data_r1xejsf
# 
loop_
_audit.revision_id 
_audit.creation_date 
_audit.update_record 
1_0 1998-01-16 'Initial release'        
1_1 2013-12-11 'Format standardization' 
# 
_cell.entry_id      1xej 
_cell.length_a      26.345 
_cell.length_b      55.885 
_cell.length_c      31.550 
_cell.angle_alpha   90.000 
_cell.angle_beta    109.980 
_cell.angle_gamma   90.000 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   1.54180 
# 
_entry.id   1xej 
# 
_exptl_crystal.id   1 
# 
_reflns_scale.group_code   1 
# 
_symmetry.entry_id               1xej 
_symmetry.space_group_name_H-M   'P 1 21 1' 
# 
#
loop_
_refln.crystal_id
_refln.wavelength_id
_refln.scale_group_code
_refln.index_h
_refln.index_k
_refln.index_l
_refln.status
_refln.F_meas_au
_refln.F_meas_sigma_au
1 1 1    0    0    3  o   1793.0   19.0 
1 1 1    0    0    4  o   3170.0   21.0 
1 1 1    0    0    5  o   1225.0   22.0 
1 1 1    0    0    6  o   1644.0   58.0 
1 1 1    0    0    7  o   2876.0   88.0 
1 1 1    0    0    8  o   1666.0   47.0 
1 1 1    0    0    9  o   5345.0  126.0 
1 1 1    0    0   11  o   1193.0  139.0 
1 1 1    0    0   12  o   1077.0  111.0 
1 1 1    0    0   13  o   1278.0  122.0 
1 1 1    1    0    3  o   5371.0   23.0 
1 1 1    1    0    4  o    343.0   76.0 
1 1 1   -1    0    4  o   3357.0   59.0 
1 1 1    1    0    5  o   2603.0   54.0 
1 1 1   -1    0    5  o   1215.0   42.0 
1 1 1    1    0    6  o    951.0   88.0 
1 1 1   -1    0    6  o   2393.0   83.0 
1 1 1    1    0    7  o   4496.0   77.0 
1 1 1   -1    0    7  o   2005.0   97.0 
1 1 1    1    0    8  o   4284.0  131.0 
1 1 1   -1    0    8  o    822.0   95.0 
1 1 1   -1    0    9  o   1458.0   57.0 
1 1 1   -1    0   10  o    858.0   87.0 
1 1 1    1    0   11  o   1227.0   51.0 
1 1 1    1    0   12  o    757.0  112.0 
1 1 1    1    0   13  o   1034.0  132.0 
1 1 1   -1    0   13  o   1602.0   64.0 
1 1 1   -1    0   14  o    717.0  158.0 
1 1 1    2    0    2  o  11287.0  133.0 
1 1 1    2    0    3  o   2389.0   36.0 
1 1 1   -2    0    3  o   3336.0   61.0 
1 1 1    2    0    4  o    753.0  136.0 
1 1 1   -2    0    4  o   5044.0   22.0 
1 1 1    2    0    5  o   2611.0   30.0 
1 1 1   -2    0    5  o    602.0   40.0 
1 1 1    2    0    6  o   5105.0   75.0 
1 1 1   -2    0    6  o   4523.0   43.0 
1 1 1    2    0    7  o   2068.0   37.0 
1 1 1   -2    0    7  o   4948.0   59.0 
1 1 1    2    0    8  o   1255.0   73.0 
1 1 1   -2    0    8  o   2646.0   46.0 
1 1 1    2    0    9  o   1533.0   40.0 
1 1 1   -2    0    9  o   2677.0   47.0 
1 1 1    2    0   10  o    607.0  101.0 
1 1 1   -2    0   10  o    681.0   91.0 
1 1 1    2    0   11  o   1906.0   37.0 
1 1 1   -2    0   11  o   2196.0   50.0 
1 1 1    2    0   12  o   1055.0  126.0 
1 1 1   -2    0   12  o   2080.0   65.0 
1 1 1    3    0    0  o  10524.0   48.0 
1 1 1    3    0    1  o   4652.0   50.0 
1 1 1   -3    0    1  o    948.0   34.0 
1 1 1    3    0    2  o   5986.0   29.0 
1 1 1   -3    0    2  o   1165.0   40.0 
1 1 1    3    0    3  o   3299.0   55.0 
