21.7719     806.296   21.7719      
1 1 1 0  43 15 o 0 72.5    85.6  ?      ?    1846.4  -90          220.009  -90         563.995   90           
1 1 1 2  43 15 o 0 227.8   61.7  ?      ?    2060.45 -166.274     505.661  -166.274    361.054   13.7258      
1 1 1 4  43 15 o 0 673.9   67    ?      ?    2662.68 -141.63      1607.85  -141.63     502.479   -141.63      
1 1 1 6  43 15 o 0 138.8   68.1  ?      ?    659.974 -167.482     136.213  -167.482    133.173   12.5176      
1 1 1 8  43 15 o 0 308.7   73.2  ?      ?    1400.17 -19.5103     790.776  -19.5103    242.039   -19.5103     
1 1 1 10 43 15 o 0 206.9   65.6  ?      ?    1697.13 36.9501      415.964  36.9501     233.094   -143.05      
1 1 1 12 43 15 o 0 114.6   73.9  ?      ?    163.808 95.1168      15.4709  95.1168     46.2424   -84.8832     
1 1 1 14 43 15 o 0 -44.1   86.2  ?      ?    797.389 -43.5308     147.507  136.469     438.308   136.469      
1 1 1 15 16 43 o 0 -235.9  104.4 ?      ?    504.9   -75.01       125.137  104.99      306.447   104.99       
1 1 1 15 18 43 o 0 777.9   134   ?      ?    2703.21 151.885      1533.23  151.885     587.399   151.885      
1 1 1 15 20 43 o 0 568.1   140.5 ?      ?    2740.82 -18.8532     1077.07  -18.8532    161.475   -18.8532     
1 1 1 15 22 43 o 0 -140.2  154.4 ?      ?    1178.92 173.025      134.93   -6.97525    515.753   -6.97525     
1 1 1 1  43 16 o 0 128.6   62.4  ?      ?    979.546 178.737      134.971  178.737     274.511   -1.26268     
1 1 1 3  43 16 o 0 278.4   68.5  ?      ?    2242.85 105.844      639.435  105.844     287.934   -74.1561     
1 1 1 5  43 16 o 0 215.8   75.4  ?      ?    1074.16 -162.121     459.62   -162.121    21.9826   -162.121     
1 1 1 7  43 16 o 0 691.7   73.5  ?      ?    2208.27 -143.746     1699.91  -143.746    834.239   -143.746     
1 1 1 9  43 16 o 0 415.5   75.8  ?      ?    1377.26 1.67312      1091.84  1.67312     563.855   1.67312      
1 1 1 11 43 16 o 0 915.6   91    ?      ?    3729.1  -23.6595     1617.18  -23.6595    205.874   -23.6595     
1 1 1 13 43 16 o 0 491.8   89.1  ?      ?    3496.03 -154.479     797.081  -154.479    486.549   25.5213      
1 1 1 15 43 16 o 0 189     93.3  ?      ?    2458.76 74.6385      125.007  74.6385     742.722   -105.361     
1 1 1 16 17 43 o 0 583.4   126.2 ?      ?    1916.69 -58.1866     1320.61  -58.1866    649.762   -58.1866     
1 1 1 16 19 43 o 0 731.7   155.6 ?      ?    1730.53 71.1         1570.25  71.1        991.002   71.1         
1 1 1 16 21 43 o 0 391.1   165.8 ?      ?    2521.93 -144.189     614.906  -144.189    202.717   35.8105      
1 1 1 0  43 17 o 0 134.4   96.8  ?      ?    2174.76 -90          363.038  -90         520.337   90           
1 1 1 2  43 17 o 0 80.3    74.2  ?      ?    856.465 142.873      25.4975  -37.1274    370.4     -37.1274     
1 1 1 4  43 17 o 0 415     80.9  ?      ?    3392.61 15.4193      695.532  15.4193     653.68    -164.581     
1 1 1 6  43 17 o 0 243.7   77.5  ?      ?    827.835 108.033      462.6    108.033     138.716   108.033      
1 1 1 8  43 17 o 0 839.6   84.6  ?      ?    5875.86 141.151      757.838  141.151     1525.43   -38.8493     
1 1 1 10 43 17 o 0 87      82.1  ?      ?    1681.2  -148.767     78.8699  31.233      716.626   31.233       
1 1 1 12 43 17 f 1 277.8   91.3  ?      ?    3953.11 -21.6658     29.9686  -21.6658    1436.35   158.334      
1 1 1 14 43 17 f 1 173.2   104.3 ?      ?    2852.16 131.811      27.2061  -48.1891    1046.41   -48.1891     
1 1 1 16 43 17 o 0 525.9   124.3 ?      ?    3317.32 -41.8238     849.08   -41.8238    287.304   138.176      
1 1 1 17 18 43 o 0 175.4   148.9 ?      ?    2539.14 -39.8174     113.655  -39.8174    736.374   140.183      
1 1 1 17 20 43 o 0 42.6    166   ?      ?    1264.1  -143.387     43.4918  -143.387    367.071   36.6127      
1 1 1 1  43 18 o 0 -70.1   74.6  ?      ?    937.487 -156.235     239.428  23.7647     613.645   23.7647      
1 1 1 3  43 18 o 0 427.7   77.7  ?      ?    3609.76 -55.9708     660.668  -55.9708    765.615   124.029      
1 1 1 5  43 18 o 0 2050.4  110.7 ?      ?    4621.95 93.3855      3047.73  93.3855     1222.88   93.3855      
1 1 1 7  43 18 o 0 1221.8  99.6  ?      ?    3170.47 22.0343      2354.42  22.0343     1124.96   22.0343      
1 1 1 9  43 18 o 0 410.6   88.4  ?      ?    2501.63 122.178      904.474  122.178     44.6291   -57.8219     
1 1 1 11 43 18 o 0 1896.3  116.1 ?      ?    4563.54 -123.546     2686.27  -123.546    1007.62   -123.546     
1 1 1 13 43 18 o 0 1114.3  117   ?      ?    2886.15 -17.5225     2080.46  -17.5225    1050.17   -17.5225     
1 1 1 15 43 18 o 0 383.7   129.8 ?      ?    2740.73 -145.876     635.138  -145.876    310.275   34.1236      
1 1 1 17 43 18 o 0 684.8   154.8 ?      ?    2702.48 103.301      1280.8   103.301     398.718   103.301      
1 1 1 18 19 43 o 0 -179.1  163.3 ?      ?    1238.42 177.299      143.646  -2.70059    545.838   -2.70059     
1 1 1 0  43 19 o 0 793.8   130.6 ?      ?    3142.65 90           1556.62  90          299.644   90           
1 1 1 2  43 19 o 0 460.5   88.5  ?      ?    2394.52 -113.338     1115.05  -113.338    164.728   -113.338     
1 1 1 4  43 19 o 0 741.6   95.6  ?      ?    3595.34 10.4177      1380.49  10.4177     29.6845   -169.582     
1 1 1 6  43 19 o 0 261.6   92.6  ?      ?    1178.99 -51.1469     551.498  -51.1469    96.2871   -51.1469     
1 1 1 8  43 19 o 0 643.8   101.4 ?      ?    4619.68 -18.8122     783.474  -18.8122    965.475   161.188      
1 1 1 10 43 19 o 0 1238.6  110.4 ?      ?    3596.45 118.029      2120.83  118.029     797.789   118.029      
1 1 1 12 43 19 o 0 620.9   108.8 ?      ?    2709.3  166.486      1266.09  166.486     296.646   166.486      
1 1 1 14 43 19 o 0 726.8   123.1 ?      ?    3793.63 -93.2342     1128.43  -93.2342    186.33    86.7658      
1 1 1 16 43 19 o 0 687.1   149.2 ?      ?    3212.62 92.6399      1169.69  92.6399     113.643   92.6399      
1 1 1 18 43 19 o 0 970     173.9 ?      ?    4748.91 1.00402      1133.74  1.00402     364.643   -178.996     
1 1 1 1  43 20 o 0 91.3    91    ?      ?    1151.27 142.829      8.21615  142.829     443.489   -37.1709     
1 1 1 3  43 20 o 0 881.5   96.4  ?      ?    3576.82 128.649      1645.4   128.649     255.115   128.649      
1 1 1 5  43 20 o 0 1199.6  117.8 ?      ?    4133.65 -62.4429     1965.98  -62.4429    380.641   -62.4429     
1 1 1 7  43 20 o 0 976.2   109.4 ?      ?    3236.15 152.027      1854.96  152.027     641.383   152.027      
1 1 1 9  43 20 o 0 1363.7  125.2 ?      ?    4525.29 -28.5286     1989.44  -28.5286    328.304   -28.5286     
1 1 1 11 43 20 o 0 402.8   117.8 ?      ?    571.017 -99.7878     602.111  -99.7878    397.769   -99.7878     
1 1 1 13 43 20 o 0 629.8   136.7 ?      ?    3106.33 133.56       1138.33  133.56      59.1653   133.56       
1 1 1 15 43 20 o 0 762.3   165.8 ?      ?    1857.65 54.4629      1581.4   54.4629     967.812   54.4629      
1 1 1 17 43 20 o 0 980     196.5 ?      ?    4537.58 -73.05       1195.88  -73.05      246.265   106.95       
1 1 1 0  43 21 o 0 -375    143.4 ?      ?    1808.08 90           57.0832  90          642.415   -90          
1 1 1 2  43 21 o 0 12.7    113.2 ?      ?    1798.04 65.324       203.063  -114.676    890.435   -114.676     
1 1 1 4  43 21 o 0 255.9   115.1 ?      ?    1966.8  -50.0682     436.333  -50.0682    307.342   129.932      
1 1 1 6  43 21 o 0 28.1    117.2 ?      ?    624.281 -169.512     27.5985  10.4881     260.125   10.4881      
1 1 1 8  43 21 o 0 -95.8   119.5 ?      ?    1335.29 26.4785      222.936  -153.521    710.898   -153.521     
1 1 1 10 43 21 o 0 232.9   135.6 ?      ?    1375.44 -77.4401     399.897  -77.4401    91.2394   102.56       
1 1 1 12 43 21 o 0 804.8   149.5 ?      ?    3769.73 118.334      1267.44  118.334     42.3793   -61.6661     
1 1 1 14 43 21 o 0 90.9    157.9 ?      ?    1267.55 -96.5761     97.7433  -96.5761    321.979   83.4239      
1 1 1 16 43 21 o 0 555.3   185.1 ?      ?    2111.02 -176.222     1027.63  -176.222    353.373   -176.222     
1 1 1 1  43 22 o 0 1133.3  123.5 ?      ?    3323.84 69.1602      2088.36  69.1602     835.534   69.1602      
1 1 1 3  43 22 o 0 711.9   130.2 ?      ?    5089.1  -102.356     724.892  -102.356    1177.12   77.6441      
1 1 1 5  43 22 o 0 13.7    136.6 ?      ?    1195.68 62.6743      46.7182  -117.326    487.993   -117.326     
1 1 1 7  43 22 o 0 553.3   140.3 ?      ?    2676.34 -33.3138     1123.06  -33.3138    151.702   -33.3138     
1 1 1 9  43 22 o 0 614.6   139   ?      ?    983.775 -136.402     1326.83  -136.402    977.127   -136.402     
1 1 1 11 43 22 o 0 -4.5    143.3 ?      ?    2788.68 -89.6458     307.97   90.3542     1258.97   90.3542      
1 1 1 13 43 22 o 0 22.2    161.5 ?      ?    2550.34 87.1383      164.851  -92.8617    1009.52   -92.8617     
1 1 1 15 43 22 o 0 869.3   191.4 ?      ?    3248.3  153.087      1372.47  153.087     332.243   153.087      
1 1 1 0  43 23 o 0 -162    187.8 ?      ?    57.4913 -90          4.34957  -90         16.9585   90           
1 1 1 2  43 23 o 0 917.3   131.2 ?      ?    3386.54 110.734      1668.56  110.734     420.721   110.734      
1 1 1 4  43 23 o 0 626.2   144.3 ?      ?    3421.1  -130.885     1077.25  -130.885    170.65    49.1145      
1 1 1 6  43 23 o 0 127.1   145.7 ?      ?    754.896 27.8871      138.583  27.8871     132.875   -152.113     
1 1 1 8  43 23 f 1 107.7   151.4 ?      ?    1105.36 -141.381     131.188  -141.381    254.816   38.6191      
1 1 1 10 43 23 o 0 485.1   165.2 ?      ?    696.375 -76.3261     751.546  -76.3261    515.134   -76.3261     
1 1 1 12 43 23 o 0 -73     174   ?      ?    1818.91 -122.911     121.04   57.0888     722.181   57.0888      
1 1 1 14 43 23 o 0 142.2   211.2 ?      ?    1270.74 112.02       195.18   112.02      211.88    -67.9804     
1 1 1 1  43 24 o 0 1491.3  165.4 ?      ?    3774.62 63.0627      2380.81  63.0627     1013.25   63.0627      
1 1 1 3  43 24 o 0 661.7   148.4 ?      ?    2818.97 56.7944      1316.43  56.7944     302.728   56.7944      
1 1 1 5  43 24 o 0 -81.8   159.2 ?      ?    638.139 55.8498      34.5343  -124.15     257.61    -124.15      
1 1 1 7  43 24 o 0 -125    172.5 ?      ?    1642.96 -6.76302     151.188  173.237     716.423   173.237      
1 1 1 9  43 24 o 0 2431.6  212.1 ?      ?    4989.74 -167.148     2912.28  -167.148    1229.93   -167.148     
1 1 1 11 43 24 o 0 503.4   193.6 ?      ?    3351.22 34.2733      648.3    34.2733     454.319   -145.727     
1 1 1 0  43 25 o 0 534.7   226   ?      ?    1897.71 -90          890.048  -90         226.912   -90          
1 1 1 2  43 25 o 0 1600.4  170.3 ?      ?    4453.94 -20.7554     2255.59  -20.7554    706.629   -20.7554     
1 1 1 4  43 25 o 0 -99.4   164.2 ?      ?    1818.04 -110.128     179.333  69.8716     805.838   69.8716      
1 1 1 6  43 25 o 0 814.7   189.9 ?      ?    3771.37 -38.0187     1244.61  -38.0187    37.6696   141.981      
1 1 1 8  43 25 o 0 61.8    195.8 ?      ?    1612.34 150.009      103.907  150.009     434.671   -29.9912     
1 1 1 10 43 25 o 0 1455    213.6 ?      ?    3418.29 81.103       2154.45  81.103      1037.46   81.103       
1 1 1 1  43 26 o 0 1268.4  175.4 ?      ?    3066.94 -91.384      2172.75  -91.384     1126.9    -91.384      
1 1 1 3  43 26 o 0 140.4   171.3 ?      ?    2132.9  145.429      130.687  145.429     591.97    -34.5708     
1 1 1 5  43 26 o 0 866.8   187   ?      ?    2218.62 -123.55      1694.02  -123.55     950.423   -123.55      
1 1 1 7  43 26 o 0 107.6   206   ?      ?    2094.33 123.491      85.8139  123.491     605.555   -56.5088     
1 1 1 0  43 27 o 0 1606.1  294.8 ?      ?    4315.74 90           1832.07  90          393.066   90           
1 1 1 2  43 27 o 0 1764.7  217.8 ?      ?    5765.88 -88.7163     1865.15  -88.7163    50.3778   91.2837      
1 1 1 0  44 0  o 0 960.5   111.1 ?      ?    2387.39 180          1696.23  180         695.724   -180         
1 1 1 0  2  44 o 0 1165.6  88.4  ?      ?    5208.48 -2.31771e-14 1864.17  0           174.394   180          
1 1 1 0  4  44 o 0 45.1    63    ?      ?    289.235 -3.06586e-14 25.5227  0           88.093    180          
1 1 1 0  6  44 o 0 36.4    60.5  ?      ?    124.754 -180         9.73477  180         39.2541   2.06379e-13  
1 1 1 0  8  44 o 0 890.8   83.4  ?      ?    3261.66 6.85015e-15  1624.57  0           331.559   -2.67141e-14 
1 1 1 0  10 44 o 0 -22.4   74.5  ?      ?    359.156 2.08828e-13  17.6649  0           123.534   -180         
1 1 1 0  12 44 o 0 -1      73.4  ?      ?    1271.88 180          70.6384  180         423.258   -1.96978e-14 
1 1 1 0  14 44 o 0 85.1    78.5  ?      ?    808.339 -180         104.228  180         204.569   8.02639e-14  
1 1 1 0  16 44 f 1 5423    267.1 ?      ?    6216.08 180          3839.26  180         1515.04   180          
1 1 1 0  18 44 f 1 7094.7  338.5 ?      ?    6367.07 -1.17762e-15 4277.21  0           1954.05   1.40006e-15  
1 1 1 0  20 44 o 0 471.3   113   ?      ?    4293.68 1.70488e-15  1035.36  0           471.058   -180         
1 1 1 0  22 44 o 0 223.3   168.1 ?      ?    2591.93 180          478.614  180         401.641   -6.74113e-14 
1 1 1 0  24 44 o 0 -385.3  204.8 ?      ?    1546.24 3.32731e-14  69.6288  0           428.345   -180         
1 1 1 1  44 1  o 0 240.5   45.2  ?      ?    2929.3  -159.592     355.615  -159.592    870.677   20.4083      
1 1 1 1  3  44 o 0 166.3   42.5  ?      ?    1128.77 -102.552     351.26   -102.552    92.6367   77.4479      
1 1 1 1  5  44 o 0 630.3   48.3  ?      ?    3180.74 25.2663      1321.05  25.2663     68.2994   25.2663      
1 1 1 1  7  44 o 0 507.5   48.3  ?      ?    1085.8  -102.414     1368.62  -102.414    936.086   -102.414     
1 1 1 1  9  44 f 1 324.3   47.2  ?      ?    4125.62 -140.405     165.736  -140.405    1476.5    39.5946      
1 1 1 1  11 44 o 0 830.9   61.3  ?      ?    2615.28 57.6811      1847.44  57.6811     822.935   57.6811      
1 1 1 1  13 44 f 1 1983.9  88.5  ?      ?    5128.61 -148.137     2631.96  -148.137    640.341   -148.137     
1 1 1 1  15 44 o 0 1783.8  90.8  ?      ?    2841.62 74.4093      3125.26  74.4093     2069.31   74.4093      
1 1 1 1  17 44 o 0 1609.9  91.1  ?      ?    4637.63 -125.043     2304.49  -125.043    596.603   -125.043     
1 1 1 1  19 44 o 0 3.9     77.2  ?      ?    1060.56 -52.808      173.194  127.192     551.664   127.192      
1 1 1 1  21 44 o 0 17.6    105.9 ?      ?    1256.37 34.1363      109.548  -145.864    544.462   -145.864     
1 1 1 1  23 44 o 0 817.2   138.2 ?      ?    2617.51 -59.2864     1557.54  -59.2864    696.447   -59.2864     
1 1 1 1  25 44 o 0 846.4   169.7 ?      ?    3304.51 79.0079      1326.14  79.0079     280.035   79.0079      
1 1 1 0  44 2  o 0 592.8   76.8  ?      ?    3659.76 4.52477e-14  1426.76  0           119.574   -180         
1 1 1 2  44 2  o 0 26      42    ?      ?    2377.35 150.479      582.247  -29.5213    1574.62   -29.5213     
1 1 1 2  4  44 f 1 6.4     43.9  ?      ?    972.059 -123.041     231.794  56.9594     617.263   56.9594      
1 1 1 2  6  44 o 0 584.7   50.4  ?      ?    3904.43 -84.0797     940.199  -84.0797    619.88    95.9203      
1 1 1 2  8  44 o 0 3648.9  130.2 ?      ?    7800.2  155.973      3438.04  155.973     335.354   155.973      
1 1 1 2  10 44 o 0 850.8   63.2  ?      ?    3862.26 -13.8577     1485.39  -13.8577    37.9858   166.142      
1 1 1 2  12 44 o 0 1058.7  67.6  ?      ?    4129.44 110.411      1735.65  110.411     126.975   110.411      
1 1 1 2  14 44 o 0 274     61.2  ?      ?    2088.17 138.528      597.769  138.528     186.614   -41.4721     
1 1 1 2  16 44 f 1 589.6   67.9  ?      ?    3408.96 3.63031      1068.17  3.63031     210.596   -176.37      
1 1 1 2  18 44 o 0 1166.6  88.7  ?      ?    5026.5  139.213      1532.17  139.213     297.681   -40.7868     
1 1 1 2  20 44 o 0 1361.4  102.2 ?      ?    3969.51 -124.501     2096.63  -124.501    699.041   -124.501     
1 1 1 2  22 44 o 0 1269.7  140.9 ?      ?    4875.36 -33.7596     1622.15  -33.7596    39.7597   146.24       
1 1 1 2  24 44 o 0 815     149.1 ?      ?    3555.84 134.205      1279.34  134.205     129.611   134.205      
