#------------------------------------------------------------------------------
#$Date: 2017-09-22 05:14:28 +0300 (Fri, 22 Sep 2017) $
#$Revision: 201157 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/22/92/7229221.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_7229221
loop_
_publ_author_name
'Shemchuk, Oleksii'
'Degli Esposti, Lorenzo'
'Grepioni, Fabrizia'
'Braga, Dario'
_publ_section_title
;
 Ionic co-crystals of enantiopure and racemic histidine with calcium
 halides
;
_journal_name_full               CrystEngComm
_journal_paper_doi               10.1039/C7CE01326D
_journal_year                    2017
_chemical_formula_moiety         'C6 H9 N3 O4, Ca0.5 I1, H2 O, H2 O'
_chemical_formula_sum            'C12 H18 Ca I2 N6 O8'
_chemical_formula_weight         676.26
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_audit_update_record
;
2017-07-19 deposited with the CCDC.
2017-09-21 downloaded from the CCDC.
;
_cell_angle_alpha                94.53901(13)
_cell_angle_beta                 95.92579(13)
_cell_angle_gamma                102.7035(13)
_cell_formula_units_Z            1
_cell_length_a                   4.90323(9)
_cell_length_b                   10.54663(2)
_cell_length_c                   11.9651(3)
_cell_measurement_temperature    298
_cell_volume                     597.058(19)
_diffrn_ambient_temperature      298
_diffrn_measurement_device_type  'Panalytical XPert PRO'
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           'Cu K\a'
_diffrn_radiation_wavelength     1.54180
_exptl_crystal_density_diffrn    1.859
_pd_char_colour                  white
_pd_proc_ls_prof_R_factor        0.0330
_pd_proc_ls_prof_wR_expected     0.0279
_pd_proc_ls_prof_wR_factor       0.0435
_refine_ls_goodness_of_fit_all   1.55828
_refine_ls_number_parameters     0.000000
_refine_ls_R_I_factor            0.0331
_refine_ls_shift/su_max          7.52751511e-014
_cod_data_source_file            c7ce01326d2.cif
_cod_data_source_block           DL-His_CaI2
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to
/home/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 4973 2017-02-22 13:04:09Z antanas 
;
_cod_original_cell_volume        597.06(2)
_cod_original_formula_sum        ' C12 H18 Ca I2 N6 O8'
_cod_database_code               7229221
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z '
'-x, -y, -z '
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_symmetry_multiplicity
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_B_iso_or_equiv
C1 C 2 0.9499(4) 0.5467(5) -0.1814(12) 1 1.16058
C2 C 2 1.042(6) 0.5530(3) -0.3009(3) 1 1.16058
C3 C 2 1.085(2) 0.4201(5) -0.3480(4) 1 1.16058
C4 C 2 0.812(4) 0.3170(5) -0.3711(5) 1 1.16058
C5 C 2 0.427(6) 0.2051(6) -0.4661(8) 1 1.16058
C6 C 2 0.689(6) 0.2302(2) -0.3031(6) 1 1.16058
N1 N 2 1.311(2) 0.654(4) -0.296(4) 1 1.16058
N2 N 2 0.648(4) 0.302(7) -0.474(7) 1 1.16058
N3 N 2 0.443(7) 0.159(4) -0.365(8) 1 1.16058
O1 O 2 0.6924(6) 0.5300(10) -0.1745(14) 1 1.16058
O2 O 2 1.1431(5) 0.5622(19) -0.1012(18) 1 1.16058
H1 H 2 0.8712(10) 0.570(5) -0.358(4) 1 1.392696
H2 H 2 1.2260(3) 0.387(3) -0.286(3) 1 1.392696
H3 H 2 1.1781(19) 0.431(7) -0.426(5) 1 1.392696
H4 H 2 0.2541(7) 0.169(8) -0.533(9) 1 1.392696
H5 H 2 0.7679(7) 0.2179(14) -0.217(8) 1 1.392696
H6 H 2 0.3212(9) 0.095(3) -0.343(9) 1 1.392696
H7 H 2 1.4411(2) 0.634(3) -0.2501(4) 1 1.392696
H8 H 2 1.3631(3) 0.658(6) -0.3630(5) 1 1.392696
H9 H 2 1.2851(4) 0.730(3) -0.2711(5) 1 1.392696
Ca Ca 1 0.5 0.5 0 0.5 0.19521
Ow O 2 0.7135(10) 0.7385(11) 0.06012(2) 1 2
