File: adrenaline.lau

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file content (4225 lines) | stat: -rw-r--r-- 181,770 bytes parent folder | download | duplicates (2)
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# TITLE *Adrenaline C9H13NO3 (epinephrine, (R)-4-(1-hydroxy-2-(méthylamino)éthyl)benzène-1,2-dio)
# L-Adrenaline: P 21 (4) monoclinic
# a=7.873, b=6.790, c=8.638; aa=cc=90, bb=98.02;
# Reference: A.M. Anderson; Acta Chem.Scand.Ser.B, 29, (1975), 239
#
# Physical parameters:
# sigma_coh 96.53   coherent scattering cross section for C9H13NO3 in [barn]
# sigma_inc 1043.9  incoherent scattering cross section for C9H13NO3 in [barn]
# sigma_abs 6.256   absorption scattering cross section for C9H13NO3 in [barn]
# density   1.33    in [g/cm^3]
# weight    183.20  in [g/mol] for C9H13NO3
# Vc        457.25  volume of unit cell in [A^3]
# multiplicity 2    in [C9H13NO3/unit cell]
# T_m       486     melting temperature in [K]
# T_b       619     boiling temperature in [K]
# lattice_a 7.873   lattice parameter a in [Angs]
# lattice_b 6.790   lattice parameter b in [Angs]
# lattice_c 8.638   lattice parameter c in [Angs]
# lattice_aa 90     lattice angle alpha in [deg]
# lattice_bb 98.02  lattice angle beta in [deg]
# lattice_cc 90     lattice angle gamma in [deg]
#
# Format parameters: Crystallographica format
# column_j  4 multiplicity 'j'
# column_d  5 d-spacing 'd' in [Angs]
# column_F2 7 norm of scattering factor |F|^2 in [fm^2]
# column_h 1
# column_k 2
# column_l 3
#
# h   k   l Mult. d-space 2Theta   F-squared
  0   0   1   2  8.55351  10.3335  126.116
  0   0  -1   2  8.55351  10.3335  126.116
  1   0   0   2    7.796  11.3407  881.551
 -1   0   0   2    7.796  11.3407  881.551
  0   1   0   1     6.79  13.0277        0
  0  -1   0   1     6.79  13.0277        0
  1   0  -1   2  6.20925  14.2522  13.8952
 -1   0   1   2  6.20925  14.2522  13.8952
  1   0   1   2  5.39901  16.4048  92.9581
 -1   0  -1   2  5.39901  16.4048  92.9581
  0  -1   1   2  5.31808  16.6562  277.702
  0  -1  -1   2  5.31808  16.6562  277.702
  0   1  -1   2  5.31808  16.6562  275.602
  0   1   1   2  5.31808  16.6562  275.602
  1   1   0   2  5.12023  17.3047  3104.29
 -1   1   0   2  5.12023  17.3047  3104.29
  1  -1   0   2  5.12023  17.3047  3098.02
 -1  -1   0   2  5.12023  17.3047  3098.02
  1  -1  -1   2  4.58219  19.3551    721.2
 -1  -1   1   2  4.58219  19.3551    721.2
 -1   1   1   2  4.58219  19.3551  716.992
  1   1  -1   2  4.58219  19.3551  716.992
  0   0   2   2  4.27676  20.7522  24.0724
  0   0  -2   2  4.27676  20.7522  24.0724
 -1   1  -1   2  4.22591  21.0046  1689.03
  1   1   1   2  4.22591  21.0046  1689.03
  1  -1   1   2  4.22591  21.0046  1682.82
 -1  -1  -1   2  4.22591  21.0046  1682.82
  1   0  -2   2   3.9918  22.2518  306.632
 -1   0   2   2   3.9918  22.2518  306.632
  2   0   0   2    3.898  22.7944  1347.36
 -2   0   0   2    3.898  22.7944  1347.36
  2   0  -1   2  3.74995  23.7071  1257.07
 -2   0   1   2  3.74995  23.7071  1257.07
  0  -1   2   2  3.61875  24.5798  20.3591
  0  -1  -2   2  3.61875  24.5798  20.3591
  0   1   2   2  3.61875  24.5798  19.9289
  0   1  -2   2  3.61875  24.5798  19.9289
  1   0   2   2  3.54674  25.0869  63.9625
 -1   0  -2   2  3.54674  25.0869  63.9625
  1  -1  -2   2  3.44118  25.8696  389.202
 -1  -1   2   2  3.44118  25.8696  389.202
  1   1  -2   2  3.44118  25.8696  388.003
 -1   1   2   2  3.44118  25.8696  388.003
  0   2   0   1    3.395  26.2277  1904.95
  0  -2   0   1    3.395  26.2277  1904.41
 -2  -1   0   2  3.38054  26.3419  1614.96
  2  -1   0   2  3.38054  26.3419  1614.96
