data_r3p1xsf
# 
loop_
_audit.revision_id 
_audit.creation_date 
_audit.update_record 
1_0 2010-12-29 'Initial release'        
2_0 2011-11-09 Re-release               
1_2 2013-08-28 'Format standardization' 
# 
_cell.entry_id      3p1x 
_cell.length_a      107.572 
_cell.length_b      24.384 
_cell.length_c      71.626 
_cell.angle_alpha   90.000 
_cell.angle_beta    124.840 
_cell.angle_gamma   90.000 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   0.97900 
# 
_entry.id   3p1x 
# 
_exptl_crystal.id   1 
# 
_reflns_scale.group_code   1 
# 
_symmetry.entry_id               3p1x 
_symmetry.space_group_name_H-M   'C 1 2 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   30   -2  -40 h        0      0 
1 1 1   32   -2  -40 h  16.8600 0.410000 
1 1 1   34   -2  -40 h  7.97000 0.450000 
1 1 1   36   -2  -40 h  6.82000 0.560000 
1 1 1   38   -2  -40 h  7.71000 0.440000 
1 1 1   27   -1  -40 h  3.03000 1.94000 
1 1 1   29   -1  -40 h  3.30000 1.40000 
1 1 1   31   -1  -40 h  4.11000 1.05000 
1 1 1   33   -1  -40 h  5.93000 0.600000 
1 1 1   35   -1  -40 h  14.7100 0.390000 
1 1 1   37   -1  -40 h  7.95000 0.430000 
1 1 1   39   -1  -40 h  8.31000 0.460000 
1 1 1   41   -1  -40 h  4.54000 0.930000 
1 1 1   26    0  -40 h  7.93000 0.540000 
1 1 1   28    0  -40 h  5.14000 0.900000 
1 1 1   30    0  -40 h  9.96000 0.490000 
1 1 1   32    0  -40 h  8.77000 0.460000 
1 1 1   34    0  -40 h        0      0 
1 1 1   36    0  -40 h  9.21000 0.460000 
1 1 1   38    0  -40 h        0      0 
1 1 1   40    0  -40 h  13.2400 0.360000 
1 1 1   42    0  -40 h        0      0 
1 1 1   27    1  -40 h  8.43000 0.560000 
1 1 1   29    1  -40 h        0      0 
1 1 1   31    1  -40 h  6.60000 0.620000 
1 1 1   33    1  -40 h  6.49000 0.710000 
1 1 1   35    1  -40 h  12.9800 0.400000 
1 1 1   37    1  -40 h  8.64000 0.590000 
1 1 1   39    1  -40 h  5.81000 0.780000 
1 1 1   41    1  -40 h  4.70000 0.850000 
1 1 1   30    2  -40 h        0      0 
1 1 1   32    2  -40 h  17.6700 0.390000 
1 1 1   34    2  -40 h  9.85000 0.490000 
1 1 1   36    2  -40 h  7.48000 0.660000 
1 1 1   38    2  -40 h  9.07000 0.470000 
1 1 1   25   -3  -39 h  5.96000 0.570000 
1 1 1   27   -3  -39 h        0      0 
1 1 1   29   -3  -39 h  10.9000 0.340000 
1 1 1   31   -3  -39 h  10.7500 0.410000 
1 1 1   33   -3  -39 h  5.61000 0.560000 
1 1 1   35   -3  -39 h  1.45000 1.45000 
1 1 1   37   -3  -39 h  8.45000 0.420000 
1 1 1   39   -3  -39 h  3.61000 0.980000 
1 1 1   41   -3  -39 h  4.45000 0.830000 
1 1 1   22   -2  -39 h  9.35000 0.460000 
1 1 1   24   -2  -39 h  13.1900 0.370000 
1 1 1   26   -2  -39 h  15.0700 0.410000 
1 1 1   28   -2  -39 h        0      0 
1 1 1   30   -2  -39 h  9.30000 0.420000 
1 1 1   32   -2  -39 h  5.81000 0.600000 
1 1 1   34   -2  -39 h  2.76000 1.57000 
1 1 1   36   -2  -39 h  8.06000 0.380000 
1 1 1   38   -2  -39 h  6.40000 0.840000 
1 1 1   40   -2  -39 h  5.83000 0.560000 
1 1 1   42   -2  -39 h        0      0 
1 1 1   44   -2  -39 h  4.56000 0.830000 
1 1 1   21   -1  -39 h 0.710000 0.710000 
1 1 1   23   -1  -39 h  7.01000 0.620000 
1 1 1   25   -1  -39 h  9.38000 0.430000 
1 1 1   27   -1  -39 h  3.77000 0.900000 
1 1 1   29   -1  -39 h        0      0 
1 1 1   31   -1  -39 h  6.94000 0.510000 
1 1 1   33   -1  -39 h  3.19000 1.43000 
1 1 1   35   -1  -39 h  6.69000 0.510000 
1 1 1   37   -1  -39 h  9.66000 0.480000 
1 1 1   39   -1  -39 h  8.28000 0.440000 
1 1 1   41   -1  -39 h  6.12000 0.670000 
1 1 1   43   -1  -39 h        0      0 
1 1 1   45   -1  -39 h  12.6600 0.420000 
1 1 1   47   -1  -39 h  4.24000 0.970000 
1 1 1   20    0  -39 h  4.79000 0.960000 
1 1 1   22    0  -39 h  16.4200 0.430000 
1 1 1   24    0  -39 h  7.25000 0.650000 
1 1 1   26    0  -39 h  11.5900 0.400000 
1 1 1   28    0  -39 h  10.5500 0.420000 
1 1 1   30    0  -39 h        0      0 
1 1 1   32    0  -39 h        0      0 
1 1 1   34    0  -39 h        0      0 
1 1 1   36    0  -39 h  14.2700 0.390000 
1 1 1   38    0  -39 h  1.82000 1.82000 
1 1 1   40    0  -39 h  13.8100 0.480000 