Ow2 O 2 0.28413(9) 0.8669(10) 0.04219(2) 1 2
I I 2 0.02887(14) 0.08925(16) 0.2263(4) 1 1.58408
loop_
_pd_proc_point_id
_pd_meas_2theta_scan
_pd_proc_intensity_total
_pd_calc_intensity_total
_pd_proc_ls_weight
1 4.99807 2299.84761 2332.88989 0.00043
2 5.01107 2296.98186 2342.56006 0.00043
3 5.02407 2294.12090 2342.56006 0.00043
4 5.03707 2291.26470 2294.41016 0.00044
5 5.05007 2288.41324 2304.00000 0.00043
6 5.06307 2285.56651 2342.56006 0.00043
7 5.07607 2282.72450 2381.43994 0.00042
8 5.08907 2279.88717 2352.25000 0.00043
9 5.10207 2277.05452 2323.23999 0.00043
10 5.11507 2274.22654 2275.29004 0.00044
11 5.12807 2271.40319 2209.00000 0.00045
12 5.14107 2268.58448 2227.84009 0.00045
13 5.15407 2265.77037 2304.00000 0.00043
14 5.16707 2262.96087 2332.88989 0.00043
15 5.18007 2260.15594 2352.25000 0.00043
16 5.19307 2257.35558 2304.00000 0.00043
17 5.20607 2254.55977 2313.60986 0.00043
18 5.21907 2251.76849 2323.23999 0.00043
19 5.23207 2248.98174 2294.41016 0.00044
20 5.24507 2246.19948 2304.00000 0.00043
21 5.25807 2243.42172 2284.83984 0.00044
22 5.27107 2240.64843 2190.23999 0.00046
23 5.28407 2237.87960 2218.40991 0.00045
24 5.29707 2235.11521 2237.29004 0.00045
25 5.31007 2232.35526 2304.00000 0.00043
26 5.32307 2229.59972 2361.95996 0.00042
27 5.33607 2226.84858 2294.41016 0.00044
28 5.34907 2224.10183 2227.84009 0.00045
29 5.36207 2221.35946 2256.25000 0.00044
30 5.37507 2218.62145 2227.84009 0.00045
31 5.38807 2215.88779 2265.75977 0.00044
32 5.40107 2213.15846 2256.25000 0.00044
33 5.41407 2210.43345 2218.40991 0.00045
34 5.42707 2207.71275 2180.89014 0.00046
35 5.44007 2204.99634 2246.76025 0.00045
36 5.45307 2202.28421 2246.76025 0.00045
37 5.46607 2199.57635 2097.63989 0.00048
38 5.47907 2196.87275 2180.89014 0.00046
39 5.49207 2194.17339 2209.00000 0.00045
40 5.50507 2191.47827 2171.55981 0.00046
41 5.51807 2188.78736 2209.00000 0.00045
42 5.53107 2186.10066 2180.89014 0.00046
43 5.54407 2183.41815 2180.89014 0.00046
44 5.55707 2180.73982 2180.89014 0.00046
45 5.57007 2178.06566 2180.89014 0.00046
46 5.58307 2175.39567 2256.25000 0.00044
47 5.59607 2172.72982 2152.96021 0.00046
48 5.60907 2170.06810 2162.25000 0.00046
49 5.62207 2167.41051 2162.25000 0.00046
50 5.63507 2164.75703 2134.44019 0.00047
51 5.64807 2162.10766 2190.23999 0.00046
52 5.66107 2159.46237 2152.96021 0.00046
53 5.67407 2156.82117 2162.25000 0.00046
54 5.68707 2154.18403 2143.68994 0.00047
55 5.70007 2151.55095 2180.89014 0.00046
56 5.71307 2148.92192 2125.20996 0.00047
57 5.72607 2146.29693 2070.25000 0.00048
58 5.73907 2143.67596 2125.20996 0.00047
59 5.75207 2141.05901 2125.20996 0.00047
60 5.76507 2138.44606 2171.55981 0.00046
61 5.77807 2135.83711 2134.44019 0.00047
62 5.79107 2133.23215 2152.96021 0.00046
63 5.80407 2130.63117 2143.68994 0.00047
64 5.81707 2128.03415 2070.25000 0.00048
65 5.83007 2125.44108 2088.48999 0.00048
66 5.84307 2122.85197 2043.04004 0.00049
67 5.85607 2120.26679 2070.25000 0.00048
68 5.86907 2117.68554 2180.89014 0.00046
69 5.88207 2115.10822 2199.61011 0.00045
70 5.89507 2112.53480 2116.00000 0.00047
71 5.90807 2109.96528 2088.48999 0.00048
72 5.92107 2107.39966 2043.04004 0.00049
73 5.93407 2104.83791 2097.63989 0.00048
74 5.94707 2102.28005 2106.81006 0.00047
75 5.96007 2099.72605 2070.25000 0.00048
76 5.97307 2097.17591 2016.01013 0.00050
77 5.98607 2094.62961 2043.04004 0.00049
78 5.99907 2092.08716 2143.68994 0.00047
79 6.01207 2089.54854 2143.68994 0.00047
80 6.02507 2087.01375 2088.48999 0.00048
81 6.03807 2084.48277 2097.63989 0.00048