1 1 1 1  44 3  o 0 33.2    46.5  ?      ?    475.709 50.1254      83.8486  -129.875    284.24    -129.875     
1 1 1 3  44 3  o 0 497.8   48.9  ?      ?    2774.16 -92.9777     1203.65  -92.9777    51.0176   -92.9777     
1 1 1 3  5  44 o 0 138.9   44.9  ?      ?    472.818 -88.905      140.491  -88.905     46.0756   91.095       
1 1 1 3  7  44 o 0 345.9   47.6  ?      ?    942.889 118.355      878.895  118.355     502.682   118.355      
1 1 1 3  9  44 o 0 322     52.2  ?      ?    3000.14 112.099      548.673  112.099     640.54    -67.9011     
1 1 1 3  11 44 o 0 520.9   58.2  ?      ?    4516.06 1.79126      554.542  1.79126     1216.88   -178.209     
1 1 1 3  13 44 o 0 147.8   57.5  ?      ?    1525.64 -44.3014     191.405  -44.3014    398.452   135.699      
1 1 1 3  15 44 o 0 97.2    65.3  ?      ?    1181.66 2.39184      10.1693  -177.608    449.813   -177.608     
1 1 1 3  17 44 o 0 290.6   76.9  ?      ?    3875.89 120.885      142.553  120.885     1286.6    -59.1153     
1 1 1 3  19 44 o 0 431.5   83.5  ?      ?    2746.59 17.4001      837.094  17.4001     144.372   -162.6       
1 1 1 3  21 44 o 0 1391.6  117.4 ?      ?    5398.79 -145.506     1649.99  -145.506    221.674   34.4942      
1 1 1 3  23 44 o 0 9.7     131.6 ?      ?    775.069 -19.6056     23.9818  160.394     279.383   160.394      
1 1 1 3  25 44 o 0 194.8   157.3 ?      ?    1609.43 -165.812     231.492  -165.812    278.96    14.1878      
1 1 1 0  44 4  o 0 -10.3   65    ?      ?    440.675 -180         23.7482  180         163.197   2.91828e-13  
1 1 1 2  44 4  f 1 774.2   54.4  ?      ?    3733.27 148.081      1516.34  148.081     57.5752   -31.9193     
1 1 1 4  44 4  o 0 700.4   52.8  ?      ?    4366.53 -85.419      1107.26  -85.419     695.333   94.581       
1 1 1 4  6  44 o 0 151.7   46.1  ?      ?    2879.37 129.901      43.1773  -50.0986    1193.57   -50.0986     
1 1 1 4  8  44 o 0 790.6   56.6  ?      ?    3899.07 -9.30492     1370.38  -9.30492    180.035   170.695      
1 1 1 4  10 44 o 0 -108.8  50    ?      ?    1255.16 -26.9456     410.413  153.054     905.222   153.054      
1 1 1 4  12 44 o 0 1439.5  76.9  ?      ?    5218.97 -79.8588     1922.07  -79.8588    109.725   100.141      
1 1 1 4  14 44 o 0 589.3   64.8  ?      ?    2144.58 156.193      1427.04  156.193     622.051   156.193      
1 1 1 4  16 44 o 0 253.3   64.9  ?      ?    2542.68 44.9192      425.179  44.9192     522.56    -135.081     
1 1 1 4  18 44 o 0 638.1   80.6  ?      ?    2334.15 -166.049     1438.49  -166.049    589.385   -166.049     
1 1 1 4  20 44 o 0 1802.4  122.1 ?      ?    4173.46 -32.0336     2580.95  -32.0336    1112.53   -32.0336     
1 1 1 4  22 44 o 0 4804.9  221.9 ?      ?    8567.22 137.38       3660.42  137.38      741.656   137.38       
1 1 1 4  24 44 o 0 2152.4  182.6 ?      ?    5374.41 -53.9613     2416.62  -53.9613    679.601   -53.9613     
1 1 1 1  44 5  o 0 30.2    45.3  ?      ?    1951.4  71.1796      431.978  -108.82     1255.71   -108.82      
1 1 1 3  44 5  o 0 414.1   50.9  ?      ?    3325.41 137.653      785.936  137.653     599       -42.3474     
1 1 1 5  44 5  o 0 -35     45.5  ?      ?    434.782 -58.3571     133.328  121.643     313.82    121.643      
1 1 1 5  7  44 o 0 387.3   51    ?      ?    1451.99 -171.327     1086.81  -171.327    508.636   -171.327     
1 1 1 5  9  44 o 0 398.4   55.8  ?      ?    1616.04 -134.554     1101.59  -134.554    462.459   -134.554     
1 1 1 5  11 44 o 0 -21.2   54.5  ?      ?    2280.94 166.633      606.813  -13.3668    1499.31   -13.3668     
1 1 1 5  13 44 o 0 545.2   66.1  ?      ?    2852.58 6.11978      1155.7   6.11978     55.6679   6.11978      
1 1 1 5  15 44 o 0 1348.4  89.2  ?      ?    3203.31 -175.937     2435.43  -175.937    1246.82   -175.937     
1 1 1 5  17 44 o 0 207.2   73.2  ?      ?    3161.88 -40.1772     53.9424  -40.1772    1108.75   139.823      
1 1 1 5  19 44 o 0 1080.9  92    ?      ?    3271.5  -166.209     1929.17  -166.209    763.324   -166.209     
1 1 1 5  21 44 o 0 431.4   106   ?      ?    2454.65 67.8285      878.541  67.8285     29.8492   67.8285      
1 1 1 5  23 44 f 1 360     138.6 ?      ?    2420.67 61.2584      606.137  61.2584     193.93    -118.742     
1 1 1 5  25 44 o 0 -29.3   195   ?      ?    1907.43 -142.348     68.7166  37.6522     672.166   37.6522      
1 1 1 0  44 6  o 0 99.7    64.9  ?      ?    611.61  -7.88668e-14 112.773  0           146.636   180          
1 1 1 2  44 6  o 0 431.9   50.8  ?      ?    2640.87 152.953      1045.96  152.953     76.7011   -27.0468     
1 1 1 4  44 6  o 0 279     48.3  ?      ?    2454.13 -15.734      606.258  -15.734     421.385   164.266      
1 1 1 6  44 6  o 0 -26.5   46.1  ?      ?    224.294 116.723      65.6085  -63.2773    157.794   -63.2773     
1 1 1 6  8  44 o 0 408.6   52.6  ?      ?    2017.69 -158.933     1071.43  -158.933    272.29    -158.933     
1 1 1 6  10 44 o 0 681.5   58.6  ?      ?    4330.16 70.6955      979.75   70.6954     720.138   -109.305     
1 1 1 6  12 44 o 0 2468.9  105   ?      ?    6601.66 -112.668     2655.7   -112.668    96.8824   -112.668     
1 1 1 6  14 44 o 0 1327.9  87.5  ?      ?    4474.82 38.9812      2006.34  38.9812     334.301   38.9812      
1 1 1 6  16 44 f 1 -103.5  76.2  ?      ?    1740.38 -13.142      455.19   166.858     1104.52   166.858      
1 1 1 6  18 44 o 0 772.9   90.2  ?      ?    3339.2  155.041      1409.06  155.041     206.183   155.041      
1 1 1 6  20 44 f 1 948.3   114   ?      ?    2732.02 23.4788      1823.98  23.4788     861.889   23.4788      
1 1 1 6  22 44 o 0 36.8    117.2 ?      ?    368.237 50.6558      5.55228  -129.344    128.367   -129.344     
1 1 1 6  24 44 f 1 1293.9  198   ?      ?    2896.29 125.229      2093.29  125.229     1156.34   125.229      
1 1 1 1  44 7  o 0 1996    87.3  ?      ?    4100.58 -5.32474     3346.37  -5.32474    1595.1    -5.32474     
1 1 1 3  44 7  o 0 59.4    48.6  ?      ?    265.353 163.68       27.5736  -16.3202    139.421   -16.3202     
1 1 1 5  44 7  o 0 142.8   47.5  ?      ?    3004.85 -149.152     151.336  30.8483     1396.9    30.8483      
1 1 1 7  44 7  o 0 432.1   51.2  ?      ?    2001.34 121.025      1168.81  121.025     355.893   121.025      
1 1 1 7  9  44 o 0 393.7   56.6  ?      ?    2412.41 18.37        925.408  18.37       23.0735   -161.63      
1 1 1 7  11 44 o 0 1500.1  80.7  ?      ?    4612.28 -119.067     2224.55  -119.067    430.874   -119.067     
1 1 1 7  13 44 o 0 414.7   67.3  ?      ?    2993.72 161.869      785.751  161.869     338.637   -18.1306     
1 1 1 7  15 44 o 0 1004.7  87.1  ?      ?    4910.8  -52.0251     1354.01  -52.0251    480.677   127.975      
1 1 1 7  17 44 o 0 608     90.5  ?      ?    2887.48 100.413      1232.44  100.413     177.687   100.413      
1 1 1 7  19 44 o 0 22.5    106.3 ?      ?    2063.24 15.343       241.473  -164.657    971.789   -164.657     
1 1 1 7  21 44 o 0 198.1   112.4 ?      ?    2929.79 -91.6115     67.124   -91.6115    938.971   88.3885      
1 1 1 7  23 44 o 0 567.1   179.2 ?      ?    1935.77 71.8295      1126.93  71.8295     495.055   71.8295      
1 1 1 0  44 8  o 0 768.1   79.6  ?      ?    4626.81 -7.88287e-15 1628.12  0           352.727   180          
1 1 1 2  44 8  o 0 1912.3  84.1  ?      ?    4439.75 -122.146     3076.08  -122.146    1196.33   -122.146     
1 1 1 4  44 8  o 0 1012.8  65    ?      ?    4469.22 45.7639      1648.27  45.7639     216.255   -134.236     
1 1 1 6  44 8  o 0 49.7    49.8  ?      ?    2413.72 143.133      465.716  -36.8666    1454.4    -36.8666     
1 1 1 8  44 8  o 0 999.9   68    ?      ?    3889.87 -1.31918     1770.38  -1.31918    211.682   -1.31918     
1 1 1 8  10 44 o 0 2062.6  96.8  ?      ?    5466.59 168.807      2632.8   168.807     503.544   168.807      
1 1 1 8  12 44 o 0 1184.5  83.8  ?      ?    4678.13 78.5782      1736.85  78.5782     26.0844   -101.422     
1 1 1 8  14 44 o 0 3487.2  149.1 ?      ?    6019.47 -100.47      3857.94  -100.47     1597.4    -100.47      
1 1 1 8  16 44 o 0 2030.5  113.5 ?      ?    5380.6  100.953      2552.91  100.953     573.666   100.953      
1 1 1 8  18 44 o 0 986.3   111.5 ?      ?    4653.19 -76.9249     1336.17  -76.9249    325.539   103.075      
1 1 1 8  20 44 o 0 349.3   115.7 ?      ?    1585.07 137.197      749.88   137.197     199.698   137.197      
1 1 1 8  22 44 o 0 -166.4  113.8 ?      ?    1032.17 -131.73      197.967  48.2696     539.165   48.2696      
1 1 1 8  24 44 o 0 337.9   205   ?      ?    2256.22 -97.1071     448.34   -97.1071    270.97    82.8929      
1 1 1 1  44 9  f 1 1420.4  78.3  ?      ?    5472.91 153.439      1951.45  153.439     384.183   -26.5606     
1 1 1 3  44 9  o 0 200.5   53.9  ?      ?    1508.4  -135.301     475.387  -135.301    156.629   44.6989      
1 1 1 5  44 9  o 0 463.9   58.4  ?      ?    1780.31 -42.5836     1312.58  -42.5836    578.738   -42.5836     
1 1 1 7  44 9  o 0 345.6   59.6  ?      ?    2185.58 7.75478      865.181  7.75478     17.8832   -172.245     
1 1 1 9  44 9  o 0 308.2   64.4  ?      ?    1676.6  79.2506      814.107  79.2506     152.555   79.2506      
1 1 1 9  11 44 o 0 1933.3  97.1  ?      ?    5144.99 24.9336      2593.07  24.9336     651.099   24.9336      
1 1 1 9  13 44 f 1 368.7   76    ?      ?    1424.4  145.147      932.609  145.147     400.017   145.147      
1 1 1 9  15 44 o 0 329.8   84.4  ?      ?    3084.86 169.456      499.025  169.456     641.612   -10.5436     
1 1 1 9  17 44 o 0 162.6   94.9  ?      ?    1927.98 -15.2366     122.814  -15.2366    570.511   164.763      
1 1 1 9  19 44 o 0 241     109.1 ?      ?    1316.99 168.403      420.212  168.403     40.9654   -11.5968     
1 1 1 9  21 44 o 0 267     128.3 ?      ?    1328.05 69.5793      470.419  69.5793     26.7083   69.5793      
1 1 1 9  23 44 o 0 -88.9   184.1 ?      ?    1074.87 -147.838     34.9073  32.1622     381.911   32.1622      
1 1 1 0  44 10 o 0 223.7   82.2  ?      ?    1620.07 180          608.95   180         78.5908   -4.26336e-13 
1 1 1 2  44 10 o 0 2528.3  105   ?      ?    6662.69 11.8714      2922.63  11.8714     124.971   11.8714      
1 1 1 4  44 10 o 0 2055    93.2  ?      ?    5791.42 179.508      2663.2   179.508     265.99    179.508      
1 1 1 6  44 10 o 0 1242    74.5  ?      ?    3054.42 -126.844     2495.82  -126.844    1254.06   -126.844     
1 1 1 8  44 10 o 0 930.5   72.8  ?      ?    2949.58 98.6432      1952.53  98.6432     779.098   98.6432      
1 1 1 10 44 10 o 0 471.7   73.4  ?      ?    3364.86 -77.1029     825.833  -77.1029    453.279   102.897      
1 1 1 10 12 44 o 0 189     71.9  ?      ?    1796.42 64.3645      294.452  64.3645     374.542   -115.636     
1 1 1 10 14 44 f 1 5       80.6  ?      ?    982.438 -7.44323     150.159  172.557     516.704   172.557      
1 1 1 10 16 44 o 0 -59.8   91.2  ?      ?    1086.41 -68.9655     210.246  111.035     602.948   111.035      
1 1 1 10 18 44 f 1 282.7   119   ?      ?    2284.3  -67.4137     451.075  -67.4137    358.956   112.586      
1 1 1 10 20 44 o 0 890.5   137.3 ?      ?    3701.7  95.9401      1422.76  95.9401     154.335   95.9401      
1 1 1 10 22 44 o 0 455.1   187.2 ?      ?    1698.2  172.926      876.197  172.926     322.129   172.926      
1 1 1 1  44 11 o 0 722.8   64.1  ?      ?    2209.03 -76.1826     1871.85  -76.1826    944.357   -76.1826     
1 1 1 3  44 11 o 0 192.5   62.1  ?      ?    1285.46 105.735      434.635  105.735     98.5156   -74.2654     
1 1 1 5  44 11 o 0 1844.9  93.9  ?      ?    4873.47 67.709       2709.2   67.709      719.876   67.709       
1 1 1 7  44 11 o 0 90.2    66.5  ?      ?    1017.64 -142.629     1.4447   -142.629    405.871   37.371       
1 1 1 9  44 11 o 0 360.5   67.3  ?      ?    2896.07 -2.2552      679.081  -2.2552     430.826   177.745      
1 1 1 11 44 11 o 0 227.7   77.3  ?      ?    3069.03 170.763      160.626  170.763     983.94    -9.2372      
1 1 1 11 13 44 o 0 125.6   87.3  ?      ?    2403.05 83.9336      70.6663  -96.0664    963.625   -96.0664     
1 1 1 11 15 44 o 0 175.2   92.3  ?      ?    2486.05 -103.902     90.7433  -103.902    815.474   76.0975      
1 1 1 11 17 44 o 0 274.6   99.1  ?      ?    3885.55 110.58       28.1579  110.58      1348.95   -69.4197     
1 1 1 11 19 44 o 0 1063.7  138.2 ?      ?    3633.39 -119.831     1727.04  -119.831    473.433   -119.831     
1 1 1 11 21 44 o 0 1425.3  158.7 ?      ?    6373.02 5.79011      1335.66  5.79011     761.765   -174.21      
1 1 1 11 23 44 f 1 1863.2  227   ?      ?    3583.57 174.17       2507.63  174.17      1361.86   174.17       
1 1 1 0  44 12 o 0 2297.7  146.5 ?      ?    4105.85 180          2760.6   180         1040.83   -180         
1 1 1 2  44 12 o 0 525.6   62.6  ?      ?    2800.96 -41.5327     1212.51  -41.5327    51.0521   -41.5327     
1 1 1 4  44 12 o 0 947.8   75.9  ?      ?    3660.58 56.3746      1791.14  56.3746     294.113   56.3746      
1 1 1 6  44 12 o 0 756.7   72.5  ?      ?    3377.77 -60.27       1493.68  -60.27      136.381   -60.27       
1 1 1 8  44 12 o 0 950.5   80.6  ?      ?    4041.09 164.818      1608.46  164.818     50.4049   164.818      
1 1 1 10 44 12 o 0 1319.1  91.8  ?      ?    4697.51 -23.3791     1928.99  -23.3791    162.837   -23.3791     
1 1 1 12 44 12 o 0 353.9   83    ?      ?    3236.47 -92.6573     528.367  -92.6573    669.453   87.3427      
1 1 1 12 14 44 o 0 2948.5  144.6 ?      ?    6678.91 96.1798      3027.6   96.1798     589.203   96.1798      
1 1 1 12 16 44 o 0 672.2   109.6 ?      ?    2626.64 -107.755     1379.54  -107.755    445.547   -107.755     
1 1 1 12 18 44 o 0 1231.8  136.6 ?      ?    4041.08 53.4725      1856.46  53.4725     455.16    53.4725      
1 1 1 12 20 44 o 0 1753.9  175.1 ?      ?    2450.51 -116.284     2872.06  -116.284    2060.08   -116.284     
1 1 1 12 22 44 o 0 17.5    214.8 ?      ?    2613.31 -9.21399     93.0186  170.786     931.025   170.786      
1 1 1 1  44 13 f 1 298     67.9  ?      ?    2841.41 88.9617      529.551  88.9617     652.345   -91.0383     
1 1 1 3  44 13 o 0 1936.2  96.8  ?      ?    5688.6  -75.8716     2516.96  -75.8716    191.39    -75.8716     
1 1 1 5  44 13 o 0 763.1   73.5  ?      ?    3477.36 31.5633      1473.84  31.5633     74.0697   31.5633      
1 1 1 7  44 13 o 0 207.2   70.6  ?      ?    1915.74 -137.004     362.635  -137.004    378.824   42.9962      
1 1 1 9  44 13 f 1 646.1   79.8  ?      ?    4671.62 142.715      775.136  142.715     1001.74   -37.2846     
1 1 1 11 44 13 o 0 586.6   85.9  ?      ?    1604.7  -165.811     1478.07  -165.811    879.344   -165.811     
1 1 1 13 44 13 f 1 2789.1  136.2 ?      ?    4539.81 -39.49       3571.49  -39.49      1920.12   -39.49       
1 1 1 13 15 44 o 0 912.7   107.5 ?      ?    2923.71 116.635      1744.91  116.635     703.737   116.635      
1 1 1 13 17 44 o 0 253     123.6 ?      ?    1972.43 -87.1795     417.613  -87.1795    268.552   92.8205      
1 1 1 13 19 44 o 0 357.7   135.9 ?      ?    2577.55 17.4054      588.898  17.4054     269.403   -162.595     
1 1 1 13 21 44 o 0 72.1    155.3 ?      ?    903.107 -160.912     62.7329  -160.912    228.804   19.0883      
1 1 1 0  44 14 o 0 171.6   98    ?      ?    1317.35 -7.61942e-15 346.428  0           195.784   180          
1 1 1 2  44 14 o 0 39.4    69.2  ?      ?    1007.22 88.7348      137.139  -91.2652    539.667   -91.2652     
1 1 1 4  44 14 o 0 1247.7  87    ?      ?    4400.34 -130.846     2017.37  -130.846    282.037   -130.846     
1 1 1 6  44 14 o 0 1250.1  88.6  ?      ?    3973.12 25.4669      2137.13  25.4669     596.857   25.4669      
1 1 1 8  44 14 o 0 478.1   77.5  ?      ?    1920.76 -105.888     1232.68  -105.888    493.662   -105.888     
1 1 1 10 44 14 f 1 661.7   86.5  ?      ?    4256.01 50.529       937.483  50.529      668.929   -129.471     
1 1 1 12 44 14 o 0 595.9   95.7  ?      ?    2391.73 165.876      1330.83  165.876     458.661   165.876      
1 1 1 14 44 14 o 0 309.1   104.4 ?      ?    1576.19 -18.0641     632.15   -18.0641    78.8468   -18.0641     
1 1 1 14 16 44 o 0 495.5   123.9 ?      ?    2473.43 -96.0615     1014.54  -96.0615    152.889   -96.0615     
1 1 1 14 18 44 o 0 16.6    133.4 ?      ?    294.339 122.084      1.99792  -57.916     100.314   -57.916      