1 1 1   42    0  -39 h        0      0 
1 1 1   44    0  -39 h  4.59000 0.930000 
1 1 1   46    0  -39 h  9.68000 0.420000 
1 1 1   21    1  -39 h  6.12000 0.810000 
1 1 1   23    1  -39 h  6.90000 0.630000 
1 1 1   25    1  -39 h  7.84000 0.500000 
1 1 1   27    1  -39 h  4.80000 0.850000 
1 1 1   29    1  -39 h  5.91000 0.730000 
1 1 1   31    1  -39 h  7.48000 0.570000 
1 1 1   33    1  -39 h  3.97000 1.22000 
1 1 1   35    1  -39 h  6.32000 0.550000 
1 1 1   37    1  -39 h  10.5700 0.460000 
1 1 1   39    1  -39 h  9.67000 0.480000 
1 1 1   41    1  -39 h  8.36000 0.510000 
1 1 1   43    1  -39 h        0      0 
1 1 1   45    1  -39 h  12.2100 0.450000 
1 1 1   47    1  -39 h  4.64000 1.02000 
1 1 1   22    2  -39 h  10.2400 0.480000 
1 1 1   24    2  -39 h  12.5100 0.420000 
1 1 1   26    2  -39 h  16.3600 0.410000 
1 1 1   28    2  -39 h  4.83000 0.930000 
1 1 1   30    2  -39 h  9.13000 0.560000 
1 1 1   32    2  -39 h  3.90000 1.29000 
1 1 1   34    2  -39 h  3.26000 1.41000 
1 1 1   36    2  -39 h  7.11000 0.660000 
1 1 1   38    2  -39 h  1.22000 1.22000 
1 1 1   40    2  -39 h  5.16000 0.900000 
1 1 1   42    2  -39 h  3.51000 1.10000 
1 1 1   44    2  -39 h  5.97000 0.780000 
1 1 1   25    3  -39 h  7.50000 0.740000 
1 1 1   27    3  -39 h  4.77000 0.860000 
1 1 1   29    3  -39 h  9.12000 0.500000 
1 1 1   31    3  -39 h  11.9400 0.500000 
1 1 1   33    3  -39 h  5.59000 0.850000 
1 1 1   35    3  -39 h  6.00000 0.780000 
1 1 1   37    3  -39 h  8.41000 0.530000 
1 1 1   39    3  -39 h  5.23000 0.740000 
1 1 1   41    3  -39 h        0      0 
1 1 1   24   -4  -38 h  11.3900 0.400000 
1 1 1   26   -4  -38 h  17.2500 0.410000 
1 1 1   28   -4  -38 h  4.01000 0.800000 
1 1 1   30   -4  -38 h  6.94000 0.450000 
1 1 1   32   -4  -38 h  10.0500 0.360000 
1 1 1   34   -4  -38 h  6.16000 0.490000 
1 1 1   36   -4  -38 h  4.63000 0.700000 
1 1 1   38   -4  -38 h  7.59000 0.420000 
1 1 1   40   -4  -38 h  3.78000 0.830000 
1 1 1   42   -4  -38 h  2.98000 1.50000 
1 1 1   19   -3  -38 h  5.79000 0.630000 
1 1 1   21   -3  -38 h  10.0400 0.400000 
1 1 1   23   -3  -38 h  13.4500 0.410000 
1 1 1   25   -3  -38 h  7.88000 0.490000 
1 1 1   27   -3  -38 h  12.5400 0.340000 
1 1 1   29   -3  -38 h  6.98000 0.620000 
1 1 1   31   -3  -38 h 0.550000 0.550000 
1 1 1   33   -3  -38 h  6.35000 0.580000 
1 1 1   35   -3  -38 h  11.2600 0.350000 
1 1 1   37   -3  -38 h  14.1400 0.370000 
1 1 1   39   -3  -38 h  4.40000 1.01000 
1 1 1   41   -3  -38 h  6.77000 0.500000 
1 1 1   43   -3  -38 h  3.62000 0.940000 
1 1 1   45   -3  -38 h  14.0000 0.360000 
1 1 1   18   -2  -38 h  14.6200 0.410000 
1 1 1   20   -2  -38 h  5.41000 0.770000 
1 1 1   22   -2  -38 h  16.3100 0.370000 
1 1 1   24   -2  -38 h  25.4300 0.460000 
1 1 1   26   -2  -38 h  11.5100 0.430000 
1 1 1   28   -2  -38 h  5.59000 0.650000 
1 1 1   30   -2  -38 h  21.0000 0.400000 
1 1 1   32   -2  -38 h  11.0200 0.380000 
1 1 1   34   -2  -38 h  10.9100 0.390000 
1 1 1   36   -2  -38 h  8.56000 0.440000 
1 1 1   38   -2  -38 h  16.0400 0.360000 
1 1 1   40   -2  -38 h  6.32000 0.580000 
1 1 1   42   -2  -38 h  13.9700 0.360000 
1 1 1   44   -2  -38 h  3.15000 1.30000 
1 1 1   46   -2  -38 h  4.22000 0.860000 
1 1 1   48   -2  -38 h  6.31000 0.490000 
1 1 1   17   -1  -38 h  8.19000 0.620000 
1 1 1   19   -1  -38 h  13.3800 0.430000 
1 1 1   21   -1  -38 h  10.8300 0.430000 
1 1 1   23   -1  -38 h  11.4600 0.410000 
1 1 1   25   -1  -38 h  16.8900 0.400000 
1 1 1   27   -1  -38 h  11.0500 0.420000 
1 1 1   29   -1  -38 h  11.9500 0.400000 
1 1 1   31   -1  -38 h  14.6200 0.390000 
1 1 1   33   -1  -38 h  13.3000 0.340000 
1 1 1   35   -1  -38 h  18.5400 0.410000 
1 1 1   37   -1  -38 h  6.38000 0.590000 
1 1 1   39   -1  -38 h  10.1500 0.400000 
1 1 1   41   -1  -38 h  14.6300 0.390000 
1 1 1   43   -1  -38 h  10.1200 0.390000 
1 1 1   45   -1  -38 h  13.2700 0.350000 
1 1 1   47   -1  -38 h  8.62000 0.420000 
1 1 1   49   -1  -38 h        0      0 
1 1 1   16    0  -38 h        0      0 
1 1 1   18    0  -38 h  8.56000 0.540000 
1 1 1   20    0  -38 h  6.39000 0.740000 