82 6.05107 2081.95560 2061.16016 0.00049
83 6.06407 2079.43224 2088.48999 0.00048
84 6.07707 2076.91266 2125.20996 0.00047
85 6.09007 2074.39687 2025.00000 0.00049
86 6.10307 2071.88486 1989.15991 0.00050
87 6.11607 2069.37661 2016.01013 0.00050
88 6.12907 2066.87214 2016.01013 0.00050
89 6.14207 2064.37141 1998.09009 0.00050
90 6.15507 2061.87444 2034.00989 0.00049
91 6.16807 2059.38120 2007.03992 0.00050
92 6.18107 2056.89170 1998.09009 0.00050
93 6.19407 2054.40593 1989.15991 0.00050
94 6.20707 2051.92387 1989.15991 0.00050
95 6.22007 2049.44553 2079.35986 0.00048
96 6.23307 2046.97090 2079.35986 0.00048
97 6.24607 2044.49997 2034.00989 0.00049
98 6.25907 2042.03273 2016.01013 0.00050
99 6.27207 2039.56917 1998.09009 0.00050
100 6.28507 2037.10930 2016.01013 0.00050
101 6.29807 2034.65311 2079.35986 0.00048
102 6.31107 2032.20058 2061.16016 0.00049
103 6.32407 2029.75174 2025.00000 0.00049
104 6.33707 2027.30661 2061.16016 0.00049
105 6.35007 2024.86527 2079.35986 0.00048
106 6.36307 2022.42779 2052.08984 0.00049
107 6.37607 2019.99480 1998.09009 0.00050
108 6.38907 2017.56680 1998.09009 0.00050
109 6.40207 2015.14447 2016.01013 0.00050
110 6.41507 2012.72846 1980.25000 0.00050
111 6.42807 2010.32088 1953.64001 0.00051
112 6.44107 2007.92007 1936.00000 0.00052
113 6.45407 2005.52517 1944.80981 0.00051
114 6.46707 2003.13582 1989.15991 0.00050
115 6.48007 2000.75222 1936.00000 0.00052
116 6.49307 1998.37446 1874.88989 0.00053
117 6.50607 1996.00246 1892.25000 0.00053
118 6.51907 1993.63648 1989.15991 0.00050
119 6.53207 1991.27728 1980.25000 0.00050
120 6.54507 1988.92644 1971.36011 0.00051
121 6.55807 1986.58384 1989.15991 0.00050
122 6.57107 1984.25049 1936.00000 0.00052
123 6.58407 1981.92763 1998.09009 0.00050
124 6.59707 1979.62286 1980.25000 0.00050
125 6.61007 1977.33802 1971.36011 0.00051
126 6.62307 1975.07885 1918.43994 0.00052
127 6.63607 1972.85142 1936.00000 0.00052
128 6.64907 1970.68155 1883.56018 0.00053
129 6.66207 1968.56741 1944.80981 0.00051
130 6.67507 1966.49066 1944.80981 0.00051
131 6.68807 1964.42200 1980.25000 0.00050
132 6.70107 1962.25621 1971.36011 0.00051
133 6.71407 1959.73404 1936.00000 0.00052
134 6.72707 1956.92082 1927.21008 0.00052
135 6.74007 1953.97236 1927.21008 0.00052
136 6.75307 1951.25330 1971.36011 0.00051
137 6.76607 1948.75637 1936.00000 0.00052
138 6.77907 1946.35427 1962.48999 0.00051
139 6.79207 1944.01138 1857.60986 0.00054
140 6.80507 1941.69524 1883.56018 0.00053
141 6.81807 1939.38922 1944.80981 0.00051
142 6.83107 1937.08895 1944.80981 0.00051
143 6.84407 1934.79444 1892.25000 0.00053
144 6.85707 1932.50578 1883.56018 0.00053
145 6.87007 1930.22450 1900.95984 0.00053
146 6.88307 1927.95064 1840.41016 0.00054
147 6.89607 1925.68454 1918.43994 0.00052
148 6.90907 1923.42689 1840.41016 0.00054
149 6.92207 1921.18045 1857.60986 0.00054
150 6.93507 1918.94781 1909.69006 0.00052
151 6.94807 1916.72978 1918.43994 0.00052
152 6.96107 1914.52854 1883.56018 0.00053
153 6.97407 1912.34921 1883.56018 0.00053
154 6.98707 1910.19800 1874.88989 0.00053
155 7.00007 1908.06230 1831.83997 0.00055
156 7.01307 1905.93360 1918.43994 0.00052
157 7.02607 1903.80164 1918.43994 0.00052
158 7.03907 1901.68780 1900.95984 0.00053
159 7.05207 1899.61915 1831.83997 0.00055
160 7.06507 1897.64009 1883.56018 0.00053
161 7.07807 1895.80749 1892.25000 0.00053
162 7.09107 1894.42571 1866.24011 0.00054
163 7.10407 1893.95870 1866.24011 0.00054
164 7.11707 1894.98887 1918.43994 0.00052
165 7.13007 1898.16027 1866.24011 0.00054