1 1 1 14 20 44 o 0 966.3   167.5 ?      ?    3030.57 -117.294     1646.83  -117.294    663.806   -117.294     
1 1 1 1  44 15 o 0 156.1   73    ?      ?    1896.87 177.685      151.194  177.685     603.076   -2.31536     
1 1 1 3  44 15 o 0 734.2   81.1  ?      ?    2861.27 7.74297      1615.21  7.74297     489.954   7.74297      
1 1 1 5  44 15 o 0 359.5   82.2  ?      ?    3215.83 178.531      580.685  178.531     665.275   -1.46898     
1 1 1 7  44 15 o 0 506.9   87.4  ?      ?    3323.23 71.1668      931.833  71.1668     348.792   -108.833     
1 1 1 9  44 15 o 0 -27.5   85.4  ?      ?    1473.31 -71.1376     278.192  108.862     833.226   108.862      
1 1 1 11 44 15 o 0 1375.5  101.2 ?      ?    5837.34 -102.718     1563.07  -102.718    578.218   77.2821      
1 1 1 13 44 15 o 0 368.9   91.4  ?      ?    2499.7  80.7423      722.906  80.7423     161.791   -99.2577     
1 1 1 15 44 15 o 0 1815.6  136.8 ?      ?    5761.79 -71.8476     2018.29  -71.8476    49.2874   -71.8476     
1 1 1 15 17 44 o 0 1907.3  166.5 ?      ?    4954.4  132.331      2383.74  132.331     726.78    132.331      
1 1 1 15 19 44 o 0 -123.6  151.2 ?      ?    464.784 -32.1562     44.0383  147.844     195.245   147.844      
1 1 1 0  44 16 f 1 48.9    114.2 ?      ?    2820.68 -180         264.082  180         870.521   7.43176e-15  
1 1 1 2  44 16 f 1 1592.2  101.3 ?      ?    4130.31 -96.1877     2628.87  -96.1877    981.872   -96.1877     
1 1 1 4  44 16 o 0 -149.1  81.3  ?      ?    1370.63 117.22       386.695  -62.7804    923.333   -62.7804     
1 1 1 6  44 16 f 1 346.4   91.2  ?      ?    2520.47 -25.3662     722.908  -25.3662    253.191   154.634      
1 1 1 8  44 16 o 0 190.7   86.8  ?      ?    2259.29 24.3014      207.416  24.3014     644.994   -155.699     
1 1 1 10 44 16 o 0 217.1   91.5  ?      ?    1588.25 67.3148      370.519  67.3148     211.295   -112.685     
1 1 1 12 44 16 o 0 255.1   102.5 ?      ?    1761.75 -148.005     459.767  -148.005    167.471   31.9953      
1 1 1 14 44 16 o 0 407.9   121.4 ?      ?    3434.06 159.55       545.686  159.55      637.586   -20.4505     
1 1 1 16 44 16 o 0 447.7   159.4 ?      ?    3341.62 -125.496     596.617  -125.496    494.646   54.5042      
1 1 1 16 18 44 o 0 316.3   160.7 ?      ?    1557.46 78.7922      567.915  78.7923     60.6766   78.7923      
1 1 1 1  44 17 o 0 1088.6  95.9  ?      ?    4306.49 143.062      1783.3   143.062     88.5805   143.062      
1 1 1 3  44 17 o 0 1330    103.2 ?      ?    4357.53 163.447      2126.93  163.447     429.749   163.447      
1 1 1 5  44 17 o 0 167.1   94.5  ?      ?    936.762 -51.592      209.803  -51.592     149.866   128.408      
1 1 1 7  44 17 o 0 433.8   92.9  ?      ?    3262.21 -82.1046     743.036  -82.1046    486.841   97.8954      
1 1 1 9  44 17 o 0 398.7   97.3  ?      ?    1992.52 -87.2523     921.836  -87.2523    190.856   -87.2523     
1 1 1 11 44 17 o 0 1677    119.9 ?      ?    3856.63 57.0808      2568.51  57.0808     1190.32   57.0808      
1 1 1 13 44 17 o 0 769.5   123.6 ?      ?    3172.64 -93.0569     1384.03  -93.0569    284.251   -93.0569     
1 1 1 15 44 17 o 0 4675.3  214.6 ?      ?    7027.58 109.567      4043.54  109.567     1729.26   109.567      
1 1 1 17 44 17 o 0 772.5   167.1 ?      ?    2935.27 -47.6647     1326.25  -47.6647    396.872   -47.6647     
1 1 1 17 19 44 o 0 515.2   189.2 ?      ?    1892.7  -8.45042     900.534  -8.45042    301.654   -8.45042     
1 1 1 0  44 18 f 1 1256.1  145.9 ?      ?    7146.73 -1.07265e-15 1923.16  0           876.699   180          
1 1 1 2  44 18 o 0 4932.9  190.3 ?      ?    7417.18 116.136      4654.55  116.136     1787.78   116.136      
1 1 1 4  44 18 o 0 896.4   101.7 ?      ?    4133.52 -100.223     1455.72  -100.223    122.904   79.7772      
1 1 1 6  44 18 o 0 344.7   104.1 ?      ?    611.769 63.8018      543.976  63.8018     315.201   63.8018      
1 1 1 8  44 18 o 0 164     108.6 ?      ?    933.516 134.228      173.545  134.228     168.652   -45.7716     
1 1 1 10 44 18 f 1 1588.3  123.1 ?      ?    4252.05 -41.0847     2326.47  -41.0847    796.168   -41.0847     
1 1 1 12 44 18 o 0 -4.4    119.3 ?      ?    2244.63 -140.03      269.099  39.9701     1050.11   39.9701      
1 1 1 14 44 18 o 0 193.1   140.3 ?      ?    353.532 -144.064     113.039  -144.064    4.09655   35.9355      
1 1 1 16 44 18 o 0 347.3   161.8 ?      ?    2383.41 27.3178      544.953  27.3178     216.154   -152.682     
1 1 1 18 44 18 o 0 2541.8  216.1 ?      ?    5873.04 -75.2061     2453.83  -75.206     654.633   -75.206      
1 1 1 1  44 19 o 0 1005.6  109.2 ?      ?    4672.56 -25.7845     1454.83  -25.7845    323.798   154.215      
1 1 1 3  44 19 o 0 1420.3  119.8 ?      ?    4602.65 90.8887      2098.17  90.8887     362.789   90.8887      
1 1 1 5  44 19 o 0 984.2   118.4 ?      ?    2609.53 -116.247     2023.83  -116.247    1053.25   -116.247     
1 1 1 7  44 19 o 0 238.7   115   ?      ?    3115.02 49.9881      121.426  49.9881     1016.89   -130.012     
1 1 1 9  44 19 o 0 334.8   122.1 ?      ?    2968.34 -117.132     459.419  -117.132    601.999   62.8684      
1 1 1 11 44 19 o 0 285.8   124.9 ?      ?    1209.73 -9.30618     542.988  -9.30618    121.446   -9.30618     
1 1 1 13 44 19 o 0 1148.3  150.8 ?      ?    2679.92 92.4586      2070.19  92.4586     1178.87   92.4586      
1 1 1 15 44 19 o 0 486.1   170.3 ?      ?    2669.06 26.6754      809.18   26.6754     48.4622   -153.325     
1 1 1 17 44 19 o 0 2034.1  201.5 ?      ?    6103.36 -154.812     1937.19  -154.812    51.0861   -154.812     
1 1 1 0  44 20 o 0 345.4   157.8 ?      ?    3745.12 180          814.577  180         592.892   -9.76799e-15 
1 1 1 2  44 20 o 0 531.8   120.7 ?      ?    3019.4  -53.4079     1015.41  -53.4079    111.404   126.592      
1 1 1 4  44 20 o 0 1103.2  126.5 ?      ?    5118.59 54.7891      1407.82  54.7891     481.127   -125.211     
1 1 1 6  44 20 f 1 653.4   121.2 ?      ?    3974.45 -134.902     963.328  -134.902    489.287   45.0979      
1 1 1 8  44 20 o 0 627.7   128.2 ?      ?    1509.53 -51.916      1471.51  -51.916     933.429   -51.916      
1 1 1 10 44 20 o 0 333.9   129   ?      ?    1896.83 155.319      676.219  155.319     15.795    155.319      
1 1 1 12 44 20 o 0 -41.4   142   ?      ?    1162.78 -87.0595     82.8494  92.9405     470.173   92.9405      
1 1 1 14 44 20 o 0 471.3   176.9 ?      ?    2726.92 -31.8719     751.931  -31.8719    127.738   148.128      
1 1 1 1  44 21 o 0 843.9   133.5 ?      ?    3141.89 59.3889      1607.65  59.3889     450.098   59.3889      
1 1 1 3  44 21 o 0 831.6   130.8 ?      ?    3518.84 -20.4861     1461.87  -20.4861    176.634   -20.4861     
1 1 1 5  44 21 o 0 445.4   141.1 ?      ?    3040.37 -146.808     735.703  -146.808    360.586   33.1916      
1 1 1 7  44 21 o 0 560     143   ?      ?    2421.8  171.373      1189.15  171.373     330.625   171.373      
1 1 1 9  44 21 o 0 511     152.4 ?      ?    1952.63 -106.509     1124.15  -106.509    457.544   -106.509     
1 1 1 11 44 21 o 0 242.4   157.5 ?      ?    3153.92 141.189      128.28   141.189     921.459   -38.8109     
1 1 1 13 44 21 o 0 652.6   180.1 ?      ?    1943.41 -26.9368     1304.97  -26.9368    677.043   -26.9368     
1 1 1 0  44 22 o 0 256.5   194.8 ?      ?    587.798 -180         186.498  180         26.726    4.269e-13    
1 1 1 2  44 22 o 0 1171.2  151.8 ?      ?    4347.68 -5.24387     1738.03  -5.24387    170.409   -5.24387     
1 1 1 4  44 22 o 0 562.6   157.5 ?      ?    3209.35 -139.151     980.496  -139.151    164.775   40.8495      
1 1 1 6  44 22 o 0 1361.1  175.7 ?      ?    4342.69 110.286      1966.89  110.286     464.613   110.286      
1 1 1 8  44 22 o 0 62.8    163.2 ?      ?    1931.48 47.7965      8.65605  47.7965     647.092   -132.204     
1 1 1 10 44 22 o 0 239.5   183.6 ?      ?    1022.66 -155.929     359.055  -155.929    19.7439   -155.929     
1 1 1 12 44 22 o 0 -164.3  187   ?      ?    1773.32 15.7963      173.502  -164.204    746.047   -164.204     
1 1 1 1  44 23 o 0 244.6   159.4 ?      ?    2393.49 -22.4869     328.497  -22.4869    507.268   157.513      
1 1 1 3  44 23 o 0 2668.6  187.7 ?      ?    6426.09 -155.67      2777.98  -155.67     551.386   -155.67      
1 1 1 5  44 23 f 1 2455.3  208   ?      ?    6219.23 12.4906      2574.92  12.4906     433.752   12.4906      
1 1 1 7  44 23 o 0 77.2    177.2 ?      ?    1249.02 -93.5972     116.475  -93.5972    304.215   86.4028      
1 1 1 9  44 23 o 0 30.6    198   ?      ?    2067.18 64.8808      8.10626  64.8808     673.992   -115.119     
1 1 1 11 44 23 f 1 -340.3  215.9 ?      ?    2312.92 -40.1017     320.517  139.898     1069.18   139.898      
1 1 1 0  44 24 o 0 -347.8  255.4 ?      ?    723.043 -180         52.9183  180         194.978   7.5248e-15   
1 1 1 2  44 24 o 0 393.8   178.1 ?      ?    1424.19 -81.3888     774.044  -81.3888    288.201   -81.3888     
1 1 1 4  44 24 o 0 772.5   189.2 ?      ?    3463.92 133.366      1245.38  133.366     74.8053   133.366      
1 1 1 6  44 24 f 1 3159.3  238.5 ?      ?    6849.75 -73.7977     2923.37  -73.7977    627.334   -73.7977     
1 1 1 8  44 24 < 0 -893.7  220.7 ?      ?    ?       ?            566.97   15.5862     ?         ?            
1 1 1 1  44 25 o 0 -18.4   195.2 ?      ?    2638.89 177.831      182.988  -2.16923    1066.88   -2.16923     
1 1 1 3  44 25 o 0 89.5    211.2 ?      ?    2406.67 -4.36777     19.2794  -4.36777    781.428   175.632      
1 1 1 5  44 25 o 0 1108.4  224.7 ?      ?    3767.43 157.188      1572.06  157.188     332.52    157.188      
1 1 1 0  1  45 o 0 -35.9   79.5  ?      ?    1677.87 -90          74.7469  -90         558.013   90           
1 1 1 0  3  45 o 0 1671.7  111.5 ?      ?    3065.63 -90          2133.53  -90         970.854   -90          
1 1 1 0  5  45 o 0 114.9   77.4  ?      ?    296.467 90           52.9507  90          59.6817   -90          
1 1 1 0  7  45 o 0 1460.9  108.2 ?      ?    3818.77 90           1992.13  90          544.551   90           
1 1 1 0  9  45 o 0 -115.7  80.5  ?      ?    1082.8  -90          31.2305  -90         376.68    90           
1 1 1 0  11 45 o 0 907.1   113.1 ?      ?    2445.32 -90          1526.24  -90         632.493   -90          
1 1 1 0  13 45 o 0 -152    93    ?      ?    391.988 90           11.0493  90          132.095   -90          
1 1 1 0  15 45 o 0 755.1   123.1 ?      ?    2661.92 -90          1355.56  -90         401.074   -90          
1 1 1 0  17 45 o 0 2249.8  178.9 ?      ?    4994.22 90           2320.72  90          578.276   90           
1 1 1 0  19 45 o 0 734.1   143.9 ?      ?    3857.41 90           1268.22  90          42.6466   -90          
1 1 1 0  21 45 o 0 4075.6  279.8 ?      ?    7660.05 -90          2955.97  -90         472.036   -90          
1 1 1 0  23 45 o 0 1673.9  258.2 ?      ?    3494.76 90           1792.42  90          697.46    90           
1 1 1 0  45 1  o 0 86.4    73.2  ?      ?    1679.91 90           217.758  90          468.907   -90          
1 1 1 1  2  45 o 0 1521.5  78.1  ?      ?    4226.29 -137.039     2335.76  -137.039    731.962   -137.039     
1 1 1 1  4  45 o 0 681.9   59.3  ?      ?    3972.58 159.39       1074.71  159.39      438.183   -20.6095     
1 1 1 1  6  45 o 0 1379.6  75.6  ?      ?    3710.39 -28.1458     2323.82  -28.1458    911.294   -28.1458     
1 1 1 1  8  45 o 0 -89.6   56.2  ?      ?    799.193 94.6954      232.749  -85.3046    535.69    -85.3046     
1 1 1 1  10 45 o 0 117.2   60.4  ?      ?    527.611 141.645      61.6086  141.645     136.741   -38.355      
1 1 1 1  12 45 o 0 477.7   70.5  ?      ?    2349.92 -62.2825     1085.39  -62.2825    230.024   -62.2825     
1 1 1 1  14 45 o 0 381.8   68.4  ?      ?    2706.55 -153.433     752.053  -153.433    230.293   26.5672      
1 1 1 1  16 45 o 0 739.4   83.6  ?      ?    2537.5  103.248      1551.84  103.248     649.302   103.248      
1 1 1 1  18 45 o 0 756.5   97.7  ?      ?    3571.11 8.83889      1250.32  8.83889     16.8268   8.83889      
1 1 1 1  20 45 o 0 823.9   108.9 ?      ?    3478.79 175.002      1363.9   175.002     195.766   175.002      
1 1 1 1  22 45 o 0 543.1   148.8 ?      ?    3002.4  122.428      910.15   122.428     50.0294   -57.5719     
1 1 1 1  45 2  o 0 828.7   65.4  ?      ?    3661.06 -113.205     1564.93  -113.205    71.2886   -113.205     
1 1 1 2  3  45 o 0 543.6   55.8  ?      ?    2903.19 113.227      1128.45  113.227     22.1484   113.227      
1 1 1 2  5  45 o 0 1181.4  69.6  ?      ?    5060.54 -31.1563     1566.54  -31.1563    364.669   148.844      
1 1 1 2  7  45 o 0 1530.4  79.5  ?      ?    4991.75 -171.082     2084.81  -171.082    184.489   -171.082     
1 1 1 2  9  45 o 0 1418    76.2  ?      ?    5214.34 74.2217      1839.74  74.2217     132.722   -105.778     
1 1 1 2  11 45 o 0 1454.4  84.3  ?      ?    4500.07 -83.4285     2137.59  -83.4285    486.192   -83.4285     
1 1 1 2  13 45 o 0 1887    99.3  ?      ?    4446.44 145.95       2701.68  145.95      1071.44   145.95       
1 1 1 2  15 45 o 0 703.5   81.9  ?      ?    2315.29 45.2364      1556.37  45.2364     722.827   45.2364      
1 1 1 2  17 45 o 0 1050.4  95.1  ?      ?    3593.76 -115.749     1752.3   -115.749    493.3     -115.749     
1 1 1 2  19 45 o 0 2142.7  131.4 ?      ?    3600.31 5.1341       3050.48  5.1341      1821.79   5.1341       
1 1 1 2  21 45 o 0 1175    135.9 ?      ?    2960.07 55.8885      2004.33  55.8885     1040.22   55.8885      
1 1 1 2  23 45 o 0 316.1   165.8 ?      ?    3579.95 -91.2157     155.41   -91.2157    971.441   88.7843      
1 1 1 0  45 3  o 0 169.8   76.2  ?      ?    254.651 -90          84.0135  -90         20.7241   90           
1 1 1 2  45 3  o 0 239.1   58.4  ?      ?    2095.39 90.1919      527.798  90.1919     323.92    -89.8081     
1 1 1 3  4  45 f 1 849.5   64.2  ?      ?    4523.21 -34.0502     1197.44  -34.0502    539.576   145.95       
1 1 1 3  6  45 o 0 1901.8  87.9  ?      ?    4127.35 149.214      2867.44  149.214     1292.32   149.214      
1 1 1 3  8  45 o 0 936.6   65.5  ?      ?    3302.33 84.0174      1766.31  84.0174     511.7     84.0174      
1 1 1 3  10 45 o 0 240.1   59.6  ?      ?    2498.17 -144.748     396.561  -144.748    544.582   35.2519      
1 1 1 3  12 45 o 0 -149.7  68.6  ?      ?    935.243 89.6719      266.521  -90.3281    607.634   -90.3281     
1 1 1 3  14 45 o 0 319.4   78.2  ?      ?    3715.8  2.27692      277.132  2.27692     1074.2    -177.723     
1 1 1 3  16 45 o 0 486.1   88    ?      ?    4270.29 -155.578     514.327  -155.578    1007.57   24.4224      
1 1 1 3  18 45 o 0 -54.3   93.2  ?      ?    2222.29 49.3688      434.442  -130.631    1203.62   -130.631     
1 1 1 3  20 45 o 0 320.4   110.2 ?      ?    1780.38 -33.7631     648.737  -33.7631    49.6065   -33.7631     
1 1 1 3  22 45 o 0 82      150.8 ?      ?    1172.21 -163.388     74.4832  -163.388    301.263   16.612       
1 1 1 1  45 4  o 0 715     60.1  ?      ?    3558.14 48.0083      1377.47  48.0083     80.4096   -131.992     
1 1 1 3  45 4  f 1 544     58.2  ?      ?    347.057 -139.566     750.68   -139.566    609.593   -139.566     
1 1 1 4  5  45 o 0 417.4   57.4  ?      ?    1846.26 163.66       1085.68  163.66      380.603   163.66       
1 1 1 4  7  45 o 0 1522    79.3  ?      ?    6338.04 29.6645      1586.83  29.6645     827.122   -150.335     
1 1 1 4  9  45 o 0 323.7   61.2  ?      ?    3342.63 -133.186     416.879  -133.186    847.892   46.8144      
1 1 1 4  11 45 o 0 -48.8   67.9  ?      ?    1419.86 111.053      339.104  -68.9473    860.211   -68.9473     
1 1 1 4  13 45 o 0 254.1   74.2  ?      ?    2150.07 -63.2497     499.022  -63.2497    289.295   116.75       
1 1 1 4  15 45 f 1 325     79    ?      ?    1287.73 173.113      762.698  173.113     296.488   173.113      
1 1 1 4  17 45 f 1 2028.8  116.3 ?      ?    4848.44 47.2133      2604.89  47.2133     896.792   47.2133      
1 1 1 4  19 45 o 0 1052.5  115.3 ?      ?    3242.48 -156.019     1811.62  -156.019    705.036   -156.019     
1 1 1 4  21 45 o 0 358.8   126.6 ?      ?    2247.65 10.5396      647.747  10.5396     84.3927   -169.46      
1 1 1 4  23 45 < 1 -732.7  164.9 ?      ?    ?       ?            536.625  76.7998     ?         ?            