  2   1   0   2  3.38054  26.3419  1614.63
 -2   1   0   2  3.38054  26.3419  1614.63
  2   0   1   2  3.37386   26.395  148.557
 -2   0  -1   2  3.37386   26.395  148.557
  2   1  -1   2  3.28261  27.1425  600.353
 -2   1   1   2  3.28261  27.1425  600.353
 -2  -1   1   2  3.28261  27.1425  598.659
  2  -1  -1   2  3.28261  27.1425  598.659
  0  -2  -1   2  3.15553  28.2579  281.915
  0  -2   1   2  3.15553  28.2579  281.915
  0   2   1   2  3.15553  28.2579  280.679
  0   2  -1   2  3.15553  28.2579  280.679
 -1   1  -2   2   3.1437  28.3664  447.198
  1   1   2   2   3.1437  28.3664  447.198
  1  -1   2   2   3.1437  28.3664  443.834
 -1  -1  -2   2   3.1437  28.3664  443.834
  1  -2   0   2  3.11266  28.6553  1344.48
 -1  -2   0   2  3.11266  28.6553  1344.48
  1   2   0   2  3.11266  28.6553   1344.4
 -1   2   0   2  3.11266  28.6553   1344.4
  2   0  -2   2  3.10463  28.7311  629.421
 -2   0   2   2  3.10463  28.7311  629.421
  2  -1   1   2  3.02142    29.54  156.228
 -2  -1  -1   2  3.02142    29.54  156.228
 -2   1  -1   2  3.02142    29.54  156.121
  2   1   1   2  3.02142    29.54  156.121
  1  -2  -1   2  2.97881  29.9724  236.288
 -1  -2   1   2  2.97881  29.9724  236.288
 -1   2   1   2  2.97881  29.9724  236.095
  1   2  -1   2  2.97881  29.9724  236.095
  1   2   1   2  2.87401  31.0925   540.31
 -1   2  -1   2  2.87401  31.0925   540.31
  1  -2   1   2  2.87401  31.0925  539.924
 -1  -2  -1   2  2.87401  31.0925  539.924
  0   0   3   2  2.85117  31.3479  514.785
  0   0  -3   2  2.85117  31.3479  514.785
 -2  -1   2   2  2.82348  31.6634   182.67
  2  -1  -2   2  2.82348  31.6634   182.67
 -2   1   2   2  2.82348  31.6634  182.518
  2   1  -2   2  2.82348  31.6634  182.518
  1   0  -3   2  2.80702  31.8539  168.574
 -1   0   3   2  2.80702  31.8539  168.574
  2   0   2   2   2.6995  33.1585  532.843
 -2   0  -2   2   2.6995  33.1585  532.843
  0   2   2   2  2.65904   33.678  242.692
  0   2  -2   2  2.65904   33.678  242.692
  0  -2  -2   2  2.65904   33.678  241.922
  0  -2   2   2  2.65904   33.678  241.922
  0  -1  -3   2  2.62882   34.077  86.3999
  0  -1   3   2  2.62882   34.077  86.3998
  0   1   3   2  2.62882   34.077  86.0096
  0   1  -3   2  2.62882   34.077  86.0096
  3   0   0   2  2.59867  34.4846  8.53609
 -3   0   0   2  2.59867  34.4846  8.53609
  1   1  -3   2  2.59409  34.5474   408.19
 -1   1   3   2  2.59409  34.5474   408.19
 -1  -1   3   2  2.59409  34.5474  406.298
  1  -1  -3   2  2.59409  34.5474  406.298
  3   0  -1   2  2.58894  34.6183  79.5732
 -3   0   1   2  2.58894  34.6183  79.5732
 -1   2   2   2  2.58615  34.6568  28.7661
  1   2  -2   2  2.58615  34.6568  28.7661
  1  -2  -2   2  2.58615  34.6568  28.5006
 -1  -2   2   2  2.58615  34.6568  28.5006
  1   0   3   2  2.56477   34.955  8.28342
 -1   0  -3   2  2.56477   34.955  8.28342
 -2   2   0   2  2.56012  35.0206  990.307
  2   2   0   2  2.56012  35.0206  990.306
  2  -2   0   2  2.56012  35.0206  988.435
 -2  -2   0   2  2.56012  35.0206  988.435
 -2  -2   1   2  2.51678  35.6436  989.402
  2  -2  -1   2  2.51678  35.6436  989.401
  2   2  -1   2  2.51678  35.6436  988.119
 -2   2   1   2  2.51678  35.6436  988.118
  2   1   2   2  2.50852  35.7649  207.769
 -2   1  -2   2  2.50852  35.7649  207.769
  2  -1   2   2  2.50852  35.7649  207.199
 -2  -1  -2   2  2.50852  35.7649  207.199
  2   0  -3   2  2.47143  36.3202  375.367
 -2   0   3   2  2.47143  36.3202  375.367
  1  -2   2   2  2.45252  36.6102  241.571
 -1  -2  -2   2  2.45252  36.6102  241.571
 -1   2  -2   2  2.45252  36.6102   239.42
  1   2   2   2  2.45252  36.6102   239.42
  3  -1   0   2  2.42699  37.0092   367.05