1 1 1   -3    0    3  o   4347.0   31.0 
1 1 1    3    0    4  o   4685.0   73.0 
1 1 1   -3    0    4  o   8911.0   77.0 
1 1 1    3    0    5  o   1881.0   71.0 
1 1 1   -3    0    5  o   3706.0   68.0 
1 1 1    3    0    6  o    808.0   94.0 
1 1 1   -3    0    6  o   3321.0   52.0 
1 1 1    3    0    7  o   3040.0   79.0 
1 1 1   -3    0    7  o   1147.0   41.0 
1 1 1    3    0    8  o   1361.0  106.0 
1 1 1   -3    0    8  o   3739.0   28.0 
1 1 1    3    0    9  o   1888.0   56.0 
1 1 1   -3    0    9  o   2774.0   74.0 
1 1 1    3    0   10  o   2432.0   47.0 
1 1 1   -3    0   10  o   3742.0   85.0 
1 1 1    3    0   11  o   1617.0  137.0 
1 1 1   -3    0   11  o   1109.0   73.0 
1 1 1    3    0   12  o   1800.0  139.0 
1 1 1   -3    0   12  o    803.0  130.0 
1 1 1   -3    0   13  o   1119.0  120.0 
1 1 1   -3    0   14  o   1359.0   81.0 
1 1 1    4    0    0  o    591.0   35.0 
1 1 1   -4    0    1  o    706.0   42.0 
1 1 1    4    0    2  o   2026.0   31.0 
1 1 1   -4    0    2  o   3701.0   37.0 
1 1 1    4    0    3  o   6660.0   63.0 
1 1 1   -4    0    3  o   6438.0   63.0 
1 1 1   -4    0    4  o   1030.0   28.0 
1 1 1    4    0    5  o    846.0   93.0 
1 1 1   -4    0    5  o   3829.0   55.0 
1 1 1    4    0    6  o   1782.0   98.0 
1 1 1   -4    0    6  o   2031.0   70.0 
1 1 1   -4    0    7  o   3881.0   66.0 
1 1 1    4    0    8  o   1258.0  133.0 
1 1 1   -4    0    8  o   3176.0   72.0 
1 1 1    4    0    9  o   2106.0  137.0 
1 1 1    4    0   10  o   2476.0   98.0 
1 1 1   -4    0   10  o   2493.0  152.0 
1 1 1    4    0   11  o   1534.0  155.0 
1 1 1   -4    0   11  o   1991.0   50.0 
1 1 1   -4    0   12  o   1337.0  131.0 
1 1 1   -4    0   14  o   1377.0  135.0 
1 1 1   -4    0   15  o   1200.0  201.0 
1 1 1    5    0    0  o   6772.0   56.0 
1 1 1    5    0    1  o   1641.0   33.0 
1 1 1   -5    0    1  o   3354.0   32.0 
1 1 1    5    0    2  o   5791.0   29.0 
1 1 1   -5    0    2  o    804.0   68.0 
1 1 1    5    0    3  o    906.0  143.0 
1 1 1   -5    0    3  o    860.0  132.0 
1 1 1    5    0    4  o   1283.0   57.0 
1 1 1   -5    0    4  o   5967.0   36.0 
1 1 1    5    0    5  o   2886.0   76.0 
1 1 1   -5    0    5  o   5628.0  109.0 
1 1 1    5    0    6  o    855.0   66.0 
1 1 1   -5    0    6  o   4798.0   61.0 
1 1 1   -5    0    7  o   1347.0   56.0 
1 1 1   -5    0    8  o   1311.0   72.0 
1 1 1    5    0    9  o   2148.0   73.0 
1 1 1   -5    0    9  o   2382.0   49.0 
1 1 1    5    0   10  o   1971.0   88.0 
1 1 1   -5    0   10  o   3294.0   37.0 
1 1 1   -5    0   11  o   1413.0   64.0 
1 1 1   -5    0   12  o    839.0  116.0 
1 1 1   -5    0   13  o   1223.0  179.0 
1 1 1   -5    0   14  o   1086.0  159.0 
1 1 1    6    0    0  o    562.0   78.0 
1 1 1    6    0    1  o   1371.0   65.0 
1 1 1   -6    0    1  o   3974.0   89.0 
1 1 1   -6    0    2  o   3680.0   50.0 
1 1 1    6    0    3  o   1203.0  135.0 
1 1 1   -6    0    3  o  14581.0   86.0 
1 1 1    6    0    4  o   4036.0   40.0 