1 1 1 0  45 5  o 0 1309.5  108.1 ?      ?    2877.93 -90          2048.86  -90         862.766   -90          
1 1 1 2  45 5  o 0 852.2   65.9  ?      ?    3789.57 59.6402      1562.72  59.6402     18.7286   59.6402      
1 1 1 4  45 5  o 0 51.5    55.6  ?      ?    2539.74 -144.641     463.728  35.3589     1482.92   35.3589      
1 1 1 5  6  45 o 0 93.5    57.9  ?      ?    465.07  177.258      13.9142  177.258     163.344   -2.74242     
1 1 1 5  8  45 o 0 164.9   57.7  ?      ?    3371.9  -49.9112     164.364  130.089     1443.45   130.089      
1 1 1 5  10 45 o 0 476.8   67.3  ?      ?    1295.31 81.5353      1199.4   81.5353     721.915   81.5353      
1 1 1 5  12 45 o 0 288.2   72.4  ?      ?    2904.78 156.807      436.582  156.807     635.121   -23.1931     
1 1 1 5  14 45 o 0 449.8   80.6  ?      ?    3083.78 -55.2386     812.651  -55.2386    306.607   124.761      
1 1 1 5  16 45 o 0 -77.8   81.6  ?      ?    1021.88 -73.6579     227.876  106.342     589.483   106.342      
1 1 1 5  18 45 o 0 1064.7  108.1 ?      ?    5248.79 41.507       1233.33  41.507      579.622   -138.493     
1 1 1 5  20 45 o 0 1140.6  130.3 ?      ?    5155.07 -131.152     1358.71  -131.152    344.135   48.8476      
1 1 1 5  22 45 o 0 21.6    127.5 ?      ?    1351.45 20.2097      63.2681  -159.79     495.608   -159.79      
1 1 1 1  45 6  o 0 26.3    56.4  ?      ?    750.534 86.0573      133.562  -93.9427    441.111   -93.9427     
1 1 1 3  45 6  o 0 441.2   57.2  ?      ?    3733.07 71.8154      652.871  71.8154     856.85    -108.185     
1 1 1 5  45 6  o 0 188.7   57.3  ?      ?    1841.9  123.623      363.531  123.623     368.922   -56.377      
1 1 1 6  7  45 f 1 -6.4    56.9  ?      ?    906.287 -69.4617     199.378  110.538     545.372   110.538      
1 1 1 6  9  45 o 0 261.7   64.8  ?      ?    2047.67 28.9123      551.239  28.9123     205.519   -151.088     
1 1 1 6  11 45 o 0 156.3   68.1  ?      ?    2679.38 -32.9922     11.0758  147.008     990.795   147.008      
1 1 1 6  13 45 o 0 1333.5  96    ?      ?    3589.39 157.273      2251.66  157.273     940.713   157.273      
1 1 1 6  15 45 o 0 76      87.3  ?      ?    1367.07 134.589      54.8852  -45.4107    545.073   -45.4107     
1 1 1 6  17 45 o 0 787.6   97.7  ?      ?    3558.32 -85.023      1322.87  -85.023     81.4105   -85.023      
1 1 1 6  19 45 f 1 25      104.8 ?      ?    1384.21 -86.0435     109.608  93.9565     582.721   93.9565      
1 1 1 6  21 45 o 0 254.3   139.6 ?      ?    1822.47 68.2232      403.395  68.2232     187.799   -111.777     
1 1 1 0  45 7  o 0 812.7   95.5  ?      ?    3453.53 -90          1604.2   -90         184.021   -90          
1 1 1 2  45 7  o 0 267.8   56.8  ?      ?    1341.71 42.1117      716.248  42.1117     170.585   42.1117      
1 1 1 4  45 7  o 0 596.8   66.7  ?      ?    3344.85 -9.28812     1159.34  -9.28813    180.974   170.712      
1 1 1 6  45 7  f 1 -43.7   56.9  ?      ?    1341.05 -19.5909     365.773  160.409     896.258   160.409      
1 1 1 7  8  45 o 0 1353.2  79.1  ?      ?    5056.23 -151.319     1825.7   -151.319    44.4248   28.681       
1 1 1 7  10 45 o 0 338.9   70.8  ?      ?    2016.64 76.3176      792.333  76.3176     53.0316   76.3176      
1 1 1 7  12 45 o 0 51.6    75.1  ?      ?    1073.55 43.4591      98.9464  -136.541    492.77    -136.541     
1 1 1 7  14 45 o 0 924.3   88.5  ?      ?    3619.61 78.6621      1592.2   78.6621     286.18    78.6621      
1 1 1 7  16 45 o 0 104.5   104.3 ?      ?    132.583 -50.0766     10.0855  -50.0766    36.5485   129.923      
1 1 1 7  18 45 o 0 492.2   115   ?      ?    3245.34 149.127      805.05   149.127     309.038   -30.873      
1 1 1 7  20 45 o 0 507.9   146.7 ?      ?    1130.46 -67.5413     1041.1   -67.5413    669.99    -67.5413     
1 1 1 7  22 45 o 0 1187    168.6 ?      ?    3804.92 -92.8355     1710.5   -92.8355    500.872   -92.8355     
1 1 1 1  45 8  o 0 507.4   64.7  ?      ?    2321.71 -71.1112     1288.98  -71.1112    341.52    -71.1112     
1 1 1 3  45 8  o 0 4.1     61.8  ?      ?    1107.41 -99.293      227.617  80.707      673.812   80.707       
1 1 1 5  45 8  o 0 841.2   68.9  ?      ?    2546.03 -85.3465     1905.63  -85.3465    896.574   -85.3465     
1 1 1 7  45 8  o 0 546.2   66.2  ?      ?    2641.09 -133.331     1226.29  -133.331    220.873   -133.331     
1 1 1 8  9  45 o 0 842.1   80.3  ?      ?    3240.38 62.9063      1596.95  62.9063     408.051   62.9063      
1 1 1 8  11 45 f 1 613     81.8  ?      ?    2804.71 -30.6207     1276.01  -30.6207    238.622   -30.6207     
1 1 1 8  13 45 o 0 114.2   86.4  ?      ?    1438.22 -25.144      42.0618  -25.144     479.162   154.856      
1 1 1 8  15 45 o 0 288.3   103.6 ?      ?    2039    141.393      524.326  141.393     197.342   -38.6072     
1 1 1 8  17 45 o 0 1181.7  125.7 ?      ?    4413.19 16.8605      1665.78  16.8605     138.494   16.8605      
1 1 1 8  19 45 o 0 246.1   135.4 ?      ?    1523.32 34.4731      416.416  34.4731     88.6569   -145.527     
1 1 1 8  21 45 o 0 2611.4  202.8 ?      ?    6308.9  169.89       2551.07  169.89      521.507   169.89       
1 1 1 0  45 9  o 0 171     91.8  ?      ?    1703.11 -90          421.566  -90         274.266   90           
1 1 1 2  45 9  o 0 152.6   63    ?      ?    2147.23 -118.621     116.218  -118.621    751.804   61.3794      
1 1 1 4  45 9  o 0 338.2   68.5  ?      ?    2691.4  89.7966      687.383  89.7966     385.045   -90.2034     
1 1 1 6  45 9  o 0 229.5   68.8  ?      ?    2147.48 142.309      433.856  142.309     389.755   -37.6912     
1 1 1 8  45 9  o 0 814.9   77    ?      ?    4448.89 2.07688      1187.83  2.07688     481.365   -177.923     
1 1 1 9  10 45 o 0 74.9    76    ?      ?    1535.9  14.2006      99.8452  -165.799    665.209   -165.799     
1 1 1 9  12 45 f 1 530     87.2  ?      ?    4905.28 -57.8303     409.183  -57.8303    1383.23   122.17       
1 1 1 9  14 45 o 0 215.3   98.5  ?      ?    1782.33 174.137      322.015  174.137     311.584   -5.86273     
1 1 1 9  16 45 o 0 200.8   110.3 ?      ?    2396.78 -19.9447     176.423  -19.9447    658.201   160.055      
1 1 1 9  18 45 o 0 478.6   124.8 ?      ?    4281.18 -158.225     464.502  -158.225    990.25    21.7745      
1 1 1 9  20 45 o 0 570.4   155.3 ?      ?    2680.66 7.44412      1051.05  7.44412     180.124   7.44412      
1 1 1 1  45 10 o 0 1127.9  80.7  ?      ?    3706.83 105.267      2068.58  105.267     568.492   105.267      
1 1 1 3  45 10 o 0 90.6    72.3  ?      ?    3208.8  -43.403      458.426  136.597     1741.11   136.597      
1 1 1 5  45 10 o 0 11.3    75.9  ?      ?    973.637 -155.919     156.742  24.0812     532.134   24.0812      
1 1 1 7  45 10 o 0 572.8   80.1  ?      ?    2253.8  -64.3842     1371.19  -64.3842    519.323   -64.3842     
1 1 1 9  45 10 o 0 61.3    81.3  ?      ?    3435.46 3.0033       580.085  -176.997    1865.19   -176.997     
1 1 1 10 11 45 f 1 1572.1  110   ?      ?    5326.04 -160.332     1974.4   -160.332    26.656    -160.332     
1 1 1 10 13 45 o 0 789     102.1 ?      ?    3958.44 -24.2407     1227.35  -24.2407    183.458   155.759      
1 1 1 10 15 45 o 0 270.3   111.5 ?      ?    1731.51 -91.1772     494.945  -91.1772    110.644   88.8228      
1 1 1 10 17 45 f 1 283.9   128.4 ?      ?    798.75  93.9755      428.863  93.9755     154.231   93.9755      
1 1 1 10 19 45 o 0 1185.3  158.7 ?      ?    4431.68 167.919      1601.5   167.919     150.181   167.919      
1 1 1 10 21 45 o 0 670.8   168.6 ?      ?    3828.94 -64.2962     880.45   -64.2962    335.952   115.704      
1 1 1 0  45 11 o 0 1255.6  124.3 ?      ?    5564.34 90           1961.69  90          242.662   -90          
1 1 1 2  45 11 o 0 433.5   72.5  ?      ?    3018.84 -41.8288     860.493  -41.8288    323.449   138.171      
1 1 1 4  45 11 o 0 19.6    74.9  ?      ?    1594.19 -129.968     263.77   50.0319     880.324   50.0319      
1 1 1 6  45 11 o 0 1294.9  90.7  ?      ?    2610.38 -165.119     2590.2   -165.119    1598.42   -165.119     
1 1 1 8  45 11 f 1 665.4   85.5  ?      ?    2543.22 -12.5666     1489.78  -12.5666    526.041   -12.5666     
1 1 1 10 45 11 f 1 76.8    86.3  ?      ?    1150.09 17.268       34.4138  -162.732    459.252   -162.732     
1 1 1 11 12 45 o 0 1013.1  106.7 ?      ?    4636.33 175.258      1388.11  175.258     273.993   -4.74231     
1 1 1 11 14 45 o 0 91.4    107.2 ?      ?    1843.46 8.39806      51.4529  -171.602    697.825   -171.602     
1 1 1 11 16 45 o 0 583.5   127.4 ?      ?    2199.17 -137.585     1250.74  -137.585    495.624   -137.585     
1 1 1 11 18 45 o 0 435.6   152.3 ?      ?    3742.59 -7.53588     462.653  -7.53588    770.461   172.464      
1 1 1 11 20 45 o 0 1223.4  177.4 ?      ?    4684.13 84.9536      1523.85  84.9536     24.0169   84.9536      
1 1 1 1  45 12 o 0 2646.7  118.5 ?      ?    4468.03 -29.1134     3758.76  -29.1134    2008.85   -29.1134     
1 1 1 3  45 12 o 0 1088.2  88.4  ?      ?    3061.37 161.643      2175.4   161.643     990.412   161.643      
1 1 1 5  45 12 o 0 429.7   77    ?      ?    3242.73 -29.273      769.261  -29.273     483.094   150.727      
1 1 1 7  45 12 o 0 1146.7  93    ?      ?    4776.17 152.02       1649.45  152.02      159.552   -27.9805     
1 1 1 9  45 12 f 1 1211.1  107.3 ?      ?    3199.41 -87.1172     2210.19  -87.1172    1019.71   -87.1172     
1 1 1 11 45 12 o 0 1919.1  116.3 ?      ?    5275.84 33.5956      2401.68  33.5956     502.286   33.5956      
1 1 1 12 13 45 o 0 1030    122.4 ?      ?    4534.92 161.912      1414.45  161.912     176.772   -18.0882     
1 1 1 12 15 45 o 0 1115.1  138.8 ?      ?    3347.86 69.4861      1875.87  69.4861     723.496   69.4861      
1 1 1 12 17 45 f 1 256.7   132.5 ?      ?    2431.3  -134.352     338.053  -134.352    470.937   45.6485      
1 1 1 12 19 45 o 0 1060.6  167.7 ?      ?    4477.94 -31.6231     1378.37  -31.6231    64.0298   148.377      
1 1 1 0  45 13 o 0 -15.4   105   ?      ?    183.486 90           12.9726  90          59.5854   -90          
1 1 1 2  45 13 o 0 695.9   83.2  ?      ?    2293.67 -107.154     1685.22  -107.154    786.752   -107.154     
1 1 1 4  45 13 o 0 976.5   91.4  ?      ?    2838.69 112.716      2046.33  112.716     949.186   112.716      
1 1 1 6  45 13 o 0 -91     86.9  ?      ?    1486.36 -91.0751     348.896  88.9249     913.51    88.9249      
1 1 1 8  45 13 o 0 115.5   89.2  ?      ?    2309.73 120.985      84.7414  -59.0152    943.708   -59.0152     
1 1 1 10 45 13 o 0 261.8   99.2  ?      ?    2837.78 -97.8135     291.296  -97.8135    732.603   82.1865      
1 1 1 12 45 13 o 0 645.1   112.2 ?      ?    3538.8  67.3322      1051.53  67.3322     188.491   -112.668     
1 1 1 13 14 45 o 0 696     121.8 ?      ?    3819.41 -41.2447     1052.67  -41.2447    262.852   138.755      
1 1 1 13 16 45 o 0 1316.2  146   ?      ?    5715.26 102.072      1424.68  102.072     470.805   -77.9277     
1 1 1 13 18 45 o 0 2105.6  202.7 ?      ?    5314.66 -120.136     2378.13  -120.136    659.185   -120.136     
1 1 1 1  45 14 o 0 -34.7   83.3  ?      ?    1197.93 131.123      241.46   -48.8766    708.917   -48.8766     
1 1 1 3  45 14 o 0 -121    88.3  ?      ?    1698.41 139.94       432.142  -40.0595    1087.56   -40.0595     
1 1 1 5  45 14 o 0 769     91.1  ?      ?    3097.47 11.3309      1550.38  11.3309     372.98    11.3309      
1 1 1 7  45 14 o 0 82.2    98    ?      ?    2804.97 160.066      291.214  -19.934     1337.34   -19.934      
1 1 1 9  45 14 o 0 471.9   94.3  ?      ?    3663.47 31.903       676.227  31.903      652.291   -148.097     
1 1 1 11 45 14 o 0 623.2   103   ?      ?    2950.98 170.27       1192.31  170.27      150.706   170.27       
1 1 1 13 45 14 o 0 1062.2  124.9 ?      ?    3766.01 -25.1669     1671.32  -25.1669    382.878   -25.1669     
1 1 1 14 15 45 o 0 77.9    132.7 ?      ?    1989.94 147.057      28.0515  -32.9431    688.367   -32.9431     
1 1 1 14 17 45 o 0 842     163.3 ?      ?    2180.16 17.2154      1643.12  17.2154     936.407   17.2154      
1 1 1 14 19 45 o 0 374.2   173.3 ?      ?    2852.27 174.361      434.769  174.361     465.016   -5.63924     
1 1 1 0  45 15 o 0 45.9    117.5 ?      ?    931.209 -90          98.5007  -90         262.602   90           
1 1 1 2  45 15 o 0 193.5   94.1  ?      ?    2391.3  -62.1714     187.735  -62.1714    731.461   117.829      
1 1 1 4  45 15 f 1 614.8   94.1  ?      ?    1453.77 85.2063      1564.51  85.2063     1009.69   85.2063      
1 1 1 6  45 15 o 0 578.9   101.1 ?      ?    2020.23 -28.0624     1395.92  -28.0624    642.011   -28.0624     
1 1 1 8  45 15 o 0 38.5    98.9  ?      ?    1586.15 32.6088      155.738  -147.391    732.562   -147.391     
1 1 1 10 45 15 o 0 645.3   111.7 ?      ?    3451.2  -42.6578     1094.02  -42.6578    130.323   137.342      
1 1 1 12 45 15 o 0 1326.1  121.5 ?      ?    3237.01 -153.974     2218.54  -153.974    1102.92   -153.974     
1 1 1 14 45 15 o 0 502.8   129.3 ?      ?    4217.23 53.6881      539.505  53.6881     843.421   -126.312     
1 1 1 15 16 45 o 0 635.2   166.1 ?      ?    2072.35 -103.894     1286.28  -103.894    614.252   -103.894     
1 1 1 15 18 45 o 0 -39.1   200.2 ?      ?    2334.94 93.0667      136.801  -86.9333    874.921   -86.9333     
1 1 1 1  45 16 o 0 -4.1    97    ?      ?    1344.69 77.8637      186.06   -102.136    699.673   -102.136     
1 1 1 3  45 16 o 0 388.8   100.2 ?      ?    3287.48 -125.769     601.772  -125.769    640.845   54.2311      
1 1 1 5  45 16 o 0 456.7   110.4 ?      ?    2438.9  25.239       980.671  25.239      76.6672   25.239       
1 1 1 7  45 16 o 0 -164.9  105.3 ?      ?    2012.46 41.4947      475.029  -138.505    1207.29   -138.505     
1 1 1 9  45 16 o 0 467     112.5 ?      ?    3548.07 -171.627     677.14   -171.627    585.096   8.37311      
1 1 1 11 45 16 o 0 221.1   125.5 ?      ?    1639.4  -118.054     357.261  -118.054    210.622   61.9456      
1 1 1 13 45 16 o 0 260.4   137.9 ?      ?    1490.25 -77.0329     452.129  -77.0329    40.1898   102.967      
1 1 1 15 45 16 o 0 3180.7  192.7 ?      ?    6028.2  -60.2117     3114.01  -60.2117    1191.53   -60.2117     
1 1 1 16 17 45 o 0 450.2   193.7 ?      ?    4121.81 139.127      253.114  139.127     1050.14   -40.8726     
1 1 1 0  45 17 o 0 -188.6  155.3 ?      ?    1785.39 -90          92.2314  -90         580.268   90           
1 1 1 2  45 17 o 0 991.4   109.2 ?      ?    4604.16 60.5035      1424.29  60.5035     296.128   -119.496     
1 1 1 4  45 17 f 1 463.4   110.9 ?      ?    1573.66 -129.316     1129.5   -129.316    545.29    -129.316     
1 1 1 6  45 17 o 0 616.3   120.2 ?      ?    3476.63 -91.4711     1043.56  -91.4711    219.231   88.5289      
1 1 1 8  45 17 o 0 717     122.9 ?      ?    2924.31 25.1542      1388.26  25.1542     347.387   25.1542      
1 1 1 10 45 17 f 1 568     127.7 ?      ?    2510.25 151.439      1166.04  151.439     289.13    151.439      
1 1 1 12 45 17 f 1 1450.4  149.4 ?      ?    2844.19 62.3968      2433.27  62.3968     1483.49   62.3968      
1 1 1 14 45 17 o 0 3024.3  185.9 ?      ?    6374.01 -166.628     2904.3   -166.628    856.228   -166.628     
1 1 1 16 45 17 o 0 20.4    191.8 ?      ?    1240.31 74.8006      38.6894  74.8006     345.22    -105.199     
1 1 1 1  45 18 o 0 2372.9  146.2 ?      ?    5229.67 -106.36      3005.97  -106.36     1069.21   -106.36      
1 1 1 3  45 18 o 0 2414    143.9 ?      ?    5816.34 9.24423      2821.21  9.24423     687.956   9.24423      
1 1 1 5  45 18 o 0 4405.6  206.9 ?      ?    6382.94 175.859      4338.74  175.859     2029.84   175.859      
1 1 1 7  45 18 o 0 969.2   133.4 ?      ?    4075.7  -49.7382     1486.56  -49.7382    38.4673   -49.7382     
1 1 1 9  45 18 o 0 903     138.5 ?      ?    2625.8  37.8343      1764.62  37.8343     852.026   37.8343      
1 1 1 11 45 18 o 0 125.8   148.8 ?      ?    1449.48 -58.8556     142.287  -58.8556    340.396   121.144      
1 1 1 13 45 18 o 0 287.9   164.1 ?      ?    2068.2  -148.505     453.301  -148.505    214.716   31.4953      
1 1 1 15 45 18 o 0 1316.8  190.3 ?      ?    4680.8  39.1178      1565.57  39.1178     105.626   39.1178      
1 1 1 0  45 19 o 0 551.2   186.9 ?      ?    3815.15 90           1102.01  90          294.701   -90          
1 1 1 2  45 19 o 0 879.5   132   ?      ?    4311.34 -167.947     1288.46  -167.947    278.651   12.053       
1 1 1 4  45 19 o 0 545.1   133.2 ?      ?    2729.12 -70.747      1094.61  -70.747     113.847   -70.747      
1 1 1 6  45 19 f 1 787.6   145.8 ?      ?    4361.36 128.872      1068.96  128.872     482.905   -51.1278     
1 1 1 8  45 19 o 0 515.1   138.5 ?      ?    1387.11 -62.6887     1165.18  -62.6887    691.852   -62.6887     
1 1 1 10 45 19 o 0 847.3   155.6 ?      ?    2652.71 -100.618     1601.35  -100.618    717.515   -100.618     
1 1 1 12 45 19 o 0 448.3   162.5 ?      ?    2657.25 162.101      737.939  162.101     122.835   -17.899      
1 1 1 14 45 19 o 0 619     179.4 ?      ?    3024.1  -69.5769     951.499  -69.5769    3.25127   -69.5769     
1 1 1 1  45 20 o 0 3676.6  187   ?      ?    7144.23 41.0018      3482.79  41.0018     915.819   41.0018      
1 1 1 3  45 20 o 0 2776.1  169.5 ?      ?    5630.8  178.315      3165.77  178.315     1160.43   178.315      
1 1 1 5  45 20 o 0 220.9   140.9 ?      ?    1356.21 80.4928      363.57   80.4929     105.327   -99.5071     
1 1 1 7  45 20 o 0 256.7   154.5 ?      ?    2147    114.582      388.139  114.582     341.433   -65.4183     