 -3  -1   0   2  2.42699  37.0092   367.05
  3   1   0   2  2.42699  37.0092   366.31
 -3   1   0   2  2.42699  37.0092   366.31
 -3   1   1   2  2.41906  37.1349  263.157
  3   1  -1   2  2.41906  37.1349  263.156
  3  -1  -1   2  2.41906  37.1349  262.622
 -3  -1   1   2  2.41906  37.1349  262.622
  1  -1   3   2  2.39931  37.4519  169.858
 -1  -1  -3   2  2.39931  37.4519  169.858
  1   1   3   2  2.39931  37.4519  168.464
 -1   1  -3   2  2.39931  37.4519  168.464
  3   0   1   2  2.39523  37.5181  144.896
 -3   0  -1   2  2.39523  37.5181  144.896
  2   2   1   2  2.39312  37.5525  313.669
 -2   2  -1   2  2.39312  37.5525  313.669
 -2  -2  -1   2  2.39312  37.5525  313.365
  2  -2   1   2  2.39312  37.5525  313.365
  3   0  -2   2  2.37259  37.8898  5.09874
 -3   0   2   2  2.37259  37.8898  5.09874
  2  -1  -3   2  2.32238  38.7412  218.476
 -2  -1   3   2  2.32238  38.7412  218.476
 -2   1   3   2  2.32238  38.7412  217.132
  2   1  -3   2  2.32238  38.7412  217.132
  2   2  -2   2  2.29109  39.2918  490.769
 -2   2   2   2  2.29109  39.2918  490.769
  2  -2  -2   2  2.29109  39.2918  489.669
 -2  -2   2   2  2.29109  39.2918  489.669
  0   3   0   1  2.26333   39.794        0
  0  -3   0   1  2.26333   39.794        0
  3   1   1   2  2.25881   39.877  301.753
 -3   1  -1   2  2.25881   39.877  301.753
  3  -1   1   2  2.25881   39.877    301.7
 -3  -1  -1   2  2.25881   39.877    301.7
 -3  -1   2   2  2.23979  40.2303  131.195
  3  -1  -2   2  2.23979  40.2303  131.195
  3   1  -2   2  2.23979  40.2303  131.123
 -3   1   2   2  2.23979  40.2303  131.123
  0  -3   1   2  2.18803  41.2246  145.659
  0  -3  -1   2  2.18803  41.2246  145.659
  0   3  -1   2  2.18803  41.2246  145.498
  0   3   1   2  2.18803  41.2246  145.498
  0  -2  -3   2  2.18335  41.3169  9.98354
  0  -2   3   2  2.18335  41.3169  9.98353
  0   2   3   2  2.18335  41.3169  9.74999
  0   2  -3   2  2.18335  41.3169  9.74997
 -1   3   0   2  2.17358  41.5112  192.093
  1   3   0   2  2.17358  41.5112  192.092
  1  -3   0   2  2.17358  41.5112   191.71
 -1  -3   0   2  2.17358  41.5112   191.71
  1  -2  -3   2  2.16334  41.7169  89.8141
 -1  -2   3   2  2.16334  41.7169  89.8141
  1   2  -3   2  2.16334  41.7169  89.1222
 -1   2   3   2  2.16334  41.7169  89.1222
  2   0   3   2  2.16202  41.7436  8.68544
 -2   0  -3   2  2.16202  41.7436  8.68544
  1   0  -4   2  2.13977  42.1982  123.083
 -1   0   4   2  2.13977  42.1982  123.083
  0   0   4   2  2.13838   42.227   75.701
  0   0  -4   2  2.13838   42.227   75.701
 -1  -3   1   2  2.12647   42.475  277.783
  1  -3  -1   2  2.12647   42.475  277.783
  1   3  -1   2  2.12647   42.475  277.514
 -1   3   1   2  2.12647   42.475  277.514
 -2  -2  -2   2  2.11296  42.7599   363.51
  2  -2   2   2  2.11296  42.7599   363.51
 -2   2  -2   2  2.11296  42.7599  363.105
  2   2   2   2  2.11296  42.7599  363.105
  3   0   2   2  2.09491  43.1466  2.00988
 -3   0  -2   2  2.09491  43.1466  2.00988
 -1   3  -1   2  2.08734   43.311  67.9731
  1   3   1   2  2.08734   43.311  67.9731
  1  -3   1   2  2.08734   43.311  67.8471
 -1  -3  -1   2  2.08734   43.311  67.8471
  3   0  -3   2  2.06975  43.6979 0.0453225
 -3   0   3   2  2.06975  43.6979 0.0453225
  3   2   0   2  2.06354  43.8362  89.3962
 -3   2   0   2  2.06354  43.8362  89.3962
 -3  -2   0   2  2.06354  43.8362  89.2442
  3  -2   0   2  2.06354  43.8362  89.2442
  2   1   3   2  2.06011  43.9131  157.695
 -2   1  -3   2  2.06011  43.9131  157.695
  2  -1   3   2  2.06011  43.9131  156.721
 -2  -1  -3   2  2.06011  43.9131  156.721
  3  -2  -1   2  2.05866  43.9455  425.951