1 1 1   -6    0    4  o    816.0   64.0 
1 1 1   -6    0    5  o   4764.0   40.0 
1 1 1    6    0    6  o    874.0   75.0 
1 1 1   -6    0    6  o   6837.0  122.0 
1 1 1    6    0    7  o    855.0   67.0 
1 1 1   -6    0    7  o   1505.0  129.0 
1 1 1    6    0    8  o    600.0  137.0 
1 1 1   -6    0    8  o   1191.0  123.0 
1 1 1    6    0    9  o   1275.0   98.0 
1 1 1   -6    0    9  o   2293.0   40.0 
1 1 1   -6    0   10  o   1401.0  110.0 
1 1 1   -6    0   11  o   2790.0   50.0 
1 1 1    7    0    0  o   2388.0   79.0 
1 1 1    7    0    1  o    624.0  110.0 
1 1 1   -7    0    1  o   7441.0   68.0 
1 1 1    7    0    2  o   2841.0   45.0 
1 1 1    7    0    3  o   2958.0   57.0 
1 1 1   -7    0    3  o    914.0  157.0 
1 1 1    7    0    4  o   1508.0  108.0 
1 1 1   -7    0    4  o   1806.0   79.0 
1 1 1    7    0    5  o   1395.0   69.0 
1 1 1   -7    0    5  o   1467.0   71.0 
1 1 1    7    0    6  o    562.0   92.0 
1 1 1   -7    0    6  o   1460.0   69.0 
1 1 1    7    0    7  o   1365.0   88.0 
1 1 1   -7    0    7  o    755.0   76.0 
1 1 1    7    0    8  o    828.0  121.0 
1 1 1   -7    0    8  o   1642.0   84.0 
1 1 1   -7    0    9  o   1433.0   54.0 
1 1 1   -7    0   10  o   1584.0   94.0 
1 1 1   -7    0   11  o   1124.0   72.0 
1 1 1   -7    0   12  o    608.0  134.0 
1 1 1   -7    0   13  o   1986.0   55.0 
1 1 1    8    0    1  o    950.0  154.0 
1 1 1   -8    0    1  o   1270.0  117.0 
1 1 1    8    0    2  o   2011.0  137.0 
1 1 1    8    0    3  o    528.0  119.0 
1 1 1   -8    0    3  o   2312.0   42.0 
1 1 1    8    0    4  o   2175.0  101.0 
1 1 1   -8    0    4  o   3836.0   55.0 
1 1 1   -8    0    5  o   2252.0   83.0 
1 1 1    8    0    6  o    854.0  112.0 
1 1 1   -8    0    6  o   1765.0   35.0 
1 1 1    8    0    7  o    576.0  142.0 
1 1 1   -8    0    7  o   1000.0  176.0 
1 1 1   -8    0    9  o    662.0  104.0 
1 1 1   -8    0   10  o   1208.0   55.0 
1 1 1   -8    0   13  o   1144.0   89.0 
1 1 1   -8    0   14  o    859.0  204.0 
1 1 1   -9    0    1  o   1818.0  109.0 
1 1 1    9    0    2  o   1256.0  126.0 
1 1 1   -9    0    2  o   1972.0   62.0 
1 1 1    9    0    3  o    880.0  152.0 
1 1 1    9    0    4  o   1761.0   77.0 
1 1 1   -9    0    4  o   1694.0   87.0 
1 1 1    9    0    5  o    762.0  125.0 
1 1 1   -9    0    5  o   1069.0   72.0 
1 1 1   -9    0    6  o   1777.0   66.0 
1 1 1   -9    0    7  o    665.0   90.0 
1 1 1   -9    0    9  o    978.0  119.0 
1 1 1   -9    0   11  o    802.0   71.0 
1 1 1   -9    0   12  o   1276.0   56.0 
1 1 1   10    0    2  o   1772.0  110.0 
1 1 1   10    0    3  o   1016.0  113.0 
1 1 1  -10    0    4  o    936.0  111.0 
1 1 1  -10    0    8  o   1122.0   77.0 
1 1 1  -10    0   10  o    607.0   88.0 
1 1 1  -10    0   11  o    669.0  135.0 
1 1 1   11    0    1  o    937.0   75.0 
1 1 1  -11    0    1  o   1128.0   90.0 
1 1 1  -11    0    3  o    497.0  114.0 
1 1 1  -11    0    6  o   1124.0   93.0 
1 1 1  -11    0    7  o    811.0  101.0 
1 1 1  -12    0    3  o    922.0  181.0 