166 7.14307 1905.37848 1857.60986 0.00054
167 7.15607 1916.53807 1944.80981 0.00051
168 7.16907 1930.26637 1918.43994 0.00052
169 7.18207 1946.15799 1900.95984 0.00053
170 7.19507 1964.05007 1866.24011 0.00054
171 7.20807 1984.22477 1953.64001 0.00051
172 7.22107 2006.37352 1927.21008 0.00052
173 7.23407 2030.72296 1971.36011 0.00051
174 7.24707 2057.57777 2088.48999 0.00048
175 7.26007 2088.83799 2125.20996 0.00047
176 7.27307 2124.07790 2079.35986 0.00048
177 7.28607 2164.04408 2190.23999 0.00046
178 7.29907 2209.56921 2246.76025 0.00045
179 7.31207 2265.30674 2313.60986 0.00043
180 7.32507 2333.69801 2361.95996 0.00042
181 7.33807 2418.63117 2530.08984 0.00040
182 7.35107 2525.11831 2714.40991 0.00037
183 7.36407 2669.60307 2905.21021 0.00034
184 7.37707 2867.47440 3192.25000 0.00031
185 7.39007 3116.29743 3552.15991 0.00028
186 7.40307 3403.77151 4147.36035 0.00024
187 7.41607 3699.52385 4637.60986 0.00022
188 7.42907 3749.16735 4556.25000 0.00022
189 7.44207 3413.98542 4019.56030 0.00025
190 7.45507 2848.66678 3226.23999 0.00031
191 7.46807 2301.52538 2480.04004 0.00040
192 7.48107 2045.64471 2088.48999 0.00048
193 7.49407 1910.73861 1936.00000 0.00052
194 7.50707 1853.52242 1883.56018 0.00053
195 7.52007 1835.00794 1866.24011 0.00054
196 7.53307 1828.52878 1823.29004 0.00055
197 7.54607 1823.75506 1857.60986 0.00054
198 7.55907 1819.89938 1874.88989 0.00053
199 7.57207 1816.55820 1780.84009 0.00056
200 7.58507 1813.58625 1772.40991 0.00056
201 7.59807 1810.82892 1814.75989 0.00055
202 7.61107 1808.20278 1806.25000 0.00055
203 7.62407 1805.68123 1814.75989 0.00055
204 7.63707 1803.24880 1806.25000 0.00055
205 7.65007 1800.88954 1764.00000 0.00057
206 7.66307 1798.57665 1738.89001 0.00058
207 7.67607 1796.30591 1713.96008 0.00058
208 7.68907 1794.07410 1738.89001 0.00058
209 7.70207 1791.89005 1730.55981 0.00058
210 7.71507 1789.74245 1705.68994 0.00059
211 7.72807 1787.62388 1738.89001 0.00058
212 7.74107 1785.52274 1730.55981 0.00058
213 7.75407 1783.40317 1738.89001 0.00058
214 7.76707 1781.18467 1764.00000 0.00057
215 7.78007 1778.88381 1747.23999 0.00057
216 7.79307 1776.53377 1823.29004 0.00055
217 7.80607 1774.21333 1780.84009 0.00056
218 7.81907 1771.99802 1789.28992 0.00056
219 7.83207 1769.83455 1764.00000 0.00057
220 7.84507 1767.70447 1780.84009 0.00056
221 7.85807 1765.58959 1713.96008 0.00058
222 7.87107 1763.49281 1755.61011 0.00057
223 7.88407 1761.42436 1780.84009 0.00056
224 7.89707 1759.37974 1806.25000 0.00055
225 7.91007 1757.35086 1814.75989 0.00055
226 7.92307 1755.33076 1789.28992 0.00056
227 7.93607 1753.31495 1806.25000 0.00055
228 7.94907 1751.30312 1755.61011 0.00057
229 7.96207 1749.29498 1797.76013 0.00056
230 7.97507 1747.29076 1764.00000 0.00057
231 7.98807 1745.29045 1764.00000 0.00057
232 8.00107 1743.29402 1730.55981 0.00058
233 8.01407 1741.30150 1689.20984 0.00059
234 8.02707 1739.31300 1747.23999 0.00057
235 8.04007 1737.32877 1738.89001 0.00058
236 8.05307 1735.34867 1747.23999 0.00057
237 8.06607 1733.37277 1640.25000 0.00061
238 8.07907 1731.40116 1697.44006 0.00059
239 8.09207 1729.43442 1713.96008 0.00058
240 8.10507 1727.47228 1705.68994 0.00059
241 8.11807 1725.51487 1747.23999 0.00057
242 8.13107 1723.56233 1713.96008 0.00058
243 8.14407 1721.61552 1576.09009 0.00063
244 8.15707 1719.67440 1616.04004 0.00062
245 8.17007 1717.73909 1755.61011 0.00057
246 8.18307 1715.80988 1764.00000 0.00057
247 8.19607 1713.88807 1713.96008 0.00058
248 8.20907 1711.97463 1747.23999 0.00057
249 8.22207 1710.06966 1747.23999 0.00057