 -3  -2   1   2  2.05866  43.9455  425.951
 -3   2   1   2  2.05866  43.9455  425.515
  3   2  -1   2  2.05866  43.9455  425.515
  1   2   3   2  2.04645  44.2216  285.742
 -1   2  -3   2  2.04645  44.2216  285.742
 -1  -2  -3   2  2.04645  44.2216  284.979
  1  -2   3   2  2.04645  44.2216  284.979
  1  -1  -4   2  2.04083  44.3497   755.41
 -1  -1   4   2  2.04083  44.3497   755.41
  1   1  -4   2  2.04083  44.3497   754.21
 -1   1   4   2  2.04083  44.3497   754.21
  0   1  -4   2  2.03962  44.3774  8.17435
  0   1   4   2  2.03962  44.3774  8.17435
  0  -1   4   2  2.03962  44.3774  7.90797
  0  -1  -4   2  2.03962  44.3774  7.90796
 -3   1  -2   2   2.0018  45.2619  89.5108
  3   1   2   2   2.0018  45.2619  89.5108
  3  -1   2   2   2.0018  45.2619  89.2439
 -3  -1  -2   2   2.0018  45.2619  89.2439
  0  -3  -2   2  2.00047  45.2937  121.035
  0  -3   2   2  2.00047  45.2937  121.035
  0   3   2   2  2.00047  45.2937  120.724
  0   3  -2   2  2.00047  45.2937  120.724
  2  -2  -3   2  1.99808  45.3508  96.0079
 -2  -2   3   2  1.99808  45.3508  96.0079
  2   2  -3   2  1.99808  45.3508  95.3916
 -2   2   3   2  1.99808  45.3508  95.3916
  2   0  -4   2   1.9959  45.4031   1.0562
 -2   0   4   2   1.9959  45.4031   1.0562
  1   0   4   2  1.99251  45.4846  50.2436
 -1   0  -4   2  1.99251  45.4846  50.2436
 -3   1   3   2  1.97981  45.7929  53.9865
  3   1  -3   2  1.97981  45.7929  53.9865
 -3  -1   3   2  1.97981  45.7929   53.864
  3  -1  -3   2  1.97981  45.7929   53.864
  1   3  -2   2  1.96887   46.062  22.7973
 -1   3   2   2  1.96887   46.062  22.7973
  1  -3  -2   2  1.96887   46.062  22.6695
 -1  -3   2   2  1.96887   46.062  22.6695
  4   0  -1   2  1.96046   46.271  638.357
 -4   0   1   2  1.96046   46.271  638.357
  2   3   0   2  1.95731  46.3499  788.737
 -2   3   0   2  1.95731  46.3499  788.737
  2  -3   0   2  1.95731  46.3499  788.615
 -2  -3   0   2  1.95731  46.3499  788.615
  3  -2   1   2  1.95716  46.3536  265.941
 -3  -2  -1   2  1.95716  46.3536  265.941
 -3   2  -1   2  1.95716  46.3536  265.662
  3   2   1   2  1.95716  46.3536  265.662
  4   0   0   2    1.949  46.5592  391.212
 -4   0   0   2    1.949  46.5592  391.212
 -3   2   2   2  1.94475  46.6669  29.8352
  3   2  -2   2  1.94475  46.6669  29.8352
  3  -2  -2   2  1.94475  46.6669  29.8075
 -3  -2   2   2  1.94475  46.6669  29.8075
  2  -3  -1   2  1.93774  46.8458  255.017
 -2  -3   1   2  1.93774  46.8458  255.017
 -2   3   1   2  1.93774  46.8458  253.737
  2   3  -1   2  1.93774  46.8458  253.737
  2  -1  -4   2  1.91489   47.439  299.895
 -2  -1   4   2  1.91489   47.439  299.895
  2   1  -4   2  1.91489   47.439   299.53
 -2   1   4   2  1.91489   47.439   299.53
  1   1   4   2  1.91189  47.5178  60.9814
 -1   1  -4   2  1.91189  47.5178  60.9814
 -1  -1  -4   2  1.91189  47.5178  60.6073
  1  -1   4   2  1.91189  47.5178  60.6073
 -1   3  -2   2  1.90795  47.6221  205.233
  1   3   2   2  1.90795  47.6221  205.233
  1  -3   2   2  1.90795  47.6221  204.223
 -1  -3  -2   2  1.90795  47.6221  204.223
  4  -1  -1   2  1.88353  48.2786  21.4809
 -4  -1   1   2  1.88353  48.2786  21.4808
 -4   1   1   2  1.88353  48.2786  21.3194
  4   1  -1   2  1.88353  48.2786  21.3194
 -2  -3  -1   2  1.87957  48.3866  94.1609
  2  -3   1   2  1.87957  48.3866  94.1609
  2   3   1   2  1.87957  48.3866  94.0755
 -2   3  -1   2  1.87957  48.3866  94.0754
  4   0  -2   2  1.87498  48.5128  184.982
 -4   0   2   2  1.87498  48.5128  184.982
  4  -1   0   2  1.87335  48.5576  42.2429
 -4  -1   0   2  1.87335  48.5576  42.2429
 -4   1   0   2  1.87335  48.5576  41.7941
  4   1   0   2  1.87335  48.5576  41.7941