1 1 1  -12    0    4  o   1546.0  152.0 
1 1 1  -12    0    5  o    943.0  174.0 
1 1 1  -12    0    7  o   1162.0  211.0 
1 1 1    0    1    3  o   3121.0   18.0 
1 1 1    0    1    4  o   7632.0   42.0 
1 1 1    0    1    5  o   2963.0   28.0 
1 1 1    0    1    6  o   3314.0   51.0 
1 1 1    0    1    7  o   4921.0   24.0 
1 1 1    0    1    8  o   2715.0   57.0 
1 1 1    0    1    9  o   1576.0   37.0 
1 1 1    0    1   10  o   1387.0   38.0 
1 1 1    0    1   11  o   1208.0   75.0 
1 1 1    0    1   12  o    709.0   68.0 
1 1 1    1    1    3  o   3003.0   14.0 
1 1 1    1    1    4  o   1765.0   17.0 
1 1 1   -1    1    4  o  10141.0   32.0 
1 1 1    1    1    5  o   1470.0   34.0 
1 1 1   -1    1    5  o   7488.0   27.0 
1 1 1    1    1    6  o   3968.0   32.0 
1 1 1   -1    1    6  o   4189.0   31.0 
1 1 1    1    1    7  o   2422.0   27.0 
1 1 1   -1    1    7  o   3811.0   47.0 
1 1 1    1    1    8  o   3586.0   28.0 
1 1 1   -1    1    8  o   2850.0   50.0 
1 1 1    1    1    9  o    943.0   45.0 
1 1 1   -1    1    9  o   1338.0   60.0 
1 1 1    1    1   10  o    996.0   40.0 
1 1 1   -1    1   10  o   1255.0   49.0 
1 1 1    1    1   11  o   1364.0   34.0 
1 1 1   -1    1   11  o   1161.0   58.0 
1 1 1    1    1   12  o   1124.0   73.0 
1 1 1   -1    1   12  o   1520.0   37.0 
1 1 1    1    1   13  o    954.0   83.0 
1 1 1   -1    1   13  o   1507.0   49.0 
1 1 1   -1    1   14  o   1239.0   61.0 
1 1 1    2    1    2  o   4101.0   18.0 
1 1 1    2    1    3  o   1806.0   23.0 
1 1 1   -2    1    3  o   5730.0   38.0 
1 1 1    2    1    4  o   3785.0   54.0 
1 1 1   -2    1    4  o   4174.0   24.0 
1 1 1    2    1    5  o   3765.0   17.0 
1 1 1   -2    1    5  o   5729.0   25.0 
1 1 1    2    1    6  o   5990.0   33.0 
1 1 1   -2    1    6  o   4513.0   26.0 
1 1 1    2    1    7  o   2774.0   22.0 
1 1 1   -2    1    7  o   5855.0   36.0 
1 1 1    2    1    8  o   1160.0   44.0 
1 1 1   -2    1    8  o   5938.0   48.0 
1 1 1    2    1    9  o   1787.0   50.0 
1 1 1   -2    1    9  o   4279.0   49.0 
1 1 1    2    1   10  o   2883.0   24.0 
1 1 1   -2    1   10  o   1847.0   48.0 
1 1 1    2    1   11  o    820.0   59.0 
1 1 1   -2    1   11  o   1170.0   80.0 
1 1 1    2    1   12  o    705.0  147.0 
1 1 1   -2    1   12  o    811.0   63.0 
1 1 1   -2    1   13  o   1589.0   46.0 
1 1 1   -2    1   14  o    901.0   91.0 
1 1 1    3    1    0  o   3522.0   17.0 
1 1 1    3    1    1  o   6949.0   18.0 
1 1 1   -3    1    1  o   2645.0   12.0 
1 1 1    3    1    2  o   2005.0   32.0 
1 1 1   -3    1    2  o   3119.0   12.0 
1 1 1    3    1    3  o   3542.0   23.0 
1 1 1   -3    1    3  o   5238.0   15.0 
1 1 1    3    1    4  o   4578.0   47.0 
1 1 1   -3    1    4  o   2277.0   26.0 
1 1 1    3    1    5  o   1643.0   57.0 
1 1 1   -3    1    5  o   1570.0   26.0 
1 1 1    3    1    6  o   1481.0   40.0 
1 1 1   -3    1    6  o   4221.0   35.0 
1 1 1    3    1    7  o    436.0  108.0 
1 1 1   -3    1    7  o   3729.0   20.0 