250 8.23507 1708.17409 1689.20984 0.00059
251 8.24807 1706.29015 1722.25000 0.00058
252 8.26107 1704.42376 1681.00000 0.00059
253 8.27407 1702.57938 1681.00000 0.00059
254 8.28707 1700.77059 1648.35986 0.00061
255 8.30007 1699.01473 1705.68994 0.00059
256 8.31307 1697.45430 1648.35986 0.00061
257 8.32607 1696.23758 1780.84009 0.00056
258 8.33907 1695.56298 1624.08997 0.00062
259 8.35207 1695.61944 1689.20984 0.00059
260 8.36507 1696.95004 1713.96008 0.00058
261 8.37807 1699.17537 1681.00000 0.00059
262 8.39107 1702.10133 1656.49011 0.00060
263 8.40407 1705.65462 1697.44006 0.00059
264 8.41707 1709.93273 1656.49011 0.00060
265 8.43007 1715.01992 1747.23999 0.00057
266 8.44307 1720.91178 1738.89001 0.00058
267 8.45607 1727.73595 1713.96008 0.00058
268 8.46907 1735.81857 1713.96008 0.00058
269 8.48207 1745.93819 1764.00000 0.00057
270 8.49507 1758.25192 1755.61011 0.00057
271 8.50807 1773.46358 1730.55981 0.00058
272 8.52107 1792.44458 1814.75989 0.00055
273 8.53407 1820.51130 1797.76013 0.00056
274 8.54707 1858.59406 1866.24011 0.00054
275 8.56007 1907.69123 1936.00000 0.00052
276 8.57307 1967.51118 1989.15991 0.00050
277 8.58607 2027.80571 2088.48999 0.00048
278 8.59907 2044.33771 2218.40991 0.00045
279 8.61207 1999.96384 2070.25000 0.00048
280 8.62507 1897.41846 1918.43994 0.00052
281 8.63807 1789.32500 1780.84009 0.00056
282 8.65107 1718.54231 1689.20984 0.00059
283 8.66407 1676.19324 1584.03992 0.00063
284 8.67707 1656.19493 1600.00000 0.00063
285 8.69007 1648.53993 1624.08997 0.00062
286 8.70307 1644.62230 1632.16016 0.00061
287 8.71607 1641.60905 1608.00989 0.00062
288 8.72907 1639.04829 1560.25000 0.00064
289 8.74207 1636.71535 1536.64001 0.00065
290 8.75507 1634.55306 1640.25000 0.00061
291 8.76807 1632.46489 1648.35986 0.00061
292 8.78107 1630.43660 1616.04004 0.00062
293 8.79407 1628.45528 1616.04004 0.00062
294 8.80707 1626.51836 1584.03992 0.00063
295 8.82007 1624.60827 1536.64001 0.00065
296 8.83307 1622.71915 1560.25000 0.00064
297 8.84607 1620.84816 1608.00989 0.00062
298 8.85907 1618.99489 1600.00000 0.00063
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1809 28.50207 1312.66517 1274.49011 0.00078
1810 28.51507 1282.14654 1232.00989 0.00081
1811 28.52807 1256.30167 1211.03992 0.00083
1812 28.54107 1234.66356 1190.25000 0.00084
1813 28.55407 1218.04541 1218.01013 0.00082
1814 28.56707 1205.97725 1232.00989 0.00081
1815 28.58007 1197.96716 1190.25000 0.00084
1816 28.59307 1193.35749 1162.80994 0.00086
1817 28.60607 1192.01667 1197.15991 0.00084
1818 28.61907 1194.63727 1197.15991 0.00084
1819 28.63207 1202.81936 1183.36011 0.00085
1820 28.64507 1218.44802 1239.04004 0.00081
1821 28.65807 1245.76610 1281.63989 0.00078
1822 28.67107 1294.51101 1332.25000 0.00075
1823 28.68407 1368.63333 1391.28992 0.00072
1824 28.69707 1468.29283 1497.69006 0.00067
1825 28.71007 1595.89567 1632.16016 0.00061
1826 28.72307 1749.23993 1789.28992 0.00056
1827 28.73607 1897.34248 1953.64001 0.00051
1828 28.74907 2023.69907 1998.09009 0.00050
1829 28.76207 2113.60019 2052.08984 0.00049
1830 28.77507 2128.23423 2070.25000 0.00048
1831 28.78807 2081.72731 1989.15991 0.00050
1832 28.80107 2002.68591 1900.95984 0.00053
1833 28.81407 1905.05755 1831.83997 0.00055
1834 28.82707 1812.98687 1806.25000 0.00055
1835 28.84007 1724.86612 1730.55981 0.00058
1836 28.85307 1632.05265 1544.48999 0.00065
1837 28.86607 1536.69289 1536.64001 0.00065
1838 28.87907 1434.77962 1421.29004 0.00070
1839 28.89207 1355.68787 1339.55994 0.00075
1840 28.90507 1292.66703 1267.35986 0.00079