1 1 1   22    0  -38 h  7.35000 0.460000 
1 1 1   24    0  -38 h  6.32000 0.670000 
1 1 1   26    0  -38 h  29.3300 0.530000 
1 1 1   28    0  -38 h  20.2400 0.430000 
1 1 1   30    0  -38 h  20.4200 0.420000 
1 1 1   32    0  -38 h  9.87000 0.440000 
1 1 1   34    0  -38 h  18.5900 0.390000 
1 1 1   36    0  -38 h        0      0 
1 1 1   38    0  -38 h        0      0 
1 1 1   40    0  -38 h  10.4900 0.450000 
1 1 1   42    0  -38 h  10.6900 0.450000 
1 1 1   44    0  -38 h  10.7800 0.410000 
1 1 1   46    0  -38 h  4.39000 0.930000 
1 1 1   48    0  -38 h  3.52000 1.26000 
1 1 1   50    0  -38 h  7.94000 0.530000 
1 1 1   17    1  -38 h  5.75000 0.820000 
1 1 1   19    1  -38 h  15.1100 0.400000 
1 1 1   21    1  -38 h  12.4100 0.460000 
1 1 1   23    1  -38 h  11.0900 0.450000 
1 1 1   25    1  -38 h  16.4900 0.410000 
1 1 1   27    1  -38 h  13.1000 0.430000 
1 1 1   29    1  -38 h  10.7700 0.430000 
1 1 1   31    1  -38 h  13.3900 0.420000 
1 1 1   33    1  -38 h  13.9000 0.390000 
1 1 1   35    1  -38 h  16.9100 0.430000 
1 1 1   37    1  -38 h  4.38000 0.780000 
1 1 1   39    1  -38 h  13.2300 0.420000 
1 1 1   41    1  -38 h  16.1600 0.400000 
1 1 1   43    1  -38 h  9.96000 0.420000 
1 1 1   45    1  -38 h  12.8400 0.430000 
1 1 1   47    1  -38 h  8.56000 0.510000 
1 1 1   49    1  -38 h        0      0 
1 1 1   18    2  -38 h  15.0400 0.440000 
1 1 1   20    2  -38 h  8.01000 0.630000 
1 1 1   22    2  -38 h  15.7200 0.410000 
1 1 1   24    2  -38 h  27.4700 0.500000 
1 1 1   26    2  -38 h  13.8400 0.420000 
1 1 1   28    2  -38 h  5.04000 1.04000 
1 1 1   30    2  -38 h  19.5700 0.440000 
1 1 1   32    2  -38 h  10.1400 0.430000 
1 1 1   34    2  -38 h  11.0600 0.450000 
1 1 1   36    2  -38 h  7.14000 0.650000 
1 1 1   38    2  -38 h  16.4000 0.420000 
1 1 1   40    2  -38 h  6.98000 0.680000 
1 1 1   42    2  -38 h  16.2000 0.410000 
1 1 1   44    2  -38 h        0      0 
1 1 1   46    2  -38 h  4.00000 0.950000 
1 1 1   48    2  -38 h  7.55000 0.570000 
1 1 1   19    3  -38 h  5.68000 0.770000 
1 1 1   21    3  -38 h  11.2600 0.370000 
1 1 1   23    3  -38 h  11.2600 0.470000 
1 1 1   25    3  -38 h  5.53000 0.920000 
1 1 1   27    3  -38 h  14.2100 0.410000 
1 1 1   29    3  -38 h  8.65000 0.630000 
1 1 1   31    3  -38 h  2.51000 2.51000 
1 1 1   33    3  -38 h  7.00000 0.720000 
1 1 1   35    3  -38 h  12.2300 0.530000 
1 1 1   37    3  -38 h  13.7600 0.450000 
1 1 1   39    3  -38 h  2.43000 2.43000 
1 1 1   41    3  -38 h  6.69000 0.690000 
1 1 1   43    3  -38 h  3.62000 1.47000 
1 1 1   45    3  -38 h  16.2300 0.430000 
1 1 1   24    4  -38 h  12.8400 0.640000 
1 1 1   26    4  -38 h  21.5300 0.570000 
1 1 1   28    4  -38 h  7.96000 0.590000 
1 1 1   30    4  -38 h  7.91000 0.520000 
1 1 1   32    4  -38 h  10.9800 0.490000 
1 1 1   34    4  -38 h  8.11000 0.630000 
1 1 1   36    4  -38 h  6.68000 0.680000 
1 1 1   38    4  -38 h  8.00000 0.650000 
1 1 1   40    4  -38 h  4.30000 1.22000 
1 1 1   42    4  -38 h  6.00000 0.940000 
1 1 1   23   -5  -37 h  6.43000 0.590000 
1 1 1   25   -5  -37 h  9.69000 0.400000 
1 1 1   27   -5  -37 h  6.62000 0.720000 
1 1 1   29   -5  -37 h  6.25000 0.480000 
1 1 1   31   -5  -37 h  4.63000 0.840000 
1 1 1   33   -5  -37 h  11.0700 0.360000 
1 1 1   35   -5  -37 h  11.4100 0.350000 
1 1 1   37   -5  -37 h  3.10000 0.950000 
1 1 1   39   -5  -37 h  10.0300 0.360000 
1 1 1   41   -5  -37 h  7.54000 0.380000 
1 1 1   18   -4  -37 h  3.83000 1.10000 
1 1 1   20   -4  -37 h  7.49000 0.760000 
1 1 1   22   -4  -37 h  13.8000 0.380000 
1 1 1   24   -4  -37 h  8.50000 0.420000 
1 1 1   26   -4  -37 h  9.48000 0.370000 
1 1 1   28   -4  -37 h  13.9200 0.340000 
1 1 1   30   -4  -37 h        0      0 
1 1 1   32   -4  -37 h  8.68000 0.380000 
1 1 1   34   -4  -37 h  7.59000 0.420000 
1 1 1   36   -4  -37 h  6.92000 0.430000 
1 1 1   38   -4  -37 h  5.37000 0.560000 
1 1 1   40   -4  -37 h  4.29000 0.810000 
1 1 1   42   -4  -37 h  14.4300 0.350000 
1 1 1   44   -4  -37 h  10.5400 0.360000 
1 1 1   46   -4  -37 h  10.3600 0.430000 