1 1 1 9  45 20 o 0 -221.9  166   ?      ?    1834.76 109.12       266.133  -70.8802    876.336   -70.8802     
1 1 1 11 45 20 o 0 439.3   175.1 ?      ?    3145.91 -59.4299     572.996  -59.4299    446.659   120.57       
1 1 1 0  45 21 o 0 771.3   234.4 ?      ?    4243.49 -90          1285.74  -90         192.8     90           
1 1 1 2  45 21 o 0 344.8   150.3 ?      ?    1184.7  -23.4036     660.099  -23.4036    249.883   -23.4036     
1 1 1 4  45 21 o 0 392.9   178.3 ?      ?    1371.81 -75.9835     765.813  -75.9835    295.804   -75.9835     
1 1 1 6  45 21 o 0 1839    183.5 ?      ?    4825.46 63.5873      2350.64  63.5873     721.706   63.5873      
1 1 1 8  45 21 o 0 93.4    172.9 ?      ?    2179.03 -59.5438     40.7657  -59.5438    680.906   120.456      
1 1 1 10 45 21 o 0 88.3    199.2 ?      ?    115.528 15.3183      19.1426  15.3183     18.2358   -164.682     
1 1 1 1  45 22 o 0 399.7   184.5 ?      ?    1000.44 -144.849     701.789  -144.849    360.277   -144.849     
1 1 1 3  45 22 o 0 1175.4  179.5 ?      ?    3033.1  92.2152      2032.71  92.2152     1005.53   92.2152      
1 1 1 5  45 22 o 0 203.4   192   ?      ?    2392.04 -116.454     232.034  -116.454    568.141   63.5461      
1 1 1 7  45 22 o 0 -115.1  200.9 ?      ?    1092.6  -20.2662     31.9215  159.734     391.394   159.734      
1 1 1 2  45 23 o 0 1022.4  209.6 ?      ?    3624.41 -60.3039     1553.71  -60.3039    343.655   -60.3039     
1 1 1 4  45 23 f 1 753.4   210   ?      ?    4320.08 73.7745      846.982  73.7745     589.489   -106.226     
1 1 1 0  46 0  o 0 1653.2  187.8 ?      ?    4176.65 180          2155.95  180         530.459   -180         
1 1 1 0  2  46 o 0 -149.1  87.6  ?      ?    2003.47 9.51639e-14  52.9934  0           669.064   -180         
1 1 1 0  4  46 o 0 207     96.8  ?      ?    2297.04 -180         528.538  180         302.447   7.16587e-14  
1 1 1 0  6  46 o 0 313.9   90.5  ?      ?    1429.73 8.5173e-14   637.508  0           130.632   -3.30487e-13 
1 1 1 0  8  46 o 0 186     96.5  ?      ?    2075.5  3.40976e-15  431.242  0           301.54    -180         
1 1 1 0  10 46 o 0 193.9   106.3 ?      ?    2535.14 1.27679e-15  482.199  0           417.576   -180         
1 1 1 0  12 46 o 0 741.4   116.9 ?      ?    3540.27 180          1321.73  180         80.3323   180          
1 1 1 0  14 46 o 0 345     127.2 ?      ?    2259.98 180          730.465  180         45.3871   -4.48761e-13 
1 1 1 0  16 46 o 0 371.7   148.1 ?      ?    2386.78 -8.5059e-15  747.134  0           55.9187   180          
1 1 1 0  18 46 o 0 537.2   159.8 ?      ?    3314.14 1.80707e-14  1006.56  0           81.9046   -180         
1 1 1 0  20 46 o 0 648.7   187.3 ?      ?    1203.68 -180         870.771  180         492.724   180          
1 1 1 1  46 1  o 0 480.2   69.4  ?      ?    2811.47 129.937      1020.58  129.937     72.7686   -50.0632     
1 1 1 1  3  46 o 0 272.1   65.7  ?      ?    2087.89 -67.711      574.182  -67.711     182.529   112.289      
1 1 1 1  5  46 o 0 628.6   70.1  ?      ?    3094.35 132.786      1193.82  132.786     92.7399   132.786      
1 1 1 1  7  46 o 0 419.8   69.7  ?      ?    1326.72 -81.4018     1018.95  -81.4018    547.912   -81.4018     
1 1 1 1  9  46 o 0 556.2   66.6  ?      ?    1612.81 -6.71881     1361.21  -6.71881    784.476   -6.71881     
1 1 1 1  11 46 o 0 864.7   86.3  ?      ?    4298.63 -143.11      1248.87  -143.11     272.803   36.8897      
1 1 1 1  13 46 o 0 698.4   88.3  ?      ?    3618.73 15.387       1142.74  15.387      120.306   -164.613     
1 1 1 1  15 46 o 0 373.5   95.5  ?      ?    1235.23 -130.722     812.834  -130.722    391.578   -130.722     
1 1 1 1  17 46 f 1 1681.6  127.9 ?      ?    5347.6  131.977      1946.01  131.977     152.062   131.977      
1 1 1 1  19 46 o 0 2993.3  171.3 ?      ?    7739.78 -73.9481     2449.42  -73.9481    24.7284   106.052      
1 1 1 1  21 46 o 0 642.2   133.4 ?      ?    4545.34 136.595      660.68   136.595     749.247   -43.4055     
1 1 1 0  46 2  o 0 306.4   97.7  ?      ?    3780.62 -4.11253e-14 880.126  0           603.654   180          
1 1 1 2  46 2  o 0 604.4   68.2  ?      ?    2617.57 135.18       1365.93  135.18      350.647   135.18       
1 1 1 2  4  46 o 0 -77.2   64.8  ?      ?    889.862 131.821      226.466  -48.179     543.693   -48.179      
1 1 1 2  6  46 o 0 841.3   75.8  ?      ?    3081.18 131.612      1596.1   131.612     498.115   131.612      
1 1 1 2  8  46 o 0 149.1   67.8  ?      ?    2744.37 46.6617      56.4218  -133.338    1030.19   -133.338     
1 1 1 2  10 46 f 1 501.5   74.2  ?      ?    2411.2  -7.63779     1098.89  -7.63779    234.067   -7.63779     
1 1 1 2  12 46 o 0 418.9   81.9  ?      ?    1662.49 171.579      1005.94  171.579     420.171   171.579      
1 1 1 2  14 46 o 0 112.6   85.8  ?      ?    2729.26 -161.167     203.27   18.8326     1144.75   18.8326      
1 1 1 2  16 46 o 0 90.9    100   ?      ?    1395.52 48.4883      4.48564  -131.512    476.308   -131.512     
1 1 1 2  18 46 o 0 298     114.6 ?      ?    3394.38 73.0925      244.697  73.0925     857.307   -106.908     
1 1 1 2  20 46 o 0 -158.9  125.1 ?      ?    366.447 110.163      57.1741  -69.8368    172.855   -69.8368     
1 1 1 1  46 3  o 0 154.1   68.6  ?      ?    906.52  84.5145      206.968  84.5145     147.858   -95.4855     
1 1 1 3  46 3  o 0 41.9    63.2  ?      ?    1759.82 96.679       265.129  -83.321     944.695   -83.321      
1 1 1 3  5  46 o 0 -43.9   65.7  ?      ?    1003.15 -62.0449     231.511  117.955     589.645   117.955      
1 1 1 3  7  46 f 1 1425    86.1  ?      ?    4263.55 1.5642       2105.89  1.5642      578.913   1.5642       
1 1 1 3  9  46 o 0 456.4   77    ?      ?    3091.53 -83.6893     822.567  -83.6893    286.189   96.3107      
1 1 1 3  11 46 o 0 803.1   86.8  ?      ?    2757.24 120.389      1606.15  120.389     627.366   120.389      
1 1 1 3  13 46 o 0 335.3   90.2  ?      ?    1690.13 40.7397      749.79   40.7397     161.254   40.7397      
1 1 1 3  15 46 o 0 653.7   102.3 ?      ?    2007.29 85.7722      1427.74  85.7722     741.307   85.7722      
1 1 1 3  17 46 o 0 1445.9  129.5 ?      ?    4159.28 -83.4097     2041.75  -83.4097    650.431   -83.4097     
1 1 1 3  19 46 o 0 1030.8  133.4 ?      ?    4360.92 64.8326      1386.82  64.8326     11.2158   -115.167     
1 1 1 3  21 46 f 1 -85.3   150.1 ?      ?    1801.67 -85.6852     195.584  94.3148     759.283   94.3148      
1 1 1 0  46 4  o 0 1345.9  123.7 ?      ?    733.641 1.52528e-14  1657.08  0           1367.93   -3.22415e-15 
1 1 1 2  46 4  o 0 324.7   65.4  ?      ?    1120.15 -77.9908     786.462  -77.9908    358.655   -77.9908     
1 1 1 4  46 4  o 0 375.8   68.7  ?      ?    2871.75 -40.6526     715.101  -40.6526    365.061   139.347      
1 1 1 4  6  46 o 0 61.1    64.5  ?      ?    1379.12 -28.9888     137.483  151.011     629.546   151.011      
1 1 1 4  8  46 o 0 2393.9  106.9 ?      ?    6611.18 -116.961     2476.45  -116.961    96.6332   -116.961     
1 1 1 4  10 46 o 0 3023    126.6 ?      ?    4913.35 82.978       3631.81  82.978      1877.92   82.978       
1 1 1 4  12 46 f 1 434.8   83.9  ?      ?    1647.43 50.3111      1046.57  50.3111     462.39    50.3111      
1 1 1 4  14 46 o 0 3576.3  158.1 ?      ?    7538.68 -110.574     3124.45  -110.574    522.142   -110.574     
1 1 1 4  16 46 o 0 3074.3  161.2 ?      ?    4011.78 82.1702      3773.42  82.1702     2416.14   82.1702      
1 1 1 4  18 46 o 0 2440    153.4 ?      ?    7087.33 -96.2923     2205.12  -96.2923    97.4065   83.7077      
1 1 1 4  20 46 o 0 188.2   134.3 ?      ?    3495.92 35.0565      103.146  -144.944    1207.58   -144.944     
1 1 1 1  46 5  o 0 22.7    68.3  ?      ?    2626.78 -174.916     532.988  5.08357     1543.09   5.08357      
1 1 1 3  46 5  o 0 366.6   71.6  ?      ?    2550.9  -13.8474     780.865  -13.8474    187.211   166.153      
1 1 1 5  46 5  o 0 674     68.1  ?      ?    1903.75 -110.21      1644.02  -110.21     933.712   -110.21      
1 1 1 5  7  46 o 0 692.5   77.5  ?      ?    2086.75 28.5623      1591.23  28.5623     838.669   28.5623      
1 1 1 5  9  46 o 0 475.4   79.3  ?      ?    3236.16 164.473      822.496  164.473     336.967   -15.5272     
1 1 1 5  11 46 o 0 1167.9  91.4  ?      ?    3716.84 -21.1481     1913.03  -21.1481    595.146   -21.1481     
1 1 1 5  13 46 o 0 1131.5  106.4 ?      ?    4949.49 147.971      1430.68  147.971     290.605   -32.0294     
1 1 1 5  15 46 o 0 193     98.2  ?      ?    2480.98 170.783      135.481  170.783     711.78    -9.21686     
1 1 1 5  17 46 f 1 555.5   124.2 ?      ?    2447.59 -53.3284     1114.58  -53.3284    292.368   -53.3284     
1 1 1 5  19 46 o 0 369.2   130.2 ?      ?    2411.77 -154.62      631.533  -154.62     140.551   25.3797      
1 1 1 5  21 46 o 0 1319.5  171.8 ?      ?    4858.14 -61.1032     1533.08  -61.1032    23.6878   -61.1032     
1 1 1 0  46 6  o 0 32.6    109.4 ?      ?    2195.24 -180         187.057  180         661.021   3.91183e-14  
1 1 1 2  46 6  o 0 438.6   69.9  ?      ?    3045.54 15.5978      846.033  15.5978     317.595   -164.402     
1 1 1 4  46 6  o 0 1591    89.6  ?      ?    4651.96 151.134      2326.98  151.134     575.891   151.134      
1 1 1 6  46 6  o 0 429.4   71.3  ?      ?    2375.73 -61.2144     975.28   -61.2144    97.6033   -61.2144     
1 1 1 6  8  46 o 0 663.3   76.8  ?      ?    3609.1  56.6575      1118.4   56.6575     177.098   -123.342     
1 1 1 6  10 46 o 0 -23.1   79.1  ?      ?    1365.58 -80.5989     253.624  99.4011     739.607   99.4011      
1 1 1 6  12 46 o 0 384.5   89.5  ?      ?    2262.32 -60.1296     810.46   -60.1296    19.3258   -60.1296     
1 1 1 6  14 46 o 0 551.4   99.5  ?      ?    2221.24 27.693       1189.99  27.693      425.788   27.693       
1 1 1 6  16 46 o 0 1405.7  127.2 ?      ?    3109.02 95.3812      2309.82  95.3812     1261.57   95.3812      
1 1 1 6  18 46 o 0 682.6   132.2 ?      ?    3092.96 3.11947      1184.43  3.11947     183.097   3.11947      
1 1 1 6  20 46 o 0 327.2   154.1 ?      ?    2261.71 176.5        494.641  176.5       217.367   -3.50047     
1 1 1 1  46 7  o 0 243     68.3  ?      ?    2487.27 -41.6905     411.865  -41.6905    542.797   138.31       
1 1 1 3  46 7  f 1 1108.4  84    ?      ?    985.502 113.334      2412.31  113.334     2036.75   113.334      
1 1 1 5  46 7  o 0 118.7   68.2  ?      ?    1103.49 0.767065     67.1159  0.767065    349.67    -179.233     
1 1 1 7  46 7  o 0 1702.4  96.8  ?      ?    4449.3  -151.784     2497.32  -151.784    850.892   -151.784     
1 1 1 7  9  46 o 0 212.9   83.5  ?      ?    1110.82 -21.0085     355.001  -21.0085    41.0558   158.991      
1 1 1 7  11 46 o 0 353.4   90.9  ?      ?    1703.54 -141.869     819.941  -141.869    218.978   -141.869     
1 1 1 7  13 46 o 0 28      94.5  ?      ?    2004.13 136.74       250.523  -43.2599    943.838   -43.2599     
1 1 1 7  15 46 o 0 460.8   112   ?      ?    1691.48 1.15077      1042.81  1.15077     468.289   1.15077      
1 1 1 7  17 46 o 0 625.3   131.8 ?      ?    2124.93 -74.425      1305.93  -74.425     611.606   -74.425      
1 1 1 7  19 46 o 0 331     154.6 ?      ?    1593.7  -80.4488     592.277  -80.4488    84.9398   -80.4488     
1 1 1 0  46 8  o 0 25.5    102   ?      ?    5.57595 180          0.4822   180         1.66285   -6.66021e-12 
1 1 1 2  46 8  o 0 286     73.9  ?      ?    2327.22 147.21       592.56   147.21      293.266   -32.7898     
1 1 1 4  46 8  o 0 692.1   81.4  ?      ?    3271.24 -39.9704     1351.91  -39.9704    108.193   -39.9704     
1 1 1 6  46 8  o 0 283.6   76.1  ?      ?    1302.85 -154.371     666.172  -154.371    179.851   -154.371     
1 1 1 8  46 8  o 0 247.5   83.8  ?      ?    1697.72 -158.443     495.224  -158.443    124.544   21.5574      
1 1 1 8  10 46 o 0 128.8   88.6  ?      ?    3106.78 42.2006      228.041  -137.799    1326.06   -137.799     
1 1 1 8  12 46 f 1 1368.9  116.1 ?      ?    3963.05 -125.399     2062.3   -125.399    678.519   -125.399     
1 1 1 8  14 46 o 0 1629.7  135.4 ?      ?    4976.03 74.8558      2048.23  74.8558     348.812   74.8558      
1 1 1 8  16 46 f 1 933.1   138.2 ?      ?    2623.39 -98.8477     1743.27  -98.8477    860.425   -98.8477     
1 1 1 8  18 46 o 0 -92.8   145.1 ?      ?    1006.6  175.341      94.4439  -4.65865    417.839   -4.65865     
1 1 1 8  20 46 o 0 -417.1  173.8 ?      ?    1768.3  -113.78      318.555  66.2201     870.927   66.2201      
1 1 1 1  46 9  o 0 -14     73.7  ?      ?    2415.79 -57.3496     541.199  122.65      1475.17   122.65       
1 1 1 3  46 9  o 0 539.7   86.1  ?      ?    2743.38 107.931      1177.74  107.931     130.132   107.931      
1 1 1 5  46 9  o 0 403.6   89    ?      ?    3431.89 -149.354     610.252  -149.354    679.168   30.6459      
1 1 1 7  46 9  o 0 1524.4  101.1 ?      ?    3855.61 124.046      2445.36  124.046     1025.6    124.046      
1 1 1 9  46 9  o 0 1401.5  109.6 ?      ?    4811.42 -19.6133     1910.37  -19.6133    180.768   -19.6133     
1 1 1 9  11 46 o 0 238.6   104.2 ?      ?    1803.18 -142.236     383.129  -142.236    244.096   37.7643      
1 1 1 9  13 46 o 0 216.9   108.1 ?      ?    1740.33 -86.4654     323.957  -86.4653    272.555   93.5347      
1 1 1 9  15 46 o 0 494.3   128.8 ?      ?    2666.51 -116.193     940.54   -116.193    43.3774   -116.193     
1 1 1 9  17 46 o 0 44.1    142.8 ?      ?    807.95  15.2669      20.0411  15.2669     241.423   -164.733     
1 1 1 9  19 46 o 0 -319    162.9 ?      ?    662.323 -170.711     104.84   9.28859     313.624   9.28859      
1 1 1 0  46 10 o 0 350.7   113.2 ?      ?    708.142 -180         446.926  180         173.183   180          
1 1 1 2  46 10 f 1 620.3   86.3  ?      ?    4097.26 -110.469     922.896  -110.469    653.91    69.5313      
1 1 1 4  46 10 o 0 2039.4  116.4 ?      ?    5799.82 45.2925      2478.97  45.2925     290.464   45.2925      
1 1 1 6  46 10 o 0 635.3   90.6  ?      ?    2303.61 164.639      1459.28  164.639     605.518   164.639      
1 1 1 8  46 10 o 0 230.7   94.2  ?      ?    2569.85 -95.5671     271.055  -95.5671    660.748   84.4329      
1 1 1 10 46 10 o 0 781.2   105.6 ?      ?    4985.52 -101.51      861.247  -101.51     891.338   78.4899      
1 1 1 10 12 46 o 0 232.8   114.2 ?      ?    2742.84 74.3309      194.521  74.3309     747.285   -105.669     
1 1 1 10 14 46 f 1 545.5   129.9 ?      ?    3205.97 -113.655     906.427  -113.655    182.202   66.3454      
1 1 1 10 16 46 o 0 653.7   151.3 ?      ?    2376.42 -161.206     1288.23  -161.206    515.059   -161.206     
1 1 1 10 18 46 o 0 -171.5  160   ?      ?    1349.87 -25.1956     159.271  154.804     587.851   154.804      
1 1 1 1  46 11 o 0 1027.6  93.1  ?      ?    3839.84 65.8612      1791.1   65.8612     321.931   65.8612      
1 1 1 3  46 11 o 0 1646.1  106.7 ?      ?    5492.64 -120.8       2105     -120.8      28.1497   -120.8       
1 1 1 5  46 11 o 0 1732    113.7 ?      ?    3961.52 24.1933      2704.54  24.1933     1230.08   24.1933      
1 1 1 7  46 11 o 0 1149.4  111.2 ?      ?    4701.8  144.113      1605.73  144.113     110.075   -35.8868     
1 1 1 9  46 11 o 0 92.6    102.8 ?      ?    1831.57 172.594      60.9507  -7.40622    710.381   -7.40622     
1 1 1 11 46 11 o 0 37.8    116.9 ?      ?    1110.78 -157.899     45.1482  22.101      428.216   22.101       
1 1 1 11 13 46 o 0 671.7   129.8 ?      ?    2326.72 146.099      1380.51  146.099     593.526   146.099      
1 1 1 11 15 46 o 0 446.8   141.3 ?      ?    2919.02 81.7477      719.823  81.7477     233.198   -98.2523     
1 1 1 11 17 46 o 0 -254.9  164   ?      ?    1382.62 -132.778     199.044  47.2218     640.34    47.2218      
1 1 1 0  46 12 o 0 1037.9  139.9 ?      ?    2829.04 -2.03234e-14 1705.88  0           626.243   3.50376e-14  
1 1 1 2  46 12 o 0 262.4   90.6  ?      ?    1730.48 110.077      557.754  110.077     96.3975   -69.9233     
1 1 1 4  46 12 f 1 667.9   92.3  ?      ?    2411.79 -125.744     1508.55  -125.744    604.03    -125.744     
1 1 1 6  46 12 o 0 1590.8  116.4 ?      ?    4246.68 20.801       2384.71  20.801      836.352   20.801       
1 1 1 8  46 12 f 1 256.4   107.5 ?      ?    1533.41 127.616      466.16   127.616     84.1276   -52.3845     
1 1 1 10 46 12 o 0 -56.3   112.6 ?      ?    2646.05 120.304      470.726  -59.6959    1391.15   -59.6959     
1 1 1 12 46 12 o 0 308.3   125.9 ?      ?    1593.41 153.959      601.602  153.959     63.5521   153.959      
1 1 1 12 14 46 o 0 580.7   144.7 ?      ?    1843.01 -3.75093     1244.89  -3.75093    642.191   -3.75093     
1 1 1 12 16 46 o 0 476.9   159.7 ?      ?    2960.74 -42.7062     735.844  -42.7062    212.349   137.294      
1 1 1 12 18 46 o 0 3015.9  239.8 ?      ?    7190.86 113.108      2501.13  113.108     254.455   113.108      
1 1 1 1  46 13 o 0 848.6   99.1  ?      ?    3380.7  -71.2485     1594.98  -71.2485    320.377   -71.2485     
1 1 1 3  46 13 o 0 753.8   99    ?      ?    4397.76 74.6749      1066.6   74.6749     564.647   -105.325     
1 1 1 5  46 13 o 0 2495.5  132.9 ?      ?    6300.18 -76.2791     2726.16  -76.2791    424.665   -76.2791     
1 1 1 7  46 13 o 0 1567.9  118.7 ?      ?    3993.2  78.7048      2392.51  78.7048     961.608   78.7048      
1 1 1 9  46 13 o 0 1052.6  129.3 ?      ?    3227.8  -106.695     1845.8   -106.695    715.815   -106.695     
1 1 1 11 46 13 o 0 754     138.5 ?      ?    3025.16 53.4971      1366.19  53.4971     335.801   53.4971      
1 1 1 13 46 13 o 0 627.2   147.1 ?      ?    1830.12 -24.2286     1328.48  -24.2286    734.458   -24.2286     