1841 28.91807 1243.42506 1204.09009 0.00083
1842 28.93107 1207.77336 1183.36011 0.00085
1843 28.94407 1185.77754 1204.09009 0.00083
1844 28.95707 1171.22827 1142.43994 0.00088
1845 28.97007 1161.83117 1169.64001 0.00085
1846 28.98307 1156.08234 1156.00000 0.00087
1847 28.99607 1152.91218 1169.64001 0.00085
1848 29.00907 1150.79936 1190.25000 0.00084
1849 29.02207 1149.37821 1176.48999 0.00085
1850 29.03507 1148.47504 1176.48999 0.00085
1851 29.04807 1148.01767 1169.64001 0.00085
1852 29.06107 1147.97901 1102.23999 0.00091
1853 29.07407 1148.23881 1122.25000 0.00089
1854 29.08707 1148.77747 1211.03992 0.00083
1855 29.10007 1149.60019 1102.23999 0.00091
1856 29.11307 1150.82004 1122.25000 0.00089
1857 29.12607 1152.35771 1204.09009 0.00083
1858 29.13907 1154.28419 1156.00000 0.00087
1859 29.15207 1156.68419 1142.43994 0.00088
1860 29.16507 1160.34523 1190.25000 0.00084
1861 29.17807 1165.90339 1156.00000 0.00087
1862 29.19107 1174.55484 1225.00000 0.00082
1863 29.20407 1187.59612 1246.08997 0.00080
1864 29.21707 1213.30771 1225.00000 0.00082
1865 29.23007 1256.22881 1288.81006 0.00078
1866 29.24307 1320.87641 1376.40991 0.00073
1867 29.25607 1411.87111 1513.21008 0.00066
1868 29.26907 1548.47425 1544.48999 0.00065
1869 29.28207 1714.28985 1697.44006 0.00059
1870 29.29507 1894.59514 1849.00000 0.00054
1871 29.30807 2076.98947 1989.15991 0.00050
1872 29.32107 2218.74864 2116.00000 0.00047
1873 29.33407 2295.01291 2209.00000 0.00045
1874 29.34707 2307.98562 2190.23999 0.00046
1875 29.36007 2259.43190 2106.81006 0.00047
1876 29.37307 2168.89202 2134.44019 0.00047
1877 29.38607 2093.57531 2061.16016 0.00049
1878 29.39907 2039.49571 2034.00989 0.00049
1879 29.41207 2006.25550 1998.09009 0.00050
1880 29.42507 1980.37618 1971.36011 0.00051
1881 29.43807 1961.77377 2061.16016 0.00049
1882 29.45107 1987.67809 2043.04004 0.00049
1883 29.46407 2066.04610 2079.35986 0.00048
1884 29.47707 2209.89881 2304.00000 0.00043
1885 29.49007 2434.37793 2490.01025 0.00040
1886 29.50307 2741.14305 2714.40991 0.00037
1887 29.51607 3075.46331 2959.36011 0.00034
1888 29.52907 3395.30226 3249.00000 0.00031
1889 29.54207 3647.50054 3552.15991 0.00028
1890 29.55507 3717.75397 3648.16016 0.00027
1891 29.56807 3605.15317 3540.25000 0.00028
1892 29.58107 3399.35995 3283.28979 0.00030
1893 29.59407 3143.29829 3047.04004 0.00033
1894 29.60707 2915.68803 2872.95972 0.00035
1895 29.62007 2731.98436 2621.44019 0.00038
1896 29.63307 2545.39158 2470.09009 0.00040
1897 29.64607 2308.39582 2246.76025 0.00045
1898 29.65907 1970.24450 1918.43994 0.00052
1899 29.67207 1751.93182 1730.55981 0.00058
1900 29.68507 1574.95582 1592.01013 0.00063
1901 29.69807 1434.41611 1451.60986 0.00069
1902 29.71107 1326.64020 1369.00000 0.00073
1903 29.72407 1255.80645 1303.20984 0.00077
1904 29.73707 1210.57665 1211.03992 0.00083
1905 29.75007 1180.64348 1169.64001 0.00085
1906 29.76307 1161.82126 1204.09009 0.00083
1907 29.77607 1150.61333 1183.36011 0.00085
1908 29.78907 1144.19454 1156.00000 0.00087
1909 29.80207 1139.98536 1176.48999 0.00085
1910 29.81507 1137.72836 1142.43994 0.00088
1911 29.82807 1138.44596 1102.23999 0.00091
1912 29.84107 1143.00131 1142.43994 0.00088
1913 29.85407 1152.54818 1176.48999 0.00085
1914 29.86707 1168.50855 1176.48999 0.00085
1915 29.88007 1197.16718 1176.48999 0.00085
1916 29.89307 1237.88235 1197.15991 0.00084
1917 29.90607 1288.66975 1288.81006 0.00078
1918 29.91907 1347.35220 1369.00000 0.00073
1919 29.93207 1407.99418 1428.83997 0.00070
1920 29.94507 1456.86192 1513.21008 0.00066