1 1 1   15   -3  -37 h  14.3000 0.400000 
1 1 1   17   -3  -37 h  8.44000 0.480000 
1 1 1   19   -3  -37 h  18.1000 0.410000 
1 1 1   21   -3  -37 h  8.14000 0.460000 
1 1 1   23   -3  -37 h  5.17000 0.770000 
1 1 1   25   -3  -37 h  15.5000 0.390000 
1 1 1   27   -3  -37 h  12.3500 0.360000 
1 1 1   29   -3  -37 h  17.8900 0.380000 
1 1 1   31   -3  -37 h  17.4000 0.360000 
1 1 1   33   -3  -37 h  16.8000 0.360000 
1 1 1   35   -3  -37 h  7.82000 0.380000 
1 1 1   37   -3  -37 h  4.12000 0.720000 
1 1 1   39   -3  -37 h  7.75000 0.410000 
1 1 1   41   -3  -37 h  6.44000 0.520000 
1 1 1   43   -3  -37 h  4.57000 0.740000 
1 1 1   45   -3  -37 h        0      0 
1 1 1   47   -3  -37 h  1.76000 1.76000 
1 1 1   49   -3  -37 h  9.42000 0.390000 
1 1 1   14   -2  -37 h  4.28000 1.02000 
1 1 1   16   -2  -37 h  11.9200 0.440000 
1 1 1   18   -2  -37 h  18.7300 0.410000 
1 1 1   20   -2  -37 h  16.2600 0.390000 
1 1 1   22   -2  -37 h  10.8300 0.380000 
1 1 1   24   -2  -37 h  18.5900 0.400000 
1 1 1   26   -2  -37 h  14.0300 0.380000 
1 1 1   28   -2  -37 o  11.6700 0.380000 
1 1 1   30   -2  -37 o  10.6100 0.370000 
1 1 1   32   -2  -37 o  5.11000 0.670000 
1 1 1   34   -2  -37 o  9.06000 0.520000 
1 1 1   36   -2  -37 o  4.44000 0.740000 
1 1 1   38   -2  -37 h  11.1600 0.360000 
1 1 1   40   -2  -37 h  24.2600 0.450000 
1 1 1   42   -2  -37 h  20.2800 0.410000 
1 1 1   44   -2  -37 h  9.43000 0.380000 
1 1 1   46   -2  -37 h  8.14000 0.460000 
1 1 1   48   -2  -37 h  7.33000 0.450000 
1 1 1   50   -2  -37 h  7.96000 0.410000 
1 1 1   13   -1  -37 h  13.2300 0.420000 
1 1 1   15   -1  -37 h  6.14000 0.770000 
1 1 1   17   -1  -37 h  10.1100 0.420000 
1 1 1   19   -1  -37 h  11.8000 0.460000 
1 1 1   21   -1  -37 h  12.1100 0.400000 
1 1 1   23   -1  -37 h  12.3500 0.410000 
1 1 1   25   -1  -37 o  23.8200 0.460000 
1 1 1   27   -1  -37 o  17.0500 0.390000 
1 1 1   29   -1  -37 o  9.41000 0.390000 
1 1 1   31   -1  -37 o  3.48000 1.11000 
1 1 1   33   -1  -37 o  4.94000 0.850000 
1 1 1   35   -1  -37 o  11.5200 0.400000 
1 1 1   37   -1  -37 o  20.6300 0.400000 
1 1 1   39   -1  -37 o  28.5800 0.490000 
1 1 1   41   -1  -37 h  10.7200 0.380000 
1 1 1   43   -1  -37 h  18.0200 0.390000 
1 1 1   45   -1  -37 h  17.2500 0.380000 
1 1 1   47   -1  -37 h  15.4800 0.400000 
1 1 1   49   -1  -37 h  8.56000 0.440000 
1 1 1   51   -1  -37 h  6.08000 0.620000 
1 1 1   12    0  -37 h  7.62000 0.590000 
1 1 1   14    0  -37 h  10.4800 0.490000 
1 1 1   16    0  -37 h        0      0 
1 1 1   18    0  -37 h  8.68000 0.530000 
1 1 1   20    0  -37 h  14.9700 0.440000 
1 1 1   22    0  -37 h  25.2100 0.460000 
1 1 1   24    0  -37 o  13.6600 0.430000 
1 1 1   26    0  -37 o  17.3500 0.400000 
1 1 1   28    0  -37 o  13.8200 0.400000 
1 1 1   30    0  -37 o  4.77000 0.930000 
1 1 1   32    0  -37 o  13.9500 0.370000 
1 1 1   34    0  -37 o  11.9700 0.410000 
1 1 1   36    0  -37 o  18.9800 0.390000 
1 1 1   38    0  -37 o  4.68000 0.920000 
1 1 1   40    0  -37 o  29.4200 0.490000 
1 1 1   42    0  -37 h  5.92000 0.730000 
1 1 1   44    0  -37 h  3.03000 0.940000 
1 1 1   46    0  -37 h  20.1700 0.410000 
1 1 1   48    0  -37 h  11.5400 0.390000 
1 1 1   50    0  -37 h  2.07000 2.07000 
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1 1 1   45   -5  -36 h        0      0 
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1 1 1   16   -4  -36 h  3.90000 1.07000 
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1 1 1   31    3  -36 <        0      0 
1 1 1   33    3  -36 < 0.550000 0.550000 
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1 1 1   28    4  -36 h        0      0 
1 1 1   30    4  -36 h  10.9800 0.460000 
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1 1 1   46    4  -36 h        0      0 
1 1 1   48    4  -36 h  6.77000 0.730000 
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1 1 1   39    5  -36 h  14.4700 0.460000 
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1 1 1   43    5  -36 h        0      0 
1 1 1   45    5  -36 h  5.73000 1.48000 