1 1 1 13 15 46 o 0 225.7   148.7 ?      ?    3853.1  -113.676     97.8845  66.3243     1333.74   66.3243      
1 1 1 13 17 46 o 0 1559.8  186.8 ?      ?    3972.21 -2.78737     2075.33  -2.78737    830.213   -2.78737     
1 1 1 0  46 14 o 0 -93.3   141.7 ?      ?    889.603 -7.04666e-14 55.749   0           276.263   180          
1 1 1 2  46 14 o 0 166.4   100.5 ?      ?    1922.94 169.414      143.34   169.414     568.008   -10.5859     
1 1 1 4  46 14 o 0 0.4     105.9 ?      ?    1256.43 29.8954      145.865  -150.105    604.671   -150.105     
1 1 1 6  46 14 o 0 474.3   120.7 ?      ?    2608.66 -169.485     952.524  -169.485    15.9958   -169.485     
1 1 1 8  46 14 o 0 575.8   124.3 ?      ?    440.762 31.8967      743.575  31.8967     588.636   31.8967      
1 1 1 10 46 14 f 1 930.9   128.6 ?      ?    3007.13 -68.021      1685.24  -68.021     648.593   -68.021      
1 1 1 12 46 14 o 0 235.2   141.7 ?      ?    2377.79 10.0735      288.304  10.0735     490.241   -169.926     
1 1 1 14 46 14 o 0 1276.9  160.3 ?      ?    5371.38 -164.549     1397.13  -164.549    303.333   15.4507      
1 1 1 14 16 46 o 0 93.3    174.3 ?      ?    3615.21 26.9216      299.484  -153.078    1434.26   -153.078     
1 1 1 1  46 15 o 0 -105.7  104.5 ?      ?    1098.87 -164.203     220.529  15.7966     624.948   15.7966      
1 1 1 3  46 15 o 0 157.1   114.9 ?      ?    1648.38 5.66411      161.193  5.66411     439.082   -174.336     
1 1 1 5  46 15 o 0 60.3    114.7 ?      ?    1589.99 126.441      64.6901  -53.5592    635.259   -53.5592     
1 1 1 7  46 15 o 0 1101.6  136.3 ?      ?    2678.03 91.6131      2085.36  91.6131     1142.22   91.6131      
1 1 1 9  46 15 o 0 1454    145.5 ?      ?    3343.96 -148.043     2349.29  -148.043    1198.25   -148.043     
1 1 1 11 46 15 o 0 1656.6  167   ?      ?    3491.15 -59.6028     2489.02  -59.6028    1338.54   -59.6028     
1 1 1 13 46 15 o 0 588.8   148   ?      ?    1822.22 177.116      1224.06  177.116     642.083   177.116      
1 1 1 15 46 15 o 0 262.4   176.1 ?      ?    2237.52 94.3081      308.195  94.3081     381.313   -85.6919     
1 1 1 0  46 16 o 0 54.3    171.3 ?      ?    530.771 180          70.3465  180         123.505   -3.90551e-14 
1 1 1 2  46 16 o 0 438     123.1 ?      ?    2161.57 -135.602     975.547  -135.602    192.455   -135.602     
1 1 1 4  46 16 o 0 380.9   120.2 ?      ?    1401.16 -130.457     849.717  -130.457    348.317   -130.457     
1 1 1 6  46 16 o 0 496.3   134.9 ?      ?    2108.96 155.702      1100.25  155.702     357.872   155.702      
1 1 1 8  46 16 f 1 1731    158.4 ?      ?    4576.65 22.8549      2307.79  22.8549     720.622   22.8549      
1 1 1 10 46 16 o 0 371.3   148.5 ?      ?    1812.37 29.1822      724.546  29.1822     124.807   29.1822      
1 1 1 12 46 16 o 0 1569.8  172   ?      ?    4672.22 -145.518     1984.79  -145.518    482.851   -145.518     
1 1 1 14 46 16 o 0 2100.4  201.5 ?      ?    7134.43 40.6267      1714.37  40.6267     503.83    -139.373     
1 1 1 1  46 17 f 1 550.3   138.6 ?      ?    2499.44 166.443      1158.15  166.443     254.522   166.443      
1 1 1 3  46 17 o 0 410     130.2 ?      ?    999.733 71.2514      841.028  71.2514     485.142   71.2514      
1 1 1 5  46 17 f 1 1304.9  140.5 ?      ?    2020.77 93.6156      2527.27  93.6156     1813.94   93.6156      
1 1 1 7  46 17 o 0 285     151.5 ?      ?    1106.8  -116.008     487.854  -116.008    112.612   -116.008     
1 1 1 9  46 17 o 0 754.8   147.6 ?      ?    1506.45 -90.194      1604.14  -90.194     1104.71   -90.194      
1 1 1 11 46 17 o 0 1321.9  165.2 ?      ?    3377.62 -167.519     2053.53  -167.519    963.179   -167.519     
1 1 1 13 46 17 o 0 -9.4    174.7 ?      ?    1054.44 -173.242     5.52276  6.75812     335.535   6.75812      
1 1 1 0  46 18 o 0 -97.7   194   ?      ?    1129.23 -180         99.8064  180         302.005   1.8788e-14   
1 1 1 2  46 18 o 0 177.1   145.2 ?      ?    2297.67 15.3916      172.217  15.3916     626.117   -164.608     
1 1 1 4  46 18 o 0 -19.4   148.2 ?      ?    969.329 15.9372      31.3735  -164.063    364.291   -164.063     
1 1 1 6  46 18 o 0 635.1   172.8 ?      ?    2745.72 20.6707      1194.4   20.6707     266.168   20.6707      
1 1 1 8  46 18 o 0 1153.8  179.5 ?      ?    3201.28 -178.345     1913.35  -178.345    852.554   -178.345     
1 1 1 10 46 18 o 0 448.2   172.3 ?      ?    3407.9  119.58       534.899  119.58      567.304   -60.4201     
1 1 1 12 46 18 o 0 77.7    196.6 ?      ?    2602.28 29.1138      59.2752  -150.886    877.214   -150.886     
1 1 1 1  46 19 o 0 202     157.6 ?      ?    1715.1  -45.9236     304.582  -45.9236    285.232   134.076      
1 1 1 3  46 19 o 0 146.9   162.1 ?      ?    2610.65 -6.79983     42.9523  -6.79983    846.755   173.2        
1 1 1 5  46 19 o 0 92.2    168   ?      ?    1444.86 -138.582     114.261  -138.582    371.619   41.4181      
1 1 1 7  46 19 o 0 203.7   175.9 ?      ?    1894.64 75.9586      293.175  75.9586     332.848   -104.041     
1 1 1 9  46 19 o 0 548.5   176.2 ?      ?    3494.52 -29.5384     709.317  -29.5384    420.377   150.462      
1 1 1 0  46 20 o 0 36.3    240.2 ?      ?    3410.12 180          358.73   180         798.906   -2.23515e-14 
1 1 1 2  46 20 o 0 809.5   179.3 ?      ?    4348.96 -125.673     1063.56  -125.673    403.354   54.327       
1 1 1 4  46 20 o 0 -15.6   183.3 ?      ?    904.757 -12.9704     27.3887  -12.9704    274.51    167.03       
1 1 1 6  46 20 o 0 80      185.1 ?      ?    2812.52 42.033       96.0291  -137.967    1020.43   -137.967     
1 1 1 8  46 20 o 0 -162.3  201.3 ?      ?    1529.72 -143.357     113.867  36.6427     606.979   36.6427      
1 1 1 1  46 21 o 0 -660.2  202   ?      ?    1298.62 62.4021      252.498  -117.598    684.888   -117.598     
1 1 1 3  46 21 f 1 1057.7  186.8 ?      ?    3019.17 155.544      1767.43  155.544     764.707   155.544      
1 1 1 5  46 21 o 0 -287.7  193.7 ?      ?    692.499 -75.8376     78.5721  104.162     304.414   104.162      
1 1 1 0  1  47 o 0 1733.7  151.3 ?      ?    5591.9  -90          1977.57  -90         79.1329   -90          
1 1 1 0  3  47 o 0 643.3   120   ?      ?    3894.04 90           1192.44  90          137.255   -90          
1 1 1 0  5  47 o 0 -180.2  110.6 ?      ?    745.759 90           23.1599  90          231.972   -90          
1 1 1 0  7  47 f 1 1056.2  130.6 ?      ?    1364.5  90           1466.51  90          998.034   90           
1 1 1 0  9  47 o 0 7       119.8 ?      ?    1052.34 -90          79.0181  -90         278.098   90           
1 1 1 0  11 47 o 0 105.2   123.8 ?      ?    625.635 90           81.3136  90          127.822   -90          
1 1 1 0  13 47 o 0 1499.2  167.5 ?      ?    2920.91 -90          1785.12  -90         822.296   -90          
1 1 1 0  15 47 o 0 6588.2  360.6 ?      ?    9099.53 90           3696.34  90          750.32    90           
1 1 1 0  17 47 o 0 1896.9  209.6 ?      ?    4868.67 -90          1927.25  -90         410.56    -90          
1 1 1 0  19 47 f 1 537     219.4 ?      ?    1125.09 -90          588.656  -90         245.235   -90          
1 1 1 0  47 1  o 0 2417.7  169.8 ?      ?    4825.1  90           2557.43  90          766.252   90           
1 1 1 1  2  47 o 0 2650.9  122.6 ?      ?    5138.45 -88.4322     3071.6   -88.4322    1314.76   -88.4322     
1 1 1 1  4  47 o 0 803.4   84.9  ?      ?    2160.03 22.185       1694.43  22.185      953.17    22.185       
1 1 1 1  6  47 o 0 -194.5  77.3  ?      ?    1885.43 51.7091      509.425  -128.291    1156.33   -128.291     
1 1 1 1  8  47 o 0 60.5    82.8  ?      ?    637.988 -162.841     27.965   17.1586     245.966   17.1586      
1 1 1 1  10 47 o 0 465.3   89.7  ?      ?    3766.66 -51.7226     586.31   -51.7226    683.978   128.277      
1 1 1 1  12 47 o 0 759.1   104.6 ?      ?    4369.63 138.976      972.645  138.976     483.391   -41.0236     
1 1 1 1  14 47 o 0 1179.1  119.6 ?      ?    3406.97 -4.35181     1872.96  -4.35181    755.692   -4.35181     
1 1 1 1  16 47 o 0 405.5   131.4 ?      ?    1748.29 136.354      806.837  136.354     254.052   136.354      
1 1 1 1  18 47 o 0 -164.5  147   ?      ?    1690.84 -30.399      231.834  149.601     753.801   149.601      
1 1 1 1  47 2  o 0 140.4   78.8  ?      ?    930.445 16.4836      129.88   16.4836     214.977   -163.516     
1 1 1 2  3  47 o 0 3002.7  129.9 ?      ?    7254.33 -138.084     2712.49  -138.083    219.925   -138.083     
1 1 1 2  5  47 o 0 894.4   87.5  ?      ?    4084.18 28.8502      1328.89  28.8502     76.7314   -151.15      
1 1 1 2  7  47 o 0 -259.9  82.1  ?      ?    2467.76 56.9526      690.388  -123.047    1537.8    -123.047     
1 1 1 2  9  47 o 0 -3.9    87.6  ?      ?    864.667 -139.587     119.747  40.4125     413.355   40.4125      
1 1 1 2  11 47 o 0 161.3   94.2  ?      ?    1933.02 115.617      117.555  115.617     532.245   -64.3826     
1 1 1 2  13 47 o 0 1216.9  115.2 ?      ?    3076.46 -90.362      2032.73  -90.362     1012.94   -90.362      
1 1 1 2  15 47 o 0 1788.9  136.3 ?      ?    4124.86 -70.8237     2392.53  -70.8237    1049.58   -70.8237     
1 1 1 2  17 47 o 0 3293.4  184   ?      ?    5945.65 75.7303      3177.61  75.7303     1314.86   75.7303      
1 1 1 2  19 47 o 0 817.8   152.9 ?      ?    3713.95 -78.4116     1136.24  -78.4116    2.42086   -78.4116     
1 1 1 0  47 3  o 0 583.5   113.2 ?      ?    2779.37 -90          1231.19  -90         192.767   -90          
1 1 1 2  47 3  o 0 2263    119   ?      ?    5664.66 136.986      2726.38  136.986     634.049   136.986      
1 1 1 3  4  47 o 0 187.9   78.9  ?      ?    2743.14 155.085      81.2595  155.085     863.974   -24.9149     
1 1 1 3  6  47 o 0 285     86.1  ?      ?    3238.89 -35.9728     293.991  -35.9728    821.615   144.027      
1 1 1 3  8  47 o 0 902.2   93.4  ?      ?    4199.49 26.7855      1298.88  26.7855     141.413   -153.215     
1 1 1 3  10 47 f 1 164.7   94.1  ?      ?    2784.05 -79.0263     40.5465  100.974     988.142   100.974      
1 1 1 3  12 47 o 0 344.9   110.2 ?      ?    2739.65 21.8125      525.391  21.8125     390.712   -158.188     
1 1 1 3  14 47 o 0 2334.8  148.4 ?      ?    4483.73 166.727      2872.09  166.727     1396.61   166.727      
1 1 1 3  16 47 o 0 1453.6  141.7 ?      ?    4484.63 -45.6328     1892.44  -45.6328    469.51    -45.6328     
1 1 1 3  18 47 f 1 1789    162.8 ?      ?    5591.36 156.229      1882.52  156.229     140.533   156.229      
1 1 1 1  47 4  o 0 1745.5  104.8 ?      ?    5158.07 39.0676      2319.64  39.0676     399.203   39.0676      
1 1 1 3  47 4  o 0 592     88.5  ?      ?    2585.3  70.6118      1286.87  70.6118     336.978   70.6118      
1 1 1 4  5  47 o 0 -39.5   82.3  ?      ?    846.338 86.4852      153.213  -93.5148    445.074   -93.5148     
1 1 1 4  7  47 o 0 1670.3  102.1 ?      ?    4744.7  -99.1443     2188.1   -99.1443    555.891   -99.1443     
1 1 1 4  9  47 o 0 23.2    90.9  ?      ?    2781.08 109.458      442.624  -70.5417    1388.5    -70.5417     
1 1 1 4  11 47 o 0 3300.4  153.8 ?      ?    5781.31 -64.8601     3393.58  -64.8601    1447.25   -64.8601     
1 1 1 4  13 47 o 0 287     112.1 ?      ?    1973.42 75.8964      508.998  75.8964     146.071   -104.104     
1 1 1 4  15 47 f 1 2919    174.9 ?      ?    2484.16 54.4557      3912.63  54.4557     3111.51   54.4557      
1 1 1 4  17 47 o 0 380.2   134.3 ?      ?    2280.09 171.406      666.411  171.406     48.9114   -8.59365     
1 1 1 4  19 47 o 0 717.8   155.6 ?      ?    3417.69 107.51       1044.88  107.51      0.0292882 107.51       
1 1 1 0  47 5  o 0 6653.4  354   ?      ?    9128.27 -90          4268.86  -90         850.708   -90          
1 1 1 2  47 5  o 0 1604.9  103.8 ?      ?    3413.27 58.6566      2707.19  58.6566     1443.12   58.6566      
1 1 1 4  47 5  o 0 995.9   88.9  ?      ?    3693.91 -32.8822     1704.53  -32.8822    356.916   -32.8822     
1 1 1 5  6  47 o 0 1304.6  96.1  ?      ?    3578.68 138.03       2088.21  138.03      855.669   138.03       
1 1 1 5  8  47 o 0 347.4   92.8  ?      ?    3137.86 -127.388     480.826  -127.388    589.604   52.6118      
1 1 1 5  10 47 o 0 390.7   103.3 ?      ?    1992.27 -66.7        829.651  -66.7       155.674   -66.7        
1 1 1 5  12 47 o 0 421     107.3 ?      ?    2247.08 -144.225     858.914  -144.225    107.971   -144.225     
1 1 1 5  14 47 o 0 1126.7  127.2 ?      ?    3747.46 168.103      1709.83  168.103     477.486   168.103      
1 1 1 5  16 47 o 0 1454.4  156.8 ?      ?    3201.77 7.03149      2233.07  7.03149     1217.93   7.03149      
1 1 1 5  18 47 o 0 92      156.1 ?      ?    1018.58 -84.7904     78.2691  -84.7904    237.049   95.2096      
1 1 1 1  47 6  o 0 765.7   93    ?      ?    3771.8  147.245      1300.09  147.245     104.708   -32.7549     
1 1 1 3  47 6  o 0 1046.1  93.8  ?      ?    4516.7  -85.3448     1528.04  -85.3448    132.719   94.6552      
1 1 1 5  47 6  o 0 189.4   81.2  ?      ?    3068.5  105.073      4.40795  105.073     1105.07   -74.9266     
1 1 1 6  7  47 o 0 208.4   88.5  ?      ?    2796.1  -3.92442     121.489  -3.92442    833.465   176.076      
1 1 1 6  9  47 o 0 116.6   94.1  ?      ?    2397.91 158.701      103.672  -21.2986    917.294   -21.2986     
1 1 1 6  11 47 o 0 50.3    103.2 ?      ?    814.9   96.0034      29.6991  -83.9966    303.343   -83.9966     
1 1 1 6  13 47 o 0 705.7   124.4 ?      ?    2878.99 59.1575      1291.06  59.1575     337.959   59.1575      
1 1 1 6  15 47 o 0 833.3   136.8 ?      ?    2640.59 139.173      1535.16  139.173     690.744   139.173      
1 1 1 6  17 47 o 0 515.6   148.7 ?      ?    2024.14 -131.37      1022.22  -131.37     389.019   -131.37      
1 1 1 0  47 7  f 1 41.1    114.7 ?      ?    4214.19 90           296.108  90          1287.71   -90          
1 1 1 2  47 7  o 0 620.5   88.6  ?      ?    3080.15 -75.4455     1218.22  -75.4455    79.2729   -75.4455     
1 1 1 4  47 7  o 0 779.7   93.9  ?      ?    4312.45 124.395      1125.37  124.395     446.094   -55.6046     
1 1 1 6  47 7  o 0 4.8     83.7  ?      ?    2599.93 -41.8293     477.241  138.171     1402.52   138.171      
1 1 1 7  8  47 o 0 3.4     94    ?      ?    1470.2  48.1085      194.856  -131.891    694.269   -131.891     
1 1 1 7  10 47 o 0 514.6   102.6 ?      ?    1003.47 -159.714     1069.32  -159.714    731.355   -159.714     
1 1 1 7  12 47 f 1 218.5   112   ?      ?    1139.19 -152.139     329.452  -152.139    51.6247   27.8609      
1 1 1 7  14 47 o 0 1031.2  138.1 ?      ?    3319.74 -7.93022     1686.88  -7.93022    618.223   -7.93022     
1 1 1 7  16 47 o 0 -127.3  156.5 ?      ?    942.316 -53.0542     85.9788  126.946     383.276   126.946      
1 1 1 7  18 47 o 0 -580.4  169.8 ?      ?    780.458 6.06828      156.332  -173.932    396.727   -173.932     
1 1 1 1  47 8  o 0 1601.5  108.2 ?      ?    4847.39 -114.642     2232.69  -114.642    434.251   -114.642     
1 1 1 3  47 8  o 0 1208.7  102.5 ?      ?    3787.01 50.4166      2010.24  50.4166     622.53    50.4166      
1 1 1 5  47 8  o 0 90.6    92.7  ?      ?    772.478 140.046      10.4222  140.046     266.632   -39.9537     
1 1 1 7  47 8  o 0 235.3   92.6  ?      ?    1801.72 -10.0423     393.395  -10.0423    239.771   169.958      
1 1 1 8  9  47 o 0 48.4    105   ?      ?    950.281 -173.935     39.4149  6.06541     359.814   6.06541      
1 1 1 8  11 47 o 0 1684.8  135.6 ?      ?    4263.03 -127.411     2286.22  -127.411    864.057   -127.411     
1 1 1 8  13 47 o 0 278.3   133.6 ?      ?    1845    59.4196      480.898  59.4196     115.834   -120.58      
1 1 1 8  15 47 o 0 400.2   160.7 ?      ?    1797.14 139.289      749.599  139.289     178.877   139.289      
1 1 1 8  17 47 o 0 -103.9  169.3 ?      ?    2026.62 -102.586     199.711  77.4142     829.222   77.4142      
1 1 1 0  47 9  o 0 654.3   127.3 ?      ?    2447.96 -90          1286.4   -90         377.245   -90          
1 1 1 2  47 9  o 0 3161    143.4 ?      ?    6267.71 161.796      3396.17  161.796     1103.49   161.796      
1 1 1 4  47 9  o 0 3169.2  150.7 ?      ?    7947.24 -29.5756     2760.11  -29.5756    106.014   150.424      
1 1 1 6  47 9  o 0 1214.3  114   ?      ?    3449.7  122.055      2050.79  122.055     829.081   122.055      
1 1 1 8  47 9  o 0 881.2   111.1 ?      ?    4801.95 -152.851     1082.53  -152.851    580.748   27.1488      
1 1 1 9  10 47 f 1 761.3   131   ?      ?    3417.67 73.8473      1240.27  73.8473     92.4717   73.8473      
1 1 1 9  12 47 o 0 844.3   141.7 ?      ?    3221.62 -95.6819     1425.65  -95.6819    363.297   -95.6819     
1 1 1 9  14 47 o 0 1095.4  159.2 ?      ?    3257.69 48.8762      1758.79  48.8762     719.413   48.8762      
1 1 1 9  16 47 o 0 520.4   165.3 ?      ?    2977.18 130.112      788.214  130.112     142.568   -49.8883     
1 1 1 1  47 10 o 0 94.3    100.6 ?      ?    1286.57 47.4887      0.231162 47.4887     470.848   -132.511     
1 1 1 3  47 10 f 1 933.3   112.1 ?      ?    4221.4  140.405      1396.85  140.405     139.161   -39.5945     
1 1 1 5  47 10 o 0 4001.2  186   ?      ?    6901.05 -42.7738     3778.65  -42.7738    1321.22   -42.7738     
1 1 1 7  47 10 o 0 2312.8  146.7 ?      ?    5538.83 93.9644      2671     93.9644     737.652   93.9644      
1 1 1 9  47 10 f 1 537.4   121.1 ?      ?    990.129 -116.514     1121.04  -116.514    781.738   -116.514     
1 1 1 10 11 47 o 0 1662.1  150   ?      ?    4766.03 79.7283      2085.03  79.7283     511.838   79.7283      