1921 29.95807 1488.26275 1544.48999 0.00065
1922 29.97107 1498.54899 1521.00000 0.00066
1923 29.98407 1481.82141 1528.80994 0.00065
1924 29.99707 1450.75317 1474.56006 0.00068
1925 30.01007 1424.32294 1451.60986 0.00069
1926 30.02307 1407.62800 1466.88989 0.00068
1927 30.03607 1404.39885 1489.95984 0.00067
1928 30.04907 1413.22582 1436.41016 0.00070
1929 30.06207 1431.07928 1421.29004 0.00070
1930 30.07507 1470.85981 1497.69006 0.00067
1931 30.08807 1545.61170 1528.80994 0.00065
1932 30.10107 1650.93463 1697.44006 0.00059
1933 30.11407 1765.77996 1849.00000 0.00054
1934 30.12707 1866.10350 2034.00989 0.00049
1935 30.14007 1938.72424 2106.81006 0.00047
1936 30.15307 1968.55198 2199.61011 0.00045
1937 30.16607 1925.66458 2134.44019 0.00047
1938 30.17907 1855.19139 1998.09009 0.00050
1939 30.19207 1775.34029 1883.56018 0.00053
1940 30.20507 1703.17502 1738.89001 0.00058
1941 30.21807 1646.58881 1738.89001 0.00058
1942 30.23107 1585.18528 1608.00989 0.00062
1943 30.24407 1501.49469 1521.00000 0.00066
1944 30.25707 1391.69005 1428.83997 0.00070
1945 30.27007 1319.37611 1317.68994 0.00076
1946 30.28307 1263.44252 1260.25000 0.00079
1947 30.29607 1220.67246 1204.09009 0.00083
1948 30.30907 1191.93622 1204.09009 0.00083
1949 30.32207 1180.42690 1218.01013 0.00082
1950 30.33507 1185.71979 1246.08997 0.00080
1951 30.34807 1207.82254 1288.81006 0.00078
1952 30.36107 1261.61773 1267.35986 0.00079
1953 30.37407 1350.03271 1428.83997 0.00070
1954 30.38707 1480.80773 1576.09009 0.00063
1955 30.40007 1657.84152 1722.25000 0.00058
1956 30.41307 1890.28275 1806.25000 0.00055
1957 30.42607 2147.14393 2246.76025 0.00045
1958 30.43907 2409.74419 2332.88989 0.00043
1959 30.45207 2646.24554 2683.23999 0.00037
1960 30.46507 2791.01875 2787.83984 0.00036
1961 30.47807 2843.32307 2840.88989 0.00035
1962 30.49107 2799.09132 2798.41016 0.00036
1963 30.50407 2681.85270 2662.55981 0.00038
1964 30.51707 2543.02410 2601.00000 0.00038
1965 30.53007 2396.90208 2460.15991 0.00041
1966 30.54307 2257.55065 2190.23999 0.00046
1967 30.55607 2114.08582 2097.63989 0.00048
1968 30.56907 1910.14044 1953.64001 0.00051
1969 30.58207 1744.80305 1806.25000 0.00055
1970 30.59507 1568.86044 1705.68994 0.00059
1971 30.60807 1424.65037 1474.56006 0.00068
1972 30.62107 1317.57327 1310.44006 0.00076
1973 30.63407 1236.37357 1246.08997 0.00080
1974 30.64707 1178.19767 1190.25000 0.00084
1975 30.66007 1136.71885 1190.25000 0.00084
1976 30.67307 1109.72524 1115.56006 0.00090
1977 30.68607 1091.90452 1082.41016 0.00092
1978 30.69907 1080.83513 1122.25000 0.00089
1979 30.71207 1073.06270 1142.43994 0.00088
1980 30.72507 1067.55004 1162.80994 0.00086
1981 30.73807 1063.31578 1122.25000 0.00089
1982 30.75107 1059.90609 1062.75989 0.00094
1983 30.76407 1056.94671 1075.83997 0.00093
1984 30.77707 1054.34622 1011.23993 0.00099
1985 30.79007 1052.01252 1075.83997 0.00093
1986 30.80307 1049.90220 1062.75989 0.00094
1987 30.81607 1047.97066 1036.84009 0.00096
1988 30.82907 1046.20899 1049.76013 0.00095
1989 30.84207 1044.59399 979.68994 0.00102
1990 30.85507 1043.10942 979.68994 0.00102
1991 30.86807 1041.73356 1024.00000 0.00098
1992 30.88107 1040.47856 1036.84009 0.00096
1993 30.89407 1039.33673 1082.41016 0.00092
1994 30.90707 1038.29634 1069.29004 0.00094
1995 30.92007 1037.35387 1075.83997 0.00093
1996 30.93307 1036.51538 992.25000 0.00101
1997 30.94607 1035.76686 992.25000 0.00101
1998 30.95907 1035.11896 1043.28992 0.00096
1999 30.97207 1034.56525 1030.40991 0.00097
2000 30.98507 1034.09461 985.95996 0.00101