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1 1 1   26    6  -36 h        0      0 
1 1 1   28    6  -36 h  2.10000 2.10000 
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1 1 1   32    6  -36 h  4.38000 1.52000 
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1 1 1   36    6  -36 h  6.20000 0.950000 
1 1 1   38    6  -36 h        0      0 
1 1 1   29   -7  -35 h  5.81000 0.430000 
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1 1 1   18   -6  -35 h  5.54000 0.660000 
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1 1 1   30   -6  -35 h  4.80000 0.540000 
1 1 1   32   -6  -35 h  2.32000 1.43000 
1 1 1   34   -6  -35 h  4.46000 0.580000 
1 1 1   36   -6  -35 h  7.52000 0.360000 
1 1 1   38   -6  -35 h  6.02000 0.440000 
1 1 1   40   -6  -35 h  7.52000 0.330000 
1 1 1   42   -6  -35 h  9.47000 0.340000 
1 1 1   13   -5  -35 h  5.15000 0.780000 
1 1 1   15   -5  -35 h        0      0 
1 1 1   17   -5  -35 h  13.2500 0.400000 
1 1 1   19   -5  -35 h  8.75000 0.450000 
1 1 1   21   -5  -35 h  8.31000 0.450000 
1 1 1   23   -5  -35 h        0      0 
1 1 1   25   -5  -35 h  11.1000 0.340000 
1 1 1   27   -5  -35 h  5.59000 0.530000 
1 1 1   29   -5  -35 h  1.90000 1.90000 
1 1 1   31   -5  -35 h  11.8400 0.330000 
1 1 1   33   -5  -35 h  4.98000 0.540000 
1 1 1   35   -5  -35 h  9.97000 0.350000 
1 1 1   37   -5  -35 h  12.5600 0.290000 
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1 1 1   41   -5  -35 h  6.59000 0.450000 
1 1 1   43   -5  -35 h  6.14000 0.410000 
1 1 1   45   -5  -35 h  13.0600 0.340000 
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1 1 1   16   -4  -35 h  9.55000 0.440000 
1 1 1   18   -4  -35 h  12.5500 0.370000 
1 1 1   20   -4  -35 h  1.79000 1.79000 
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1 1 1   30   -4  -35 o  8.46000 0.390000 
1 1 1   32   -4  -35 o  13.7700 0.410000 
1 1 1   34   -4  -35 <        0      0 
1 1 1   36   -4  -35 o  8.26000 0.380000 
1 1 1   38   -4  -35 o  8.91000 0.400000 
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1 1 1   51   -3  -35 h  6.63000 0.450000 
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1 1 1   30   -4  -19 o  8.56000 0.300000 
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1 1 1   28   -2  -15 o  34.9200 0.610000 
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1 1 1   27    1   14 <        0      0 
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1 1 1    1   -5   19 o  35.9500 0.600000 
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1 1 1   27   -1   19 h        0      0 
1 1 1    2    0   19 o  32.6400 0.560000 
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1 1 1    8    0   19 o  12.5900 0.380000 
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1 1 1   12    0   19 <        0      0 
1 1 1   14    0   19 o  33.1800 0.580000 
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1 1 1   18    0   19 o  4.62000 0.760000 
1 1 1   20    0   19 o  13.5000 0.420000 
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1 1 1   23    1   19 o  8.83000 0.560000 
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1 1 1   27    1   19 h        0      0 
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1 1 1   19    3   19 o  29.5800 0.600000 
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1 1 1    1    5   19 o  39.7200 0.680000 
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1 1 1   17    5   19 o  20.2500 0.470000 
1 1 1   19    5   19 o  6.80000 0.710000 
1 1 1   21    5   19 h  3.61000 1.44000 
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1 1 1    8    6   19 o  25.1700 0.500000 
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1 1 1    5   -9   20 h  7.78000 0.370000 
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1 1 1    9   -9   20 h  2.10000 2.10000 
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1 1 1    4    0   20 o  53.6100 0.850000 
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1 1 1   10    0   20 o  14.7300 0.400000 
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1 1 1   23    3   20 h        0      0 