1 1 1 10 13 47 o 0 2423.1  179.7 ?      ?    4019.38 -83.605      3054.83  -83.605     1768.87   -83.605      
1 1 1 10 15 47 o 0 212.6   172   ?      ?    3126.95 86.5708      64.9311  86.5708     917.149   -93.4292     
1 1 1 0  47 11 o 0 -202    152.2 ?      ?    3034.19 90           133.962  90          975.442   -90          
1 1 1 2  47 11 o 0 40.6    110.1 ?      ?    1525.42 -41.2941     110.225  138.706     662.666   138.706      
1 1 1 4  47 11 o 0 478.5   117.6 ?      ?    1763.26 144.691      1117.11  144.691     487.205   144.691      
1 1 1 6  47 11 o 0 718.6   121.8 ?      ?    3465.36 -129.277     1215.43  -129.277    0.782756  50.7234      
1 1 1 8  47 11 o 0 2048.4  151   ?      ?    6692.07 35.2596      1978.14  35.2596     319.9     -144.74      
1 1 1 10 47 11 o 0 323.7   127.9 ?      ?    1634.84 156.19       644.339  156.19      97.2991   156.19       
1 1 1 11 12 47 o 0 121.8   142.1 ?      ?    797.617 -9.7329      106.551  -9.7329     148.87    170.267      
1 1 1 11 14 47 o 0 -215.4  157.6 ?      ?    512.697 -145.211     64.7906  34.7889     226.246   34.7889      
1 1 1 11 16 47 o 0 -344.4  184   ?      ?    1905.05 97.5513      294.237  -82.4487    881.95    -82.4487     
1 1 1 1  47 12 o 0 432.3   118.3 ?      ?    2508.66 -115.962     882.462  -115.962    24.7528   64.0379      
1 1 1 3  47 12 o 0 1883.1  134.9 ?      ?    5694.73 50.1981      2210.64  50.1981     174.439   50.1981      
1 1 1 5  47 12 o 0 2266.9  146.7 ?      ?    5212.41 -158.157     2757.78  -158.157    922.591   -158.157     
1 1 1 7  47 12 f 1 267.2   129.7 ?      ?    3219.81 5.43328      178.202  5.43328     939.786   -174.567     
1 1 1 9  47 12 o 0 426.2   132.2 ?      ?    1096.25 -111.203     894.853  -111.203    525.193   -111.203     
1 1 1 11 47 12 o 0 420.7   160.5 ?      ?    1896.84 -30.63       806.824  -30.63      194.945   -30.63       
1 1 1 12 13 47 o 0 -256.9  171   ?      ?    1958.52 100.368      283.423  -79.6323    900.686   -79.6323     
1 1 1 12 15 47 o 0 1150.7  190   ?      ?    4155.15 32.8281      1480.28  32.8281     195.112   32.8281      
1 1 1 0  47 13 o 0 -3.4    166.6 ?      ?    1295.55 -90          128.663  -90         338.028   90           
1 1 1 2  47 13 o 0 121     121.5 ?      ?    1854.46 14.1499      56.8869  14.1499     605.209   -165.85      
1 1 1 4  47 13 o 0 473     125.6 ?      ?    2276.65 -0.576931    1016.29  -0.576931   214.041   -0.576931    
1 1 1 6  47 13 o 0 544.4   129.8 ?      ?    1816.69 -63.3118     1239.38  -63.3118    610.147   -63.3118     
1 1 1 8  47 13 o 0 278.5   141.3 ?      ?    778.082 -138.175     386.701  -138.175    127.218   -138.175     
1 1 1 10 47 13 o 0 715.2   159.3 ?      ?    3264.05 -34.0137     1181.3   -34.0137    120.204   -34.0137     
1 1 1 12 47 13 o 0 392.7   170.3 ?      ?    1763.29 158.298      717.756  158.298     161.352   158.298      
1 1 1 13 14 47 f 1 1460.4  193.2 ?      ?    3956.49 17.7402      1922.8   17.7402     691.317   17.7402      
1 1 1 1  47 14 o 0 393.8   124.2 ?      ?    1853.19 161.968      868.978  161.968     209.929   161.968      
1 1 1 3  47 14 o 0 446.3   132   ?      ?    4353.64 -125.277     372.374  -125.277    1159.44   54.7235      
1 1 1 5  47 14 o 0 380.9   135.6 ?      ?    2057.9  -63.2483     777.48   -63.2483    64.1097   -63.2483     
1 1 1 7  47 14 o 0 1288    159.1 ?      ?    4092.73 1.35128      1889.04  1.35128     519.854   1.35128      
1 1 1 9  47 14 o 0 1210.2  159.5 ?      ?    3467.16 148.452      1907.68  148.452     774.379   148.452      
1 1 1 11 47 14 o 0 167.2   167   ?      ?    1641.43 -112.116     222.63   -112.116    299.38    67.8839      
1 1 1 13 47 14 f 1 456.1   192   ?      ?    3838.5  -142.14      326.99   -142.14     862.229   37.8604      
1 1 1 0  47 15 o 0 204.8   196.9 ?      ?    2416.89 90           453.487  90          400.513   -90          
1 1 1 2  47 15 o 0 709.1   135.9 ?      ?    2584.12 95.5839      1443     95.5839     537.375   95.5839      
1 1 1 4  47 15 f 1 485     146.7 ?      ?    2794.32 168.795      898.708  168.795     57.9718   -11.2047     
1 1 1 6  47 15 o 0 406.8   163.6 ?      ?    2959.2  -98.7777     595.079  -98.7777    395.701   81.2223      
1 1 1 8  47 15 o 0 13.7    151.5 ?      ?    2023.68 -13.8003     104.471  166.2       768.039   166.2        
1 1 1 10 47 15 o 0 404.9   178.4 ?      ?    2831.45 138.088      565.89   138.088     339.54    -41.9118     
1 1 1 12 47 15 o 0 -240.7  184.3 ?      ?    2812.33 82.6572      427.173  -97.3428    1300.44   -97.3428     
1 1 1 1  47 16 o 0 147.5   152.1 ?      ?    741.293 -43.7142     155.173  -43.7142    98.7178   136.286      
1 1 1 3  47 16 o 0 -62     159   ?      ?    2281.86 -28.921      233.453  151.079     1007.21   151.079      
1 1 1 5  47 16 o 0 251.2   150.3 ?      ?    3573.27 87.1437      36.7899  87.1437     1157.73   -92.8563     
1 1 1 7  47 16 o 0 77.6    170.8 ?      ?    1939.07 158.725      50.5489  158.725     585.794   -21.2754     
1 1 1 9  47 16 o 0 -3.7    164.7 ?      ?    623.775 91.7478      9.60482  91.7478     190.5     -88.2522     
1 1 1 11 47 16 o 0 172.8   189.7 ?      ?    549.775 -94.6232     129.952  -94.6232    41.7129   85.3768      
1 1 1 0  47 17 o 0 310.3   231.6 ?      ?    697.744 90           231.916  90          4.90997   -90          
1 1 1 2  47 17 o 0 305     168.2 ?      ?    1985    -160.895     525.031  -160.895    143.726   19.1046      
1 1 1 4  47 17 o 0 -75.5   165.8 ?      ?    2047.47 -108.275     181.814  71.7247     863.541   71.7247      
1 1 1 6  47 17 o 0 -328.8  178   ?      ?    1450.52 5.02663      221.334  -174.973    696.608   -174.973     
1 1 1 8  47 17 o 0 -155.8  182.7 ?      ?    850.374 117.349      61.1691  -62.6508    334.194   -62.6508     
1 1 1 1  47 18 o 0 16.4    172.3 ?      ?    1783.55 121.504      20.6011  -58.496     616.084   -58.496      
1 1 1 3  47 18 f 1 -138    190.8 ?      ?    1603.26 142.206      113.561  -37.7945    646.932   -37.7945     
1 1 1 5  47 18 o 0 -7.3    175.5 ?      ?    726.982 148.091      14.8562  148.091     222.395   -31.9088     
1 1 1 7  47 18 o 0 -103.6  207.4 ?      ?    2220.5  -15.1422     163.291  164.858     875.109   164.858      
1 1 1 0  47 19 f 1 65.2    257.4 ?      ?    1460.8  90           208.704  90          276.083   -90          
1 1 1 2  47 19 o 0 1130    197.5 ?      ?    4253.58 115.439      1499.85  115.439     105.375   115.439      
1 1 1 4  47 19 o 0 1120.9  202.7 ?      ?    3405.55 -64.7795     1700.54  -64.7795    596.312   -64.7795     
1 1 1 0  48 0  o 0 656.6   189.4 ?      ?    4303.08 0            1139.41  0           370.73    180          
1 1 1 0  2  48 o 0 1027.5  156.5 ?      ?    3637.69 -180         1429.2   180         257.271   180          
1 1 1 0  4  48 o 0 -153    140.3 ?      ?    861.103 8.81054e-14  37.9897  0           240.51    -180         
1 1 1 0  6  48 f 1 -107.1  146   ?      ?    174.577 4.8397e-13   9.62374  0           47.1563   -180         
1 1 1 0  8  48 o 0 310.5   158.8 ?      ?    868.205 -5.55005e-14 307.987  0           28.303    5.48443e-13  
1 1 1 0  10 48 o 0 376.2   161.2 ?      ?    1241.33 180          521.463  180         124.732   180          
1 1 1 0  12 48 o 0 39.1    182.1 ?      ?    1171.61 180          126.723  180         237.238   -4.32781e-15 
1 1 1 0  14 48 o 0 1056    212.4 ?      ?    2517.15 180          1376.43  180         606.788   -180         
1 1 1 0  16 48 o 0 1561.8  246.8 ?      ?    7252.72 -2.19742e-15 1653.83  0           520.133   180          
1 1 1 1  48 1  o 0 -100.5  95.4  ?      ?    1307.4  -149.881     274.069  30.119      732.674   30.119       
1 1 1 1  3  48 o 0 197.3   91.7  ?      ?    3018.35 16.7239      15.2002  16.7239     963.45    -163.276     
1 1 1 1  5  48 o 0 13.6    95.5  ?      ?    1537.36 -122.073     177.897  57.9268     677.281   57.9268      
1 1 1 1  7  48 o 0 904.2   114.4 ?      ?    3034.21 14.7708      1546.05  14.7708     562.462   14.7708      
1 1 1 1  9  48 o 0 115.5   112.1 ?      ?    1094.74 -140.055     77.8603  -140.055    274.898   39.945       
1 1 1 1  11 48 o 0 492.4   116.1 ?      ?    1881.92 173.09       1038.67  173.09      438.243   173.09       
1 1 1 1  13 48 o 0 598.9   131.6 ?      ?    2392.8  139.522      1135.95  139.522     395.393   139.522      
1 1 1 1  15 48 o 0 222.5   142.7 ?      ?    1387.99 46.2605      312.026  46.2605     109.951   -133.739     
1 1 1 0  48 2  o 0 -186.4  140.4 ?      ?    1002.83 -1.17352e-14 43.528   0           311.455   180          
1 1 1 2  48 2  o 0 -154.3  93.2  ?      ?    861.274 141.197      202.128  -38.8032    503.531   -38.8032     
1 1 1 2  4  48 o 0 736.8   102.6 ?      ?    2849.77 -11.3008     1328.26  -11.3008    400.289   -11.3008     
1 1 1 2  6  48 o 0 -32.3   101.3 ?      ?    2206.43 -126.695     350.981  53.3046     1069.32   53.3046      
1 1 1 2  8  48 o 0 645.8   108.3 ?      ?    2170.52 -44.0904     1311.33  -44.0904    607.571   -44.0904     
1 1 1 2  10 48 o 0 907.4   121.7 ?      ?    3544.65 157.453      1410.27  157.453     270.133   157.453      
1 1 1 2  12 48 o 0 1644.9  143.1 ?      ?    4155.76 56.9         2181.56  56.9        882.349   56.9         
1 1 1 2  14 48 o 0 219.1   135.5 ?      ?    2684.5  -38.6281     163.82   -38.6281    662.22    141.372      
1 1 1 2  16 48 o 0 -350.1  153.8 ?      ?    3676    155.579      752.789  -24.4211    1861.73   -24.4211     
1 1 1 1  48 3  o 0 -182.9  99.8  ?      ?    1344.24 -13.5092     320.786  166.491     795.495   166.491      
1 1 1 3  48 3  o 0 581.4   102.2 ?      ?    2619.75 -163.103     1173.38  -163.103    260.464   -163.103     
1 1 1 3  5  48 f 1 327.8   104.2 ?      ?    1909.42 -81.8087     619.533  -81.8087    7.12516   98.1913      
1 1 1 3  7  48 o 0 -119    101.9 ?      ?    1203.46 141.311      227.445  -38.689     619.314   -38.689      
1 1 1 3  9  48 f 1 735.4   114.2 ?      ?    4559.73 15.6698      842.101  15.6698     641.912   -164.33      
1 1 1 3  11 48 o 0 179.8   124   ?      ?    1431.86 29.4824      237.862  29.4824     220.916   -150.518     
1 1 1 3  13 48 f 1 193.9   139.5 ?      ?    3978.95 -11.4702     214.909  168.53      1458.54   168.53       
1 1 1 3  15 48 o 0 1743.5  168.2 ?      ?    5261.16 -135.856     1907.82  -135.856    301.594   -135.856     
1 1 1 0  48 4  o 0 -350.2  143.3 ?      ?    1505.43 -180         44.9792  180         490.3     8.35151e-14  
1 1 1 2  48 4  o 0 -110.7  103.1 ?      ?    1367.82 -62.4893     275.122  117.511     756.112   117.511      
1 1 1 4  48 4  o 0 1568.6  114.8 ?      ?    3919.46 170.741      2338.61  170.741     981.042   170.741      
1 1 1 4  6  48 o 0 -46.1   107.3 ?      ?    1537.38 -14.7668     219.975  165.233     721.76    165.233      
1 1 1 4  8  48 o 0 43.9    106.6 ?      ?    2578.97 -81.5372     275.684  98.4628     1113.84   98.4628      
1 1 1 4  10 48 o 0 -8.3    113.4 ?      ?    1063.6  -15.7231     88.0485  164.277     430.913   164.277      
1 1 1 4  12 48 o 0 852.2   131.6 ?      ?    4162.52 -103.185     1149.2   -103.185    154.871   76.8155      
1 1 1 4  14 48 o 0 262.1   156.3 ?      ?    1657.92 136.596      410.003  136.596     101.201   -43.4042     
1 1 1 4  16 48 f 1 -308.4  166.6 ?      ?    1054.14 154.886      159.435  -25.1143    479.887   -25.1143     
1 1 1 1  48 5  o 0 -65.1   106.8 ?      ?    2603.5  -46.2086     505.654  133.791     1427.43   133.791      
1 1 1 3  48 5  f 1 1598.5  124.7 ?      ?    3932.86 142.796      2380.76  142.796     998.426   142.796      
1 1 1 5  48 5  o 0 -46.7   101.5 ?      ?    2183.42 -32.7886     383.375  147.211     1133.67   147.211      
1 1 1 5  7  48 o 0 133.9   107.6 ?      ?    2371.06 -116.521     18.0755  63.479      790.451   63.479       
1 1 1 5  9  48 o 0 353.4   116.3 ?      ?    2309.72 85.2724      629.661  85.2724     118.01    -94.7276     
1 1 1 5  11 48 o 0 488.1   137   ?      ?    1694.21 173.797      1025.38  173.797     491.389   173.797      
1 1 1 5  13 48 o 0 582     144   ?      ?    1654.59 -128.521     1190.17  -128.521    675.934   -128.521     
1 1 1 5  15 48 o 0 368.8   163.4 ?      ?    2558.95 26.4726      513.027  26.4726     268.153   -153.527     
1 1 1 0  48 6  f 1 624.3   159.9 ?      ?    4138.2  -180         1192.62  180         287.463   3.04591e-14  
1 1 1 2  48 6  o 0 1015    115.3 ?      ?    3493.34 -9.28293     1724.61  -9.28293    495.346   -9.28293     
1 1 1 4  48 6  o 0 1436.2  121.7 ?      ?    4692.62 110.866      1928.9   110.866     301.774   110.866      
1 1 1 6  48 6  o 0 18.5    106.8 ?      ?    1170.72 33.6705      94.3423  -146.33     492.721   -146.33      
1 1 1 6  8  48 o 0 1950.7  137.4 ?      ?    4283.12 -127.311     2508.26  -127.311    1118.64   -127.311     
1 1 1 6  10 48 o 0 1072.3  135.3 ?      ?    4259.12 58.9067      1446.8   58.9067     76.4253   58.9067      
1 1 1 6  12 48 o 0 540.1   144.5 ?      ?    2616.26 25.5245      971.991  25.5245     154.017   25.5245      
1 1 1 6  14 48 o 0 -68.8   151.6 ?      ?    2059.97 -141.772     202.548  38.2281     836.351   38.2281      
1 1 1 1  48 7  o 0 110.6   110.5 ?      ?    849.426 164.131      64.923   164.131     235.328   -15.8687     
1 1 1 3  48 7  o 0 1088.4  117.1 ?      ?    3104.55 -19.1452     1938.21  -19.1452    854.429   -19.1452     
1 1 1 5  48 7  o 0 2403.3  135.6 ?      ?    5555.29 71.965       2722.74  71.965      815.277   71.965       
1 1 1 7  48 7  o 0 1468.7  126.7 ?      ?    5130.84 -152.745     1781.6   -152.745    55.8438   -152.745     
1 1 1 7  9  48 o 0 872.8   137.2 ?      ?    3701.46 -3.80808     1311.66  -3.80808    118.071   -3.80808     
1 1 1 7  11 48 o 0 586     135.7 ?      ?    3347.26 -100.864     904.019  -100.864    146.737   79.1357      
1 1 1 7  13 48 o 0 26.7    147.2 ?      ?    846.619 120.192      9.90957  120.192     252.113   -59.8083     
1 1 1 7  15 48 f 1 1.6     165.8 ?      ?    3479.45 5.58746      405.892  -174.413    1469.47   -174.413     
1 1 1 0  48 8  o 0 257.7   155.4 ?      ?    3042.02 -180         587.732  180         489.874   1.05205e-13  
1 1 1 2  48 8  o 0 445.4   113.5 ?      ?    1497.76 -136.022     1035.9   -136.022    510.7     -136.022     
1 1 1 4  48 8  o 0 1089.5  125.5 ?      ?    4463.78 -7.59652     1513.75  -7.59652    29.2981   172.403      
1 1 1 6  48 8  o 0 551.7   119.5 ?      ?    1223.13 75.4543      1222.2   75.4543     807.088   75.4543      
1 1 1 8  48 8  o 0 326     126   ?      ?    972.216 136.174      574.69   136.174     252.073   136.174      
1 1 1 8  10 48 o 0 215.4   147.4 ?      ?    3311.07 -54.1916     22.8197  -54.1916    1018.82   125.808      
1 1 1 8  12 48 o 0 1085.7  161.4 ?      ?    5218.37 173.377      1161.51  173.377     459.961   -6.62324     
1 1 1 8  14 48 o 0 54.3    184.3 ?      ?    2223.03 -40.2818     29.7908  139.718     709.433   139.718      
1 1 1 1  48 9  o 0 2042.9  136.2 ?      ?    5767.67 176.932      2333.68  176.932     306.855   176.932      
1 1 1 3  48 9  f 1 181.7   128.5 ?      ?    2277.13 22.8946      156.764  22.8946     638.378   -157.105     
1 1 1 5  48 9  o 0 415.8   128.9 ?      ?    3183.03 -98.6358     632.369  -98.6358    455.189   81.3642      
1 1 1 7  48 9  o 0 807.9   130.6 ?      ?    2430.91 -169.331     1591.59  -169.331    777.644   -169.331     
1 1 1 9  48 9  o 0 247.1   147.7 ?      ?    920.478 90.4652      339.733  90.4652     43.8755   90.4652      
1 1 1 9  11 48 o 0 708.3   157.7 ?      ?    3358.99 51.5225      1097.2   51.5225     51.3171   51.5225      
1 1 1 9  13 48 o 0 1672.5  197.3 ?      ?    5189.43 -167.201     1830.72  -167.201    237.996   -167.201     
1 1 1 0  48 10 o 0 -39.9   165.3 ?      ?    775.904 1.52556e-13  68.2478  0           204.344   -180         
1 1 1 2  48 10 o 0 549.5   128.1 ?      ?    2656.58 138.926      1094.01  138.926     169.616   138.926      
1 1 1 4  48 10 o 0 329.4   136.6 ?      ?    2872.06 -57.4377     452.728  -57.4377    532.942   122.562      
1 1 1 6  48 10 o 0 588.7   148.8 ?      ?    3357.23 103.43       944.988  103.43      186.701   -76.5699     
1 1 1 8  48 10 o 0 -8.9    147.3 ?      ?    1568.54 130.439      76.9791  -49.5607    585.694   -49.5607     
1 1 1 10 48 10 o 0 802.4   163.2 ?      ?    4021.44 -4.52746     1090.66  -4.52746    179.761   175.473      
1 1 1 10 12 48 o 0 235.8   166.6 ?      ?    1635.03 -96.7348     338.218  -96.7348    164.597   83.2652      
1 1 1 1  48 11 o 0 1037.8  129.1 ?      ?    3196.28 36.7629      1835.31  36.7629     723.419   36.7629      
1 1 1 3  48 11 o 0 332.5   126.3 ?      ?    1889.53 -118.031     668.149  -118.031    18.3109   -118.031     
1 1 1 5  48 11 o 0 663.6   142.9 ?      ?    1966.9  -59.2728     1423     -59.2728    767.952   -59.2728     
1 1 1 7  48 11 o 0 885.9   152.1 ?      ?    3238.08 25.6495      1493.08  25.6495     435.805   25.6495      
1 1 1 9  48 11 o 0 82.7    156.5 ?      ?    1201.17 -94.2962     83.6817  -94.2962    299.227   85.7038      
1 1 1 11 48 11 o 0 -149.7  169.6 ?      ?    1795.46 70.8151      189.076  -109.185    745.506   -109.185     
1 1 1 0  48 12 o 0 1419.6  211.5 ?      ?    5139.24 -2.64604e-14 1816.11  0           62.3835   7.43855e-13  
1 1 1 2  48 12 o 0 451.7   141.6 ?      ?    2832.73 127.98       782.45   127.98      175.542   -52.0202     
1 1 1 4  48 12 o 0 765.4   154.9 ?      ?    2964.21 -79.6487     1392.5   -79.6487    403.241   -79.6487     
1 1 1 6  48 12 o 0 285.7   152.1 ?      ?    1714.87 114.763      489.761  114.763     72.6488   -65.2369     