  4   0   1   2  1.84534  49.3435  300.615
 -4   0  -1   2  1.84534  49.3435  300.615
 -2   3   2   2  1.82892  49.8166  38.4376
  2   3  -2   2  1.82892  49.8166  38.4376
  2  -3  -2   2  1.82892  49.8166  38.1572
 -2  -3   2   2  1.82892  49.8166  38.1572
  2  -2   3   2  1.82363  49.9709  356.923
 -2  -2  -3   2  1.82363  49.9709  356.923
 -2   2  -3   2  1.82363  49.9709  355.473
  2   2   3   2  1.82363  49.9709  355.473
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 -6   5  -5   2 0.790121  154.265 0.703408
  6   5   5   2 0.790121  154.265 0.703408
  6  -5   5   2 0.790121  154.265 0.689231
 -6  -5  -5   2 0.790121  154.265  0.68923
  2  -8   3   2 0.790052   154.31  3.71108
 -2  -8  -3   2 0.790052   154.31  3.71108
 -2   8  -3   2 0.790052   154.31  3.59939
  2   8   3   2 0.790052   154.31  3.59939
  2  -2  10   2 0.789809  154.465  1.13881
 -2  -2 -10   2 0.789809  154.465  1.13881
 -2   2 -10   2 0.789809  154.465  1.12726
  2   2  10   2 0.789809  154.465  1.12726
 -1  -8   4   2 0.788951   155.02  3.75171
  1  -8  -4   2 0.788951   155.02  3.75171
  1   8  -4   2 0.788951   155.02  3.74263
 -1   8   4   2 0.788951   155.02  3.74262
  0  -8  -4   2 0.788882  155.066  5.15221
  0  -8   4   2 0.788882  155.066   5.1522
  0   8   4   2 0.788882  155.066  5.10552
  0   8  -4   2 0.788882  155.066  5.10552
  4  -2   9   2 0.788654  155.216 0.596093
 -4  -2  -9   2 0.788654  155.216 0.596093
 -4   2  -9   2 0.788654  155.216 0.588876
  4   2   9   2 0.788654  155.216 0.588876
 -5  -7   4   2 0.788319  155.439  5.28597
  5  -7  -4   2 0.788319  155.439  5.28597
  5   7  -4   2 0.788319  155.439  5.20374
 -5   7   4   2 0.788319  155.439  5.20374
  4   7   4   2 0.787692  155.861 0.824466
 -4   7  -4   2 0.787692  155.861 0.824464
 -4  -7  -4   2 0.787692  155.861 0.812634
  4  -7   4   2 0.787692  155.861 0.812633
 -6  -4   8   2 0.787311  156.122  1.84527
  6  -4  -8   2 0.787311  156.122  1.84527
  6   4  -8   2 0.787311  156.122  1.79009
 -6   4   8   2 0.787311  156.122  1.79008
 -3   7  -5   2   0.7868  156.476  1.37968
  3   7   5   2   0.7868  156.476  1.37968
  3  -7   5   2   0.7868  156.476  1.34929
 -3  -7  -5   2   0.7868  156.476  1.34929
 -3   8  -2   2  0.78664  156.589  2.20587
  3   8   2   2  0.78664  156.589  2.20587
  3  -8   2   2  0.78664  156.589  2.19254
 -3  -8  -2   2  0.78664  156.589  2.19254
 10   0  -2   2 0.786567   156.64  19.6729
-10   0   2   2 0.786567   156.64  19.6729
 10   0  -1   2 0.786362  156.785  4.20456
-10   0   1   2 0.786362  156.785  4.20456
  8  -5  -3   2 0.786195  156.904 0.841951
 -8  -5   3   2 0.786195  156.904  0.84195
 -8   5   3   2 0.786195  156.904 0.836934
  8   5  -3   2 0.786195  156.904 0.836934
 -7   4   7   2  0.78617  156.922  6.67319
  7   4  -7   2  0.78617  156.922  6.67319
  7  -4  -7   2  0.78617  156.922  6.61279
 -7  -4   7   2  0.78617  156.922  6.61279
 -4   4  -8   2 0.785925  157.097    3.379
  4   4   8   2 0.785925  157.097    3.379
  4  -4   8   2 0.785925  157.097  3.25551
 -4  -4  -8   2 0.785925  157.097  3.25551
 -1  -3 -10   2 0.785595  157.336  3.05786
  1  -3  10   2 0.785595  157.336  3.05786
  1   3  10   2 0.785595  157.336  3.02743
 -1   3 -10   2 0.785595  157.336  3.02743
 -9   1   6   2 0.785551  157.368  2.04604
  9   1  -6   2 0.785551  157.368  2.04604
  9  -1  -6   2 0.785551  157.368  1.97427
 -9  -1   6   2 0.785551  157.368  1.97427
  3   8  -3   2 0.785287  157.561  3.21262
 -3   8   3   2 0.785287  157.561  3.21262
 -3  -8   3   2 0.785287  157.561  3.15828
  3  -8  -3   2 0.785287  157.561  3.15828
  7   6  -3   2 0.785142  157.669  2.54271