1 1 1   25    3   20 h  22.0800 0.510000 
1 1 1    2    4   20 o  7.02000 0.490000 
1 1 1    4    4   20 o  12.9500 0.380000 
1 1 1    6    4   20 f  22.1500 0.450000 
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1 1 1    9    5   20 o  19.9500 0.450000 
1 1 1   11    5   20 o  18.7900 0.420000 
1 1 1   13    5   20 <        0      0 
1 1 1   15    5   20 o  7.73000 0.650000 
1 1 1   17    5   20 o  12.3100 0.470000 
1 1 1   19    5   20 h  10.0800 0.460000 
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1 1 1    4    6   20 o  18.4400 0.380000 
1 1 1    6    6   20 o  17.1000 0.390000 
1 1 1    8    6   20 o  15.2400 0.420000 
1 1 1   10    6   20 o  22.6200 0.480000 
1 1 1   12    6   20 o  16.7100 0.460000 
1 1 1   14    6   20 o  9.80000 0.520000 
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1 1 1   20    6   20 h  6.50000 0.800000 
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1 1 1    3    7   20 o  17.4200 0.410000 
1 1 1    5    7   20 o  15.1600 0.390000 
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1 1 1    9    7   20 o  7.28000 0.640000 
1 1 1   11    7   20 o  8.51000 0.520000 
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1 1 1   15    7   20 h  7.71000 0.600000 
1 1 1   17    7   20 h  6.06000 1.20000 
1 1 1    2    8   20 <        0      0 
1 1 1    4    8   20 o  5.84000 0.760000 
1 1 1    6    8   20 o  9.76000 0.500000 
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1 1 1    1    9   20 o  13.2400 0.380000 
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1 1 1    7    9   20 h  8.04000 0.530000 
1 1 1    9    9   20 h        0      0 
1 1 1   11    9   20 h  4.97000 0.970000 
1 1 1    2   10   20 h  2.85000 2.85000 
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1 1 1   15   -1   26 h        0      0 
1 1 1    2    0   26 o  13.7700 0.410000 
1 1 1    4    0   26 o  22.1200 0.450000 
1 1 1    6    0   26 o  30.8700 0.560000 
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1 1 1    9    1   26 f  21.5000 0.500000 
1 1 1   11    1   26 o  14.1100 0.470000 
1 1 1   13    1   26 h  9.18000 0.520000 
1 1 1   15    1   26 h  6.04000 0.830000 
1 1 1    2    2   26 o  13.3700 0.400000 
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1 1 1    6    2   26 f  4.21000 1.11000 
1 1 1    8    2   26 <        0      0 
1 1 1   10    2   26 o  4.40000 1.00000 
1 1 1   12    2   26 h        0      0 
1 1 1   14    2   26 h  12.2600 0.420000 
1 1 1    1    3   26 o  7.70000 0.550000 
1 1 1    3    3   26 o  18.8800 0.410000 
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1 1 1    7    3   26 o  9.57000 0.520000 
1 1 1    9    3   26 o  8.86000 0.870000 
1 1 1   11    3   26 h  23.5700 0.500000 
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1 1 1    8    4   26 o  10.0800 0.510000 
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1 1 1   12    4   26 h  8.50000 0.620000 
1 1 1    1    5   26 o  5.05000 0.630000 
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1 1 1    6    6   26 h        0      0 
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1 1 1    1   -3   27 o  13.3900 0.390000 
1 1 1    3   -3   27 o  7.69000 0.470000 
1 1 1    5   -3   27 o  5.38000 0.690000 
1 1 1    7   -3   27 o  7.29000 0.590000 
1 1 1    9   -3   27 h  1.67000 1.67000 
1 1 1   11   -3   27 h  9.53000 0.400000 
1 1 1    2   -2   27 <        0      0 
1 1 1    4   -2   27 o  9.53000 0.400000 
1 1 1    6   -2   27 o  9.52000 0.600000 
1 1 1    8   -2   27 o  16.3600 0.560000 
1 1 1   10   -2   27 h  14.9600 0.450000 
1 1 1   12   -2   27 h  5.43000 0.790000 
1 1 1    1   -1   27 o  16.8900 0.400000 
1 1 1    3   -1   27 o  12.7700 0.420000 
1 1 1    5   -1   27 o  19.8800 0.440000 
1 1 1    7   -1   27 o  25.3100 0.510000 
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1 1 1   11   -1   27 h  6.45000 0.600000 
1 1 1   13   -1   27 h  15.9200 0.450000 
1 1 1    2    0   27 <        0      0 
1 1 1    4    0   27 o  7.20000 0.910000 
1 1 1    6    0   27 o  4.09000 1.10000 
1 1 1    8    0   27 o  4.80000 0.830000 