1 1 1    3    1    8  o   1462.0   81.0 
1 1 1   -3    1    8  o   1788.0   55.0 
1 1 1    3    1    9  o   1538.0   55.0 
1 1 1   -3    1    9  o    707.0   72.0 
1 1 1    3    1   10  o    886.0  145.0 
1 1 1   -3    1   10  o   1972.0   46.0 
1 1 1    3    1   11  o   1310.0   86.0 
1 1 1   -3    1   11  o   1490.0   68.0 
1 1 1   -3    1   12  o    602.0  132.0 
1 1 1   -3    1   13  o   1749.0   51.0 
1 1 1   -3    1   14  o   1343.0   73.0 
1 1 1    4    1    0  o   4613.0   30.0 
1 1 1    4    1    1  o   1858.0   28.0 
1 1 1   -4    1    1  o    901.0   34.0 
1 1 1    4    1    2  o   8660.0   30.0 
1 1 1   -4    1    2  o   1387.0   15.0 
1 1 1    4    1    3  o   4076.0   27.0 
1 1 1   -4    1    3  o   7639.0   22.0 
1 1 1    4    1    4  o   4000.0   30.0 
1 1 1   -4    1    4  o   2271.0   27.0 
1 1 1    4    1    5  o   2970.0   41.0 
1 1 1   -4    1    5  o   3820.0   21.0 
1 1 1    4    1    6  o   5067.0   46.0 
1 1 1   -4    1    6  o   3800.0   26.0 
1 1 1    4    1    7  o   2814.0   54.0 
1 1 1   -4    1    7  o   5066.0   33.0 
1 1 1    4    1    8  o    439.0  106.0 
1 1 1   -4    1    8  o   1902.0   44.0 
1 1 1    4    1    9  o   1902.0   75.0 
1 1 1   -4    1    9  o    542.0  105.0 
1 1 1    4    1   10  o    832.0  108.0 
1 1 1   -4    1   10  o   4261.0   42.0 
1 1 1    4    1   11  o   1050.0  216.0 
1 1 1   -4    1   11  o   3307.0   32.0 
1 1 1   -4    1   12  o   2049.0   42.0 
1 1 1   -4    1   13  o   1102.0   89.0 
1 1 1   -4    1   14  o   1076.0   81.0 
1 1 1   -4    1   15  o   1285.0  177.0 
1 1 1    5    1    0  o   3958.0   18.0 
1 1 1    5    1    1  o   7653.0   57.0 
1 1 1   -5    1    1  o   1506.0   38.0 
1 1 1    5    1    2  o   2904.0   30.0 
1 1 1   -5    1    2  o   4784.0  193.0 
1 1 1    5    1    3  o   5835.0   55.0 
1 1 1   -5    1    3  o   5477.0   58.0 
1 1 1    5    1    4  o   3674.0   56.0 
1 1 1   -5    1    4  o   5123.0   81.0 
1 1 1    5    1    5  o   2973.0   44.0 
1 1 1   -5    1    5  o   1692.0   51.0 
1 1 1    5    1    6  o   3170.0   46.0 
1 1 1   -5    1    6  o   3377.0   30.0 
1 1 1    5    1    7  o   1367.0   58.0 
1 1 1   -5    1    7  o   3036.0   26.0 
1 1 1    5    1    8  o    875.0  103.0 
1 1 1   -5    1    8  o   2054.0   46.0 
1 1 1    5    1    9  o   1049.0   88.0 
1 1 1   -5    1    9  o   4828.0   50.0 
1 1 1    5    1   10  o    905.0   90.0 
1 1 1   -5    1   10  o   2432.0   72.0 
1 1 1   -5    1   12  o   1990.0   84.0 
1 1 1   -5    1   13  o    939.0   69.0 
1 1 1   -5    1   14  o   1236.0   69.0 
1 1 1   -5    1   15  o   1476.0  189.0 
1 1 1    6    1    0  o   3418.0   25.0 
1 1 1    6    1    1  o   4191.0   36.0 
1 1 1   -6    1    1  o   7433.0   25.0 
1 1 1    6    1    2  o   1706.0   35.0 
1 1 1   -6    1    2  o   5409.0   17.0 
1 1 1    6    1    3  o   3258.0   69.0 
1 1 1   -6    1    3  o   1966.0   34.0 
1 1 1    6    1    4  o    648.0   82.0 
1 1 1   -6    1    4  o   1981.0   24.0 
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#END OF REFLECTIONS