 -7   6   3   2 0.785142  157.669  2.54271
 -7  -6   3   2 0.785142  157.669  2.51387
  7  -6  -3   2 0.785142  157.669  2.51386
  8  -4   3   2 0.784826  157.903  1.17767
 -8  -4  -3   2 0.784826  157.903  1.17767
 -8   4  -3   2 0.784826  157.903  1.14125
  8   4   3   2 0.784826  157.903  1.14125
  1   0 -11   2  0.78464  158.043  1.13416
 -1   0  11   2  0.78464  158.043  1.13416
  2   0 -11   2 0.783837  158.657  13.8594
 -2   0  11   2 0.783837  158.657  13.8594
  3   7  -6   2 0.783831  158.661  0.49058
 -3   7   6   2 0.783831  158.661 0.490579
 -3  -7   6   2 0.783831  158.661 0.479296
  3  -7  -6   2 0.783831  158.661 0.479295
  1   5  -9   2 0.783701  158.762 0.468758
 -1   5   9   2 0.783701  158.762 0.468758
 -1  -5   9   2 0.783701  158.762 0.458854
  1  -5  -9   2 0.783701  158.762 0.458853
  6   5  -7   2 0.783605  158.837 0.501974
 -6   5   7   2 0.783605  158.837 0.501974
 -6  -5   7   2 0.783605  158.837 0.498417
  6  -5  -7   2 0.783605  158.837 0.498417
  7   6   1   2 0.783256  159.113  1.84653
 -7   6  -1   2 0.783256  159.113  1.84653
  7  -6   1   2 0.783256  159.113  1.83967
 -7  -6  -1   2 0.783256  159.113  1.83967
  6  -3   7   2 0.782534  159.694  2.55308
 -6  -3  -7   2 0.782534  159.694  2.55308
 -6   3  -7   2 0.782534  159.694  2.54861
  6   3   7   2 0.782534  159.694  2.54861
 -4  -6  -6   2 0.781684  160.402  2.96166
  4  -6   6   2 0.781684  160.402  2.96166
  4   6   6   2 0.781684  160.402  2.92917
 -4   6  -6   2 0.781684  160.402  2.92916
-10  -1   2   2 0.781342  160.695  1.84459
 10  -1  -2   2 0.781342  160.695  1.84459
-10   1   2   2 0.781342  160.695  1.81957
 10   1  -2   2 0.781342  160.695  1.81957
  5   6   5   2 0.781227  160.794  2.00469
 -5   6  -5   2 0.781227  160.794  2.00469
 -5  -6  -5   2 0.781227  160.794  1.95695
  5  -6   5   2 0.781227  160.794  1.95695
 -1   6   8   2 0.781206  160.812  1.34687
  1   6  -8   2 0.781206  160.812  1.34687
  1  -6  -8   2 0.781206  160.812   1.3098
 -1  -6   8   2 0.781206  160.812   1.3098
 10  -1  -1   2 0.781141  160.869 0.803759
-10  -1   1   2 0.781141  160.869 0.803759
-10   1   1   2 0.781141  160.869 0.792686
 10   1  -1   2 0.781141  160.869 0.792686
  2  -8  -4   2 0.781061  160.938  8.87144
 -2  -8   4   2 0.781061  160.938  8.87144
  2   8  -4   2 0.781061  160.938  8.71895
 -2   8   4   2 0.781061  160.938  8.71895
 -2  -5   9   2 0.780901  161.079  4.06091
  2  -5  -9   2 0.780901  161.079  4.06091
  2   5  -9   2 0.780901  161.079  4.04616
 -2   5   9   2 0.780901  161.079  4.04616
 -1  -8  -4   2 0.780858  161.117  3.99275
  1  -8   4   2 0.780858  161.117  3.99275
  1   8   4   2 0.780858  161.117   3.9453
 -1   8  -4   2 0.780858  161.117   3.9453
  3   0  10   2 0.780765  161.199 0.113276
 -3   0 -10   2 0.780765  161.199 0.113276
 -7   4  -5   2  0.78053  161.408  5.14122
  7   4   5   2  0.78053  161.408  5.14122
 -7  -4  -5   2  0.78053  161.408  5.11573
  7  -4   5   2  0.78053  161.408  5.11573
  7  -3  -8   2 0.780427  161.501  5.17791
 -7  -3   8   2 0.780427  161.501  5.17791
 -7   3   8   2 0.780427  161.501  5.12878
  7   3  -8   2 0.780427  161.501  5.12878
 -8  -5  -1   2 0.780294  161.621 0.912616
  8  -5   1   2 0.780294  161.621 0.912615
  8   5   1   2 0.780294  161.621  0.89884
 -8   5  -1   2 0.780294  161.621  0.89884
 10   0  -3   2 0.780198  161.709  10.6772
-10   0   3   2 0.780198  161.709  10.6772
 -6  -7   1   2  0.77999    161.9  4.68772
  6  -7  -1   2  0.77999    161.9  4.68772
  6   7  -1   2  0.77999    161.9  4.63513
 -6   7   1   2  0.77999    161.9  4.63513
 10   0   0   2   0.7796  162.264  1.90425