1 1 1   10    0   27 h        0      0 
1 1 1   12    0   27 h  2.85000 2.85000 
1 1 1   14    0   27 h  7.92000 0.930000 
1 1 1    1    1   27 o  21.8500 0.430000 
1 1 1    3    1   27 o  15.1900 0.380000 
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1 1 1    7    1   27 o  28.1900 0.540000 
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1 1 1   11    1   27 h        0      0 
1 1 1   13    1   27 h  17.0600 0.480000 
1 1 1    2    2   27 o  5.45000 0.550000 
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1 1 1   10    2   27 h  13.6800 0.430000 
1 1 1   12    2   27 h  6.97000 0.620000 
1 1 1    1    3   27 o  13.1600 0.420000 
1 1 1    3    3   27 o  9.71000 0.490000 
1 1 1    5    3   27 o  4.30000 0.900000 
1 1 1    7    3   27 o  7.29000 0.590000 
1 1 1    9    3   27 h        0      0 
1 1 1   11    3   27 h  10.6800 0.490000 
1 1 1    2    4   27 o  13.1300 0.470000 
1 1 1    4    4   27 o  3.48000 1.69000 
1 1 1    6    4   27 h  3.69000 1.52000 
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1 1 1   10    4   27 h        0      0 
1 1 1    1    5   27 o  26.0700 0.520000 
1 1 1    3    5   27 o  3.70000 1.33000 
1 1 1    5    5   27 h  3.99000 1.38000 
1 1 1    7    5   27 h  11.0600 0.430000 
1 1 1    9    5   27 h  9.42000 0.550000 
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1 1 1    6    6   27 h  3.24000 1.76000 
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1 1 1    2   -6   28 h  8.17000 0.490000 
1 1 1    4   -6   28 h  3.61000 1.00000 
1 1 1    1   -5   28 o  9.59000 0.440000 
1 1 1    3   -5   28 h  16.1100 0.410000 
1 1 1    5   -5   28 h        0      0 
1 1 1    7   -5   28 h  9.96000 0.440000 
1 1 1    2   -4   28 o  14.5900 0.370000 
1 1 1    4   -4   28 h  10.4600 0.450000 
1 1 1    6   -4   28 h  5.14000 0.840000 
1 1 1    8   -4   28 h  9.99000 0.500000 
1 1 1    1   -3   28 o  13.7400 0.380000 
1 1 1    3   -3   28 o  17.3700 0.400000 
1 1 1    5   -3   28 o  22.1000 0.480000 
1 1 1    7   -3   28 h  10.2700 0.420000 
1 1 1    9   -3   28 h  11.1600 0.460000 
1 1 1    2   -2   28 o  16.9100 0.380000 
1 1 1    4   -2   28 o  20.6100 0.420000 
1 1 1    6   -2   28 o  13.6500 0.410000 
1 1 1    8   -2   28 h  18.2700 0.600000 
1 1 1   10   -2   28 h  4.29000 1.08000 
1 1 1    1   -1   28 o  5.82000 0.660000 
1 1 1    3   -1   28 o  22.9700 0.460000 
1 1 1    5   -1   28 o  6.92000 0.580000 
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1 1 1    9   -1   28 h  10.1900 0.370000 
1 1 1   11   -1   28 h  11.6400 0.450000 
1 1 1    2    0   28 o  37.8500 0.620000 
1 1 1    4    0   28 o  13.8700 0.470000 
1 1 1    6    0   28 o  8.70000 0.450000 
1 1 1    8    0   28 h  32.6200 0.580000 
1 1 1   10    0   28 h  19.3600 0.460000 
1 1 1   12    0   28 h        0      0 
1 1 1    1    1   28 o  4.55000 1.00000 
1 1 1    3    1   28 o  22.9000 0.480000 
1 1 1    5    1   28 o  5.92000 0.650000 
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1 1 1    9    1   28 h  12.4400 0.460000 
1 1 1   11    1   28 h  11.7300 0.500000 
1 1 1    2    2   28 o  19.1600 0.430000 
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1 1 1    6    2   28 o  11.8200 0.650000 
1 1 1    8    2   28 h  18.0600 0.500000 
1 1 1   10    2   28 h  4.05000 1.07000 
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1 1 1    3    3   28 o  17.5000 0.420000 
1 1 1    5    3   28 o  24.6700 0.490000 
1 1 1    7    3   28 h  8.36000 0.570000 
1 1 1    9    3   28 h  10.9300 0.430000 
1 1 1    2    4   28 o  15.0800 0.440000 
1 1 1    4    4   28 h  9.28000 0.440000 
1 1 1    6    4   28 h        0      0 
1 1 1    8    4   28 h  12.0200 0.470000 
1 1 1    1    5   28 o  12.5100 0.390000 
1 1 1    3    5   28 h  16.8200 0.440000 
1 1 1    5    5   28 h        0      0 
1 1 1    7    5   28 h  12.7400 0.460000 
1 1 1    2    6   28 h  3.13000 2.04000 
1 1 1    4    6   28 h  6.50000 0.580000 
1 1 1    1    7   28 h  8.58000 0.570000 
1 1 1    2   -6   29 h  6.76000 0.560000 
1 1 1    1   -5   29 h  9.83000 0.410000 
1 1 1    3   -5   29 h  9.43000 0.440000 