1 1 1 8  48 12 o 0 95.1    171.5 ?      ?    1415.8  -103.039     121.592  -103.039    332.794   76.9607      
1 1 1 10 48 12 o 0 104.4   181.1 ?      ?    3278.49 -85.0534     163.686  94.9466     1189      94.9466      
1 1 1 1  48 13 o 0 -41.5   148.5 ?      ?    282.367 95.2424      11.0522  -84.7576    106.285   -84.7576     
1 1 1 3  48 13 f 1 490.2   158.3 ?      ?    1893.16 106.102      1004.8   106.102     369.598   106.102      
1 1 1 5  48 13 o 0 97.6    167.7 ?      ?    1552.62 -152.747     113.008  -152.747    397.256   27.2528      
1 1 1 7  48 13 o 0 199.9   167.7 ?      ?    3340.01 -27.6152     11.6143  152.385     1088.32   152.385      
1 1 1 9  48 13 o 0 945.2   186   ?      ?    4117.15 87.699       1247.27  87.699      49.0959   -92.301      
1 1 1 0  48 14 o 0 -28.6   210.7 ?      ?    1891.75 -180         189.12   180         445.575   8.27843e-15  
1 1 1 2  48 14 o 0 -16.2   155.6 ?      ?    1183.14 -27.3944     32.3978  152.606     426.066   152.606      
1 1 1 4  48 14 o 0 1771.4  183.8 ?      ?    4340.12 71.0609      2356.97  71.0609     931.017   71.0609      
1 1 1 6  48 14 o 0 4569.8  238   ?      ?    6919.04 -167.422     3905.06  -167.422    1669.91   -167.422     
1 1 1 8  48 14 o 0 1283.4  194.4 ?      ?    3556.76 -44.2851     1864.74  -44.2851    739.814   -44.2851     
1 1 1 1  48 15 o 0 -232.4  168.5 ?      ?    123.845 116.707      14.7956  -63.2933    55.7876   -63.2933     
1 1 1 3  48 15 o 0 410.1   163.3 ?      ?    1651.41 25.5984      795.97   25.5984     254.874   25.5984      
1 1 1 5  48 15 o 0 28.8    185.8 ?      ?    1488.08 -138.42      40.2701  -138.42     440.305   41.5801      
1 1 1 7  48 15 f 1 640     203.2 ?      ?    3673.62 81.5829      749.024  81.5829     421.905   -98.4171     
1 1 1 0  48 16 o 0 -432.1  259.5 ?      ?    872.27  180          53.7081  180         232.766   -5.35857e-14 
1 1 1 2  48 16 o 0 61.3    183   ?      ?    1569.82 -10.5315     58.8783  -10.5315    452.806   169.469      
1 1 1 4  48 16 f 1 183.5   193.3 ?      ?    3394.43 139.182      92.3338  -40.8184    1191.76   -40.8184     
1 1 1 0  1  49 o 0 -114    176.9 ?      ?    194.494 -90          12.8608  -90         46.4325   90           
1 1 1 0  3  49 o 0 220.4   170.7 ?      ?    639.347 -90          148.069  -90         47.9991   90           
1 1 1 0  5  49 o 0 525     180.6 ?      ?    2188.72 90           867.042  90          194.47    90           
1 1 1 0  7  49 o 0 760     182.4 ?      ?    1768.58 -90          1091.62  -90         558.074   -90          
1 1 1 0  9  49 o 0 261.6   199.4 ?      ?    92.5574 90           24.3365  90          3.42361   -90          
1 1 1 0  11 49 o 0 426.8   202.8 ?      ?    1714.54 90           598.524  90          89.3066   90           
1 1 1 0  13 49 o 0 -566.7  230.9 ?      ?    445.213 -90          16.9855  -90         113.434   90           
1 1 1 0  49 1  o 0 2336.1  224.5 ?      ?    5195.13 90           2277.56  90          530.078   90           
1 1 1 1  2  49 f 1 1184.4  134.6 ?      ?    2746.53 -93.5998     1913.28  -93.5998    1064.63   -93.5998     
1 1 1 1  4  49 o 0 245.6   130.7 ?      ?    2614.18 -77.7623     251.269  -77.7623    555.062   102.238      
1 1 1 1  6  49 o 0 212.9   124.9 ?      ?    2078.65 80.2769      259.899  80.2769     381.238   -99.7231     
1 1 1 1  8  49 o 0 401     136.2 ?      ?    2121.92 3.22425      717.295  3.22425     76.0597   3.22425      
1 1 1 1  10 49 f 1 -102    137.6 ?      ?    994.701 169.345      105.183  -10.6555    405.11    -10.6555     
1 1 1 1  12 49 o 0 -115.3  153.1 ?      ?    3178.35 -30.3693     459.934  149.631     1401.73   149.631      
1 1 1 1  49 2  f 1 1459.7  142.6 ?      ?    2182.47 -38.1446     2584.01  -38.1446    1846.69   -38.1446     
1 1 1 2  3  49 o 0 1711.3  143.8 ?      ?    5251.88 146.674      1866.18  146.674     243.302   146.674      
1 1 1 2  5  49 o 0 218.8   121.6 ?      ?    3306.8  -25.0731     26.7693  -25.0731    996.93    154.927      
1 1 1 2  7  49 o 0 271.7   133.7 ?      ?    991.719 -38.3678     393.044  -38.3678    91.6816   -38.3678     
1 1 1 2  9  49 o 0 258.4   142.5 ?      ?    2481.13 -102.562     293.181  -102.562    456.313   77.4378      
1 1 1 2  11 49 f 1 24.8    145.7 ?      ?    2157.15 177.896      116.427  -2.10427    765.307   -2.10427     
1 1 1 2  13 49 o 0 252.2   168.1 ?      ?    3087.9  -53.7921     103.034  -53.7921    807.962   126.208      
1 1 1 0  49 3  o 0 1991.7  199.3 ?      ?    5197.29 -90          2118.55  -90         358.664   -90          
1 1 1 2  49 3  o 0 1423.9  136.2 ?      ?    4738.96 83.1143      1837.11  83.1143     250.146   83.1143      
1 1 1 3  4  49 o 0 905     129.8 ?      ?    4086.8  -47.9928     1209.57  -47.9928    57.8211   132.007      
1 1 1 3  6  49 o 0 1376.7  144.4 ?      ?    2263.72 157.706      2277.25  157.706     1586.87   157.706      
1 1 1 3  8  49 o 0 395.1   133.1 ?      ?    2965.01 149.172      546.312  149.172     354.267   -30.828      
1 1 1 3  10 49 o 0 90.8    144.7 ?      ?    951.678 -69.7196     72.5987  -69.7196    214.17    110.28       
1 1 1 3  12 49 o 0 917.5   163.6 ?      ?    3981.95 -173.704     1196.69  -173.704    10.9495   -173.704     
1 1 1 1  49 4  o 0 637.2   128.1 ?      ?    2140.57 -70.9891     1352.53  -70.9891    629.991   -70.9891     
1 1 1 3  49 4  o 0 5.5     133.6 ?      ?    2557.03 -130.644     258.461  49.356      1110.44   49.356       
1 1 1 4  5  49 o 0 536.7   134.1 ?      ?    3580.96 107.089      735.552  107.089     358.401   -72.9113     
1 1 1 4  7  49 o 0 788.4   135   ?      ?    2538.69 6.40841      1415.92  6.40841     642.102   6.40841      
1 1 1 4  9  49 o 0 378.1   141.1 ?      ?    1818.38 -125.172     684.138  -125.172    133.239   -125.172     
1 1 1 4  11 49 o 0 -71.5   158   ?      ?    2504.4  44.2361      263.609  -135.764    1014.82   -135.764     
1 1 1 4  13 49 f 1 -311.2  173.6 ?      ?    1747.33 172.679      262.043  -7.32147    781.879   -7.32147     
1 1 1 0  49 5  o 0 767.4   190.4 ?      ?    2333.46 90           1258     90          465.89    90           
1 1 1 2  49 5  o 0 1355.1  141.1 ?      ?    4433    175.678      1847.35  175.678     358.53    175.678      
1 1 1 4  49 5  o 0 102.6   130.7 ?      ?    2446.24 85.4012      57.5324  -94.5988    853.714   -94.5988     
1 1 1 5  6  49 o 0 1313.5  144   ?      ?    5203.76 -71.5875     1453.14  -71.5875    135.603   108.413      
1 1 1 5  8  49 o 0 -161.8  142.9 ?      ?    2442.29 124.229      377.422  -55.7706    1119.91   -55.7706     
1 1 1 5  10 49 o 0 366.2   151.7 ?      ?    2207.04 62.7604      594.119  62.7604     71.4324   -117.24      
1 1 1 5  12 49 o 0 953.3   176.8 ?      ?    3855.46 -2.80861     1250.73  -2.80861    101.919   -2.80861     
1 1 1 1  49 6  o 0 956.3   141.9 ?      ?    2366.48 38.4303      1856.88  38.4303     1057.6    38.4303      
1 1 1 3  49 6  o 0 427.6   130.1 ?      ?    2408.59 82.4627      836.584  82.4627     46.4017   82.4627      
1 1 1 5  49 6  o 0 160.5   129.9 ?      ?    1809.48 -150.664     165.597  -150.664    418.187   29.3362      
1 1 1 6  7  49 o 0 463.1   143.8 ?      ?    3282.99 -125.162     609.717  -125.162    389.905   54.8375      
1 1 1 6  9  49 o 0 852.8   150.3 ?      ?    3891.98 69.645       1167.29  69.6451     10.3509   -110.355     
1 1 1 6  11 49 o 0 743.2   164.6 ?      ?    1599.67 -57.4039     1397.32  -57.4039    918.163   -57.4039     
1 1 1 0  49 7  o 0 248.9   209.8 ?      ?    1892.44 90           424.387  90          206.389   -90          
1 1 1 2  49 7  o 0 700.7   133.3 ?      ?    2928.69 -67.8739     1287.58  -67.8739    321.321   -67.8739     
1 1 1 4  49 7  o 0 681.6   140.4 ?      ?    3422.65 -1.89445     1098.21  -1.89445    14.8398   178.106      
1 1 1 6  49 7  o 0 59.7    135.9 ?      ?    1769.46 -36.274      32.949   143.726     597.776   143.726      
1 1 1 7  8  49 o 0 1175    156.5 ?      ?    4641.33 163.349      1415.17  163.349     8.70242   163.349      
1 1 1 7  10 49 o 0 1534    171   ?      ?    5869.83 -39.8713     1471.27  -39.8713    292.778   140.129      
1 1 1 1  49 8  o 0 2798.4  177.1 ?      ?    5750.33 92.264       2993.18  92.264      1089.71   92.264       
1 1 1 3  49 8  o 0 1433.3  155.8 ?      ?    4523.18 -143.79      1905.67  -143.79     426.386   -143.79      
1 1 1 5  49 8  o 0 542.5   148.5 ?      ?    2889.78 -38.0797     939.335  -38.0797    9.51801   -38.0797     
1 1 1 7  49 8  o 0 2327.1  172.8 ?      ?    4872.35 108.014      2681.28  108.014     1145.34   108.014      
1 1 1 8  9  49 o 0 743.5   172.2 ?      ?    2314.14 -64.8306     1326.01  -64.8306    629.57    -64.8306     
1 1 1 8  11 49 o 0 -86.2   186.8 ?      ?    2101.53 -64.9996     158.763  115         784.731   115          
1 1 1 0  49 9  o 0 138.5   191.6 ?      ?    2887.74 -90          372.985  -90         583.778   90           
1 1 1 2  49 9  o 0 1070.8  150.3 ?      ?    3421    65.3196      1735.22  65.3196     612.686   65.3196      
1 1 1 4  49 9  o 0 306.1   152.1 ?      ?    1732.67 -147.106     536.636  -147.106    24.0315   32.894       
1 1 1 6  49 9  o 0 624.5   162.8 ?      ?    1535.11 64.9944      1285.69  64.9944     797.895   64.9944      
1 1 1 8  49 9  o 0 820.4   177.5 ?      ?    4516.79 76.756       941.59   76.756      461.908   -103.244     
1 1 1 9  10 49 f 1 2389.2  216.2 ?      ?    4953.37 -122.38      2502.39  -122.38     1016.69   -122.38      
1 1 1 1  49 10 f 1 260.4   153.1 ?      ?    1912.68 -21.7763     411.192  -21.7763    220.537   158.224      
1 1 1 3  49 10 o 0 595.2   158   ?      ?    2886.04 72.3791      1050.09  72.3791     113.1     72.3791      
1 1 1 5  49 10 o 0 1199.9  171   ?      ?    4271.2  -113.906     1620.42  -113.906    255.473   -113.906     
1 1 1 7  49 10 o 0 988.2   176.8 ?      ?    4302.5  34.0478      1267.33  34.0478     80.3382   -145.952     
1 1 1 9  49 10 f 1 155.3   183.4 ?      ?    2732.63 24.9652      9.03472  24.9652     831.073   -155.035     
1 1 1 0  49 11 o 0 1777    247.8 ?      ?    6871.25 -90          1948.4   -90         304.846   90           
1 1 1 2  49 11 f 1 -41.8   154.9 ?      ?    2107.76 53.293       183.946  -126.707    872.757   -126.707     
1 1 1 4  49 11 o 0 4.3     173.9 ?      ?    1224.25 -143.4       17.5167  -143.4      375.02    36.5996      
1 1 1 6  49 11 o 0 -88.3   185.6 ?      ?    2611.86 43.2393      255.864  -136.761    1078.65   -136.761     
1 1 1 8  49 11 o 0 -174.8  193.7 ?      ?    2153.22 -122.296     226.431  57.7037     890.012   57.7037      
1 1 1 1  49 12 o 0 2219.5  185.7 ?      ?    5831.82 -145.714     2347.2   -145.714    454.968   -145.714     
1 1 1 3  49 12 o 0 -452.6  175.5 ?      ?    1591.72 -9.59483     294.199  170.405     805.039   170.405      
1 1 1 5  49 12 o 0 -434.3  171.9 ?      ?    2635.98 -102.816     522.961  77.1843     1356.12   77.1843      
1 1 1 0  49 13 o 0 896.3   247.8 ?      ?    3697.5  90           1276.68  90          81.7874   90           
1 1 1 2  49 13 o 0 -174.3  189.9 ?      ?    2046.26 123.786      224.18   -56.2142    879.911   -56.2142     
1 1 1 4  49 13 f 1 -77.4   180.4 ?      ?    459.307 65.8737      12.7372  -114.126    158.872   -114.126     
1 1 1 0  50 0  o 0 7228.9  601.8 ?      ?    9751.75 -1.63362e-14 3755.6   0           696.188   7.17899e-14  
1 1 1 0  2  50 o 0 1982.7  258.3 ?      ?    6435.38 -180         1794.22  180         42.6173   1.96675e-12  
1 1 1 0  4  50 f 1 -430.1  228.1 ?      ?    1473.26 -180         65.5842  180         359.011   6.39337e-14  
1 1 1 0  6  50 o 0 774.8   237.8 ?      ?    987.742 -1.34969e-13 794.373  0           511.264   7.47382e-14  
1 1 1 0  8  50 o 0 -477    238.2 ?      ?    1376.48 -5.66635e-14 59.6501  0           333.389   180          
1 1 1 1  50 1  o 0 -91.7   161.6 ?      ?    2264.73 -146.798     237.79   33.2017     948.159   33.2017      
1 1 1 1  3  50 o 0 1311.4  175.1 ?      ?    4216.77 43.5186      1604.09  43.5186     391.845   43.5186      
1 1 1 1  5  50 o 0 1108.9  167.3 ?      ?    4639.82 -177.607     1253.77  -177.607    82.778    2.39345      
1 1 1 1  7  50 o 0 394.9   168.2 ?      ?    1631.7  -112.275     649.003  -112.275    179.862   -112.275     
1 1 1 1  9  50 o 0 -530.4  187.2 ?      ?    1805.96 -70.7868     307.086  109.213     823.33    109.213      
1 1 1 0  50 2  o 0 58.5    227.2 ?      ?    282.708 -4.39763e-13 40.1322  0           49.3502   180          
1 1 1 2  50 2  o 0 45.4    158   ?      ?    2497.04 99.9855      118.563  -80.0145    900.15    -80.0145     
1 1 1 2  4  50 o 0 -368.3  164.5 ?      ?    853.682 -60.2313     130.956  119.769     377.615   119.769      
1 1 1 2  6  50 o 0 981.1   167.6 ?      ?    4150.02 80.1249      1212.7   80.1249     13.6309   80.1249      
1 1 1 2  8  50 o 0 468.2   174.6 ?      ?    3177.93 -101.8       529.746  -101.8      384.881   78.2         
1 1 1 1  50 3  o 0 4.8     157.7 ?      ?    2279.43 -87.3063     138.882  92.6937     858.867   92.6937      
1 1 1 3  50 3  o 0 775.6   161.5 ?      ?    3230.7  73.4089      1242.45  73.4089     235.263   73.4089      
1 1 1 3  5  50 o 0 653     167.1 ?      ?    3698.49 -55.0689     834.746  -55.0689    237.01    124.931      
1 1 1 3  7  50 o 0 -239.9  165.6 ?      ?    2926.89 0.21543      458.731  -179.785    1305.17   -179.785     
1 1 1 0  50 4  f 1 416.6   221.4 ?      ?    3311.63 180          730.859  180         328.207   -1.62743e-14 
1 1 1 2  50 4  o 0 2281.1  183   ?      ?    4876.44 -19.356      2624.46  -19.356     1090.29   -19.356      
1 1 1 4  50 4  o 0 2509.7  189.3 ?      ?    5316.57 164.764      2664.33  164.764     1016.6    164.764      
1 1 1 4  6  50 o 0 -276.7  156   ?      ?    490.621 -87.402      69.2883  92.598      211.578   92.598       
1 1 1 4  8  50 o 0 963.8   174.3 ?      ?    4142    -21.4806     1154.76  -21.4806    41.6441   158.519      
1 1 1 1  50 5  o 0 -315.6  178.4 ?      ?    1733.81 -77.4625     256.826  102.537     806.017   102.537      
1 1 1 3  50 5  o 0 -68.7   157.7 ?      ?    1169.98 -17.064      71.1667  162.936     437.1     162.936      
1 1 1 5  50 5  o 0 3676.8  208.4 ?      ?    7083.81 63.2506      3054.67  63.2506     876.236   63.2506      
1 1 1 5  7  50 o 0 1421.6  184.7 ?      ?    4674.81 -169.428     1583.52  -169.428    229.467   -169.428     
1 1 1 0  50 6  o 0 81.8    239.1 ?      ?    2097.77 2.813e-15    277.411  0           390.019   -180         
1 1 1 2  50 6  o 0 258.2   164.6 ?      ?    1127.31 -127.008     379.956  -127.008    24.9552   -127.008     
1 1 1 4  50 6  o 0 1211.8  171.8 ?      ?    4571.73 -80.6488     1493.56  -80.6488    74.6951   -80.6488     
1 1 1 6  50 6  o 0 601.6   174.6 ?      ?    3439.77 -29.5429     797.458  -29.5429    250.187   150.457      
1 1 1 1  50 7  o 0 38.7    165.6 ?      ?    2248.69 -7.04682     79.6297  172.953     790.935   172.953      
1 1 1 3  50 7  o 0 1517.2  179.9 ?      ?    4347.56 137.253      1936.7   137.253     578.136   137.253      
1 1 1 5  50 7  o 0 736.4   181.2 ?      ?    3790.73 -100.145     949.901  -100.145    215.308   79.8546      
1 1 1 0  50 8  o 0 -146.8  237.4 ?      ?    851.676 -1.12134e-13 72.0214  0           197.935   180          
1 1 1 2  50 8  o 0 -513.9  173.5 ?      ?    1387.06 -157.763     268.028  22.2369     703.424   22.2369      
1 1 1 4  50 8  o 0 968.1   180.2 ?      ?    3671.93 64.2842      1362.89  64.2842     226.407   64.2842      
1 1 1 1  50 9  o 0 -227.5  175.1 ?      ?    846.058 -12.5227     98.5457  167.477     364.677   167.477      
1 1 1 0  1  1  x 0 ?       ?     ?      ?    ?       ?            18159.6  -90         ?         ?            
1 1 1 0  1  3  x 0 ?       ?     ?      ?    ?       ?            2100.78  90          ?         ?            
1 1 1 0  2  0  x 0 ?       ?     ?      ?    ?       ?            14988.7  180         ?         ?            
1 1 1 0  2  2  x 0 ?       ?     ?      ?    ?       ?            2067.86  -2.0149e-13 ?         ?            
1 1 1 0  3  1  x 0 ?       ?     ?      ?    ?       ?            5194.46  -90         ?         ?            
1 1 1 0  3  3  x 0 ?       ?     ?      ?    ?       ?            2421.15  90          ?         ?            
1 1 1 0  4  0  x 0 ?       ?     ?      ?    ?       ?            1689.22  -180        ?         ?            
1 1 1 0  4  2  x 0 ?       ?     ?      ?    ?       ?            77.5125  8.89111e-12 ?         ?            
1 1 1 0  5  1  x 0 ?       ?     ?      ?    ?       ?            1017.54  90          ?         ?            
1 1 1 0  6  0  x 0 ?       ?     ?      ?    ?       ?            4497.23  -180        ?         ?            
1 1 1 0  45 23 x 0 ?       ?     ?      ?    ?       ?            160.961  -90         ?         ?            
1 1 1 1  2  1  x 0 ?       ?     ?      ?    ?       ?            7995.12  108.226     ?         ?            
1 1 1 1  2  3  x 0 ?       ?     ?      ?    ?       ?            3221.3   160.974     ?         ?            
1 1 1 1  3  2  x 0 ?       ?     ?      ?    ?       ?            772.166  -56.0388    ?         ?            
1 1 1 2  2  2  x 0 ?       ?     ?      ?    ?       ?            7451.51  -94.7305    ?         ?            
1 1 1 2  4  2  x 0 ?       ?     ?      ?    ?       ?            1527.49  93.1363     ?         ?            
1 1 1 3  4  3  x 0 ?       ?     ?      ?    ?       ?            1354.6   1.50824     ?         ?            
# 
#END OF REFLECTIONS