-10   0   0   2   0.7796  162.264  1.90425
 -1   1  11   2 0.779453  162.402  1.55196
  1   1 -11   2 0.779453  162.402  1.55196
  1  -1 -11   2 0.779453  162.402  1.54626
 -1  -1  11   2 0.779453  162.402  1.54626
  4  -8  -1   2 0.778889  162.947  1.81648
 -4  -8   1   2 0.778889  162.947  1.81648
 -4   8   1   2 0.778889  162.947  1.79823
  4   8  -1   2 0.778889  162.947  1.79823
  5   3   8   2 0.778808  163.027  0.61614
 -5   3  -8   2 0.778808  163.027  0.61614
 -5  -3  -8   2 0.778808  163.027 0.603665
  5  -3   8   2 0.778808  163.027 0.603665
 -8   2  -5   2 0.778766  163.067  6.82056
  8   2   5   2 0.778766  163.067  6.82056
  8  -2   5   2 0.778766  163.067  6.75926
 -8  -2  -5   2 0.778766  163.067  6.75926
  2  -1 -11   2 0.778666  163.168  1.22431
 -2  -1  11   2 0.778666  163.168  1.22431
 -2   1  11   2 0.778666  163.168  1.18952
  2   1 -11   2 0.778666  163.168  1.18952
  0  -5  -9   2 0.778647  163.186  1.99276
  0  -5   9   2 0.778647  163.186  1.99276
  0   5   9   2 0.778647  163.186  1.98294
  0   5  -9   2 0.778647  163.186  1.98294
  7   0  -9   2 0.778566  163.267 0.0236856
 -7   0   9   2 0.778566  163.267 0.0236856
 -4   8   0   2 0.778165  163.674  1.58003
  4   8   0   2 0.778165  163.674  1.58003
  4  -8   0   2 0.778165  163.674  1.53696
 -4  -8   0   2 0.778165  163.674  1.53696
  0   0  11   2 0.777592  164.273  1.55759
  0   0 -11   2 0.777592  164.273  1.55759
  2   6  -8   2 0.777447  164.428 0.0953733
 -2   6   8   2 0.777447  164.428 0.0953725
 -2  -6   8   2 0.777447  164.428 0.0917664
  2  -6  -8   2 0.777447  164.428 0.0917657
 -6   7   0   2  0.77729  164.598   5.4929
  6   7   0   2  0.77729  164.598  5.49289
  6  -7   0   2  0.77729  164.598  5.46417
 -6  -7   0   2  0.77729  164.598  5.46417
 -9   2  -3   2 0.777208  164.688  3.18677
  9   2   3   2 0.777208  164.688  3.18676
  9  -2   3   2 0.777208  164.688  3.18389
 -9  -2  -3   2 0.777208  164.688  3.18389
  0   6   8   2  0.77718  164.719 0.213632
  0   6  -8   2  0.77718  164.719 0.213632
  0  -6  -8   2  0.77718  164.719 0.211776
  0  -6   8   2  0.77718  164.719 0.211776
  5   2 -10   2 0.777161   164.74 0.681141
 -5   2  10   2 0.777161   164.74 0.681141
  5  -2 -10   2 0.777161   164.74 0.645041
 -5  -2  10   2 0.777161   164.74 0.645041
  9  -4  -1   2  0.77714  164.763 0.342853
 -9  -4   1   2  0.77714  164.763 0.342852
  9   4  -1   2  0.77714  164.763 0.336733
 -9   4   1   2  0.77714  164.763 0.336733
 -4  -3  10   2 0.776641  165.323 0.789226
  4  -3 -10   2 0.776641  165.323 0.789225
  4   3 -10   2 0.776641  165.323 0.762475
 -4   3  10   2 0.776641  165.323 0.762474
  9  -3   2   2 0.776634  165.332  15.7665
 -9  -3  -2   2 0.776634  165.332  15.7665
  9   3   2   2 0.776634  165.332  15.6652
 -9   3  -2   2 0.776634  165.332  15.6651
  9   4  -2   2 0.776356  165.654  3.43677
 -9   4   2   2 0.776356  165.654  3.43677
 -9  -4   2   2 0.776356  165.654  3.39616
  9  -4  -2   2 0.776356  165.654  3.39616
 -6  -7   2   2 0.776245  165.784  3.48969
  6  -7  -2   2 0.776245  165.784  3.48969
  6   7  -2   2 0.776245  165.784  3.47086
 -6   7   2   2 0.776245  165.784  3.47086
  5  -7   3   2 0.776167  165.878  1.25924
 -5  -7  -3   2 0.776167  165.878  1.25924
 -5   7  -3   2 0.776167  165.878  1.24503
  5   7   3   2 0.776167  165.878  1.24503
  8   0  -8   2 0.776157   165.89 0.776191
 -8   0   8   2 0.776157   165.89 0.776191
  5  -5  -8   2 0.775924   166.17  1.61961
 -5  -5   8   2 0.775924   166.17  1.61961
 -5   5   8   2 0.775924   166.17  1.61051
  5   5  -8   2 0.775924   166.17  1.61051
  3  -1  10   2 0.775654  166.503  6.16184
 -3  -1 -10   2 0.775654  166.503  6.16183