1 1 1    5   -5   29 h  8.06000 0.440000 
1 1 1    2   -4   29 h  10.4400 0.440000 
1 1 1    4   -4   29 h  7.69000 0.550000 
1 1 1    6   -4   29 h        0      0 
1 1 1    1   -3   29 o  16.6600 0.390000 
1 1 1    3   -3   29 h  11.9600 0.390000 
1 1 1    5   -3   29 h  15.4100 0.380000 
1 1 1    7   -3   29 h  9.86000 0.490000 
1 1 1    2   -2   29 o  12.9800 0.370000 
1 1 1    4   -2   29 h  14.0700 0.420000 
1 1 1    6   -2   29 h  3.41000 1.38000 
1 1 1    8   -2   29 h  7.45000 0.490000 
1 1 1    1   -1   29 o  17.5900 0.390000 
1 1 1    3   -1   29 o  15.6200 0.410000 
1 1 1    5   -1   29 h  21.2900 0.430000 
1 1 1    7   -1   29 h  7.78000 0.590000 
1 1 1    9   -1   29 h  17.0500 0.640000 
1 1 1    2    0   29 o  14.7600 0.450000 
1 1 1    4    0   29 o  9.37000 0.480000 
1 1 1    6    0   29 h  10.9700 0.430000 
1 1 1    8    0   29 h  20.1100 0.490000 
1 1 1    1    1   29 o  20.8200 0.440000 
1 1 1    3    1   29 o  17.3900 0.410000 
1 1 1    5    1   29 h  23.3100 0.460000 
1 1 1    7    1   29 h  9.86000 0.490000 
1 1 1    9    1   29 h  15.6800 0.460000 
1 1 1    2    2   29 o  16.4400 0.390000 
1 1 1    4    2   29 h  14.3200 0.410000 
1 1 1    6    2   29 h        0      0 
1 1 1    8    2   29 h        0      0 
1 1 1    1    3   29 o  17.4200 0.400000 
1 1 1    3    3   29 h  12.6300 0.450000 
1 1 1    5    3   29 h  17.0100 0.390000 
1 1 1    7    3   29 h  11.5000 0.440000 
1 1 1    2    4   29 h  11.9300 0.420000 
1 1 1    4    4   29 h        0      0 
1 1 1    6    4   29 h        0      0 
1 1 1    1    5   29 h  11.4000 0.420000 
1 1 1    3    5   29 h  9.80000 0.470000 
1 1 1    5    5   29 h  6.57000 0.730000 
1 1 1    2    6   29 h  6.91000 0.700000 
1 1 1    1   -5   30 h  3.69000 1.20000 
1 1 1    2   -4   30 h  1.30000 1.30000 
1 1 1    4   -4   30 h  8.22000 0.480000 
1 1 1    1   -3   30 h  10.3200 0.440000 
1 1 1    3   -3   30 h        0      0 
1 1 1    5   -3   30 h  4.80000 0.850000 
1 1 1    2   -2   30 h  9.96000 0.460000 
1 1 1    4   -2   30 h  9.04000 0.420000 
1 1 1    6   -2   30 h  8.50000 0.520000 
1 1 1    1   -1   30 o  24.1400 0.470000 
1 1 1    3   -1   30 h  10.5400 0.440000 
1 1 1    5   -1   30 h  16.9900 0.430000 
1 1 1    7   -1   30 h  3.75000 1.25000 
1 1 1    2    0   30 o  44.0000 0.700000 
1 1 1    4    0   30 h  4.77000 1.01000 
1 1 1    6    0   30 h  25.5300 0.520000 
1 1 1    8    0   30 h  10.3600 1.80000 
1 1 1    1    1   30 o  24.1200 0.470000 
1 1 1    3    1   30 h  13.0800 0.440000 
1 1 1    5    1   30 h  14.8900 0.460000 
1 1 1    7    1   30 h        0      0 
1 1 1    2    2   30 h  11.9200 0.550000 
1 1 1    4    2   30 h  12.6400 0.410000 
1 1 1    6    2   30 h  7.74000 0.500000 
1 1 1    1    3   30 h  11.6100 0.430000 
1 1 1    3    3   30 h        0      0 
1 1 1    5    3   30 h  4.38000 1.11000 
1 1 1    2    4   30 h  5.06000 1.03000 
1 1 1    4    4   30 h  10.7700 0.470000 
1 1 1    1    5   30 h        0      0 
1 1 1    2   -4   31 h  10.3700 0.430000 
1 1 1    1   -3   31 h  17.4400 0.430000 
1 1 1    3   -3   31 h  10.5500 0.460000 
1 1 1    2   -2   31 h  10.0800 0.380000 
1 1 1    4   -2   31 h  5.54000 0.580000 
1 1 1    1   -1   31 h  6.08000 0.630000 
1 1 1    3   -1   31 h  15.8400 0.410000 
1 1 1    5   -1   31 h  4.62000 0.940000 
1 1 1    2    0   31 h        0      0 
1 1 1    4    0   31 h  2.39000 2.39000 
1 1 1    1    1   31 h        0      0 
1 1 1    3    1   31 h  15.3200 0.440000 
1 1 1    5    1   31 h  6.83000 1.02000 
1 1 1    2    2   31 h  11.0900 0.440000 
1 1 1    4    2   31 h  6.57000 1.06000 
1 1 1    1    3   31 h  19.2500 0.440000 
1 1 1    3    3   31 h  12.6900 0.520000 
1 1 1    2    4   31 h  5.25000 1.37000 
1 1 1    1   -3   32 h  10.0200 0.440000 
1 1 1    2   -2   32 h  3.35000 1.45000 
1 1 1    1   -1   32 h  13.2400 0.390000 
1 1 1    2    0   32 h  6.59000 0.570000 
1 1 1    1    1   32 h  15.2700 0.430000 
1 1 1    3    1   32 h  9.10000 0.670000 
1 1 1    2    2   32 h        0      0 
1 1 1    1    3   32 h  8.95000 0.600000 
#END OF REFLECTIONS