  3   1  10   2 0.775654  166.503  6.15474
 -3   1 -10   2 0.775654  166.503  6.15474
  3   0 -11   2 0.775254  167.012 0.0389906
 -3   0  11   2 0.775254  167.012 0.0389906
-10   1   3   2 0.775098  167.216 0.0947986
 10   1  -3   2 0.775098  167.216 0.0947986
 10  -1  -3   2 0.775098  167.216 0.0928512
-10  -1   3   2 0.775098  167.216 0.0928512
 -7   5   6   2 0.775037  167.297  1.49364
  7   5  -6   2 0.775037  167.297  1.49364
  7  -5  -6   2 0.775037  167.297  1.46803
 -7  -5   6   2 0.775037  167.297  1.46803
 -3   5  -8   2 0.774862  167.532 0.739382
  3   5   8   2 0.774862  167.532 0.739381
  3  -5   8   2 0.774862  167.532 0.717471
 -3  -5  -8   2 0.774862  167.532  0.71747
 10  -1   0   2 0.774511  168.016 0.298322
-10  -1   0   2 0.774511  168.016 0.298322
 10   1   0   2 0.774511  168.016 0.298026
-10   1   0   2 0.774511  168.016 0.298026
  6   0   8   2   0.7743  168.319 0.0197671
 -6   0  -8   2   0.7743  168.319 0.0197671
 -6  -3   9   2 0.774126  168.572 0.129901
  6  -3  -9   2 0.774126  168.572 0.129901
  6   3  -9   2 0.774126  168.572   0.1205
 -6   3   9   2 0.774126  168.572   0.1205
  7  -3   6   2 0.774001   168.76  4.07947
 -7  -3  -6   2 0.774001   168.76  4.07947
 -7   3  -6   2 0.774001   168.76  4.00593
  7   3   6   2 0.774001   168.76  4.00593
  2  -7   6   2 0.773616  169.354 0.717911
 -2  -7  -6   2 0.773616  169.354  0.71791
 -2   7  -6   2 0.773616  169.354 0.715317
  2   7   6   2 0.773616  169.354 0.715316
  7   1  -9   2 0.773498  169.544  4.28502
 -7   1   9   2 0.773498  169.544  4.28502
 -7  -1   9   2 0.773498  169.544  4.21379
  7  -1  -9   2 0.773498  169.544  4.21379
 -4   8   2   2 0.773218  170.007  3.15484
  4   8  -2   2 0.773218  170.007  3.15484
  4  -8  -2   2 0.773218  170.007  3.11382
 -4  -8   2   2 0.773218  170.007  3.11382
  0   1  11   2 0.772543  171.227 0.474028
  0   1 -11   2 0.772543  171.227 0.474028
  0  -1  11   2 0.772543  171.227 0.471367
  0  -1 -11   2 0.772543  171.227 0.471367
  5   4  -9   2 0.772162  171.999 0.554499
 -5   4   9   2 0.772162  171.999 0.554499
 -5  -4   9   2 0.772162  171.999 0.534766
  5  -4  -9   2 0.772162  171.999 0.534766
 -9  -4   0   2  0.77157  173.373 0.342242
  9  -4   0   2  0.77157  173.373 0.342242
  9   4   0   2  0.77157  173.373  0.33843
 -9   4   0   2  0.77157  173.373  0.33843
  8   5  -4   2 0.771504  173.545  1.88132
 -8   5   4   2 0.771504  173.545  1.88132
 -8  -5   4   2 0.771504  173.545  1.85527
  8  -5  -4   2 0.771504  173.545  1.85527
  7   0   7   2 0.771287  174.145 0.429697
 -7   0  -7   2 0.771287  174.145 0.429697
 -9  -3   5   2 0.771209  174.373  15.8681
  9  -3  -5   2 0.771209  174.373  15.8681
  9   3  -5   2 0.771209  174.373  15.7907
 -9   3   5   2 0.771209  174.373  15.7907
 -8   1   8   2 0.771135  174.603 0.114778
  8   1  -8   2 0.771135  174.603 0.114778
 -8  -1   8   2 0.771135  174.603 0.113161
  8  -1  -8   2 0.771135  174.603 0.113161
  4   8   1   2 0.771098  174.721  1.10135
 -4   8  -1   2 0.771098  174.721  1.10135
 -4  -8  -1   2 0.771098  174.721  1.07506
  4  -8   1   2 0.771098  174.721  1.07506
 -8   3   7   2 0.770683  176.294 0.430513
  8   3  -7   2 0.770683  176.294 0.430513
  8  -3  -7   2 0.770683  176.294 0.416734
 -8  -3   7   2 0.770683  176.294 0.416734
  7   5   4   2 0.770525  177.111 0.301463
 -7   5  -4   2 0.770525  177.111 0.301463
 -7  -5  -4   2 0.770525  177.111 0.300716
  7  -5   4   2 0.770525  177.111 0.300716
  3  -5  -9   2 0.770492  177.313  4.16871
 -3  -5   9   2 0.770492  177.313  4.16871
 -3   5   9   2 0.770492  177.313  4.14178
  3   5  -9   2 0.770492  177.313  4.14177