2001 30.99807 1033.72080 1017.60999 0.00098
2002 31.01107 1033.48123 1062.75989 0.00094
2003 31.02407 1033.44694 1030.40991 0.00097
2004 31.03707 1033.85351 1024.00000 0.00098
2005 31.05007 1035.27804 1049.76013 0.00095
2006 31.06307 1038.09169 1049.76013 0.00095
2007 31.07607 1042.73590 1004.89008 0.00100
2008 31.08907 1050.05164 1011.23993 0.00099
2009 31.10207 1061.20616 1017.60999 0.00098
2010 31.11507 1074.76190 1024.00000 0.00098
2011 31.12807 1089.76906 1036.84009 0.00096
2012 31.14107 1105.10061 1062.75989 0.00094
2013 31.15407 1116.53630 1102.23999 0.00091
2014 31.16707 1122.59940 1102.23999 0.00091
2015 31.18007 1122.72117 1082.41016 0.00092
2016 31.19307 1116.76219 1075.83997 0.00093
2017 31.20607 1106.10566 1062.75989 0.00094
2018 31.21907 1096.81009 1017.60999 0.00098
2019 31.23207 1089.06616 1030.40991 0.00097
2020 31.24507 1082.51802 1043.28992 0.00096
2021 31.25807 1075.20236 1043.28992 0.00096
2022 31.27107 1060.81216 1049.76013 0.00095
2023 31.28407 1048.28984 1030.40991 0.00097
2024 31.29707 1039.03040 1017.60999 0.00098
2025 31.31007 1031.59954 1049.76013 0.00095
2026 31.32307 1025.94379 1082.41016 0.00092
2027 31.33607 1021.61948 985.95996 0.00101
2028 31.34907 1018.51206 961.00000 0.00104
2029 31.36207 1016.52246 985.95996 0.00101
2030 31.37507 1015.65323 1036.84009 0.00096
2031 31.38807 1015.39961 1043.28992 0.00096
2032 31.40107 1015.76997 1011.23993 0.00099
2033 31.41407 1017.08664 1036.84009 0.00096
2034 31.42707 1020.17255 1024.00000 0.00098
2035 31.44007 1025.74808 992.25000 0.00101
2036 31.45307 1034.78889 1004.89008 0.00100
2037 31.46607 1050.03189 1082.41016 0.00092
2038 31.47907 1075.25861 1075.83997 0.00093
2039 31.49207 1109.74023 1056.25000 0.00095
2040 31.50507 1153.36110 1082.41016 0.00092
2041 31.51807 1206.27185 1135.69006 0.00088
2042 31.53107 1261.74736 1190.25000 0.00084
2043 31.54407 1310.73554 1260.25000 0.00079
2044 31.55707 1348.22707 1274.49011 0.00078
2045 31.57007 1366.64727 1281.63989 0.00078
2046 31.58307 1355.67057 1332.25000 0.00075
2047 31.59607 1330.37721 1267.35986 0.00079
2048 31.60907 1298.18942 1232.00989 0.00081
2049 31.62207 1268.26364 1225.00000 0.00082
2050 31.63507 1246.04066 1149.21008 0.00087
2051 31.64807 1223.03620 1135.69006 0.00088
2052 31.66107 1191.16847 1142.43994 0.00088
2053 31.67407 1141.44905 1142.43994 0.00088
2054 31.68707 1105.65829 1049.76013 0.00095
2055 31.70007 1076.58175 1069.29004 0.00094
2056 31.71307 1052.87902 1011.23993 0.00099
2057 31.72607 1033.68902 1024.00000 0.00098
2058 31.73907 1020.57179 967.21002 0.00103
2059 31.75207 1011.11848 1011.23993 0.00099
2060 31.76507 1004.49616 973.44006 0.00103
2061 31.77807 1000.13529 1030.40991 0.00097
2062 31.79107 997.64353 1024.00000 0.00098
2063 31.80407 995.97895 1004.89008 0.00100
2064 31.81707 994.87462 1024.00000 0.00098
2065 31.83007 994.17018 973.44006 0.00103
2066 31.84307 993.77679 954.81000 0.00105
2067 31.85607 993.58264 985.95996 0.00101
2068 31.86907 993.56034 954.81000 0.00105
2069 31.88207 993.71435 967.21002 0.00103
2070 31.89507 994.11167 998.56000 0.00100
2071 31.90807 994.79588 1049.76013 0.00095
2072 31.92107 995.90754 1017.60999 0.00098
2073 31.93407 997.58651 1011.23993 0.00099
2074 31.94707 1000.93582 979.68994 0.00102
2075 31.96007 1006.67661 1043.28992 0.00096
2076 31.97307 1015.83629 1036.84009 0.00096
2077 31.98607 1029.46387 1069.29004 0.00094
2078 31.99907 1051.34035 1122.25000 0.00089
2079 32.01207 1081.41917 1142.43994 0.00088
2080 32.02507 1117.90594 1162.80994 0.00086
2081 32.03807 1159.20766 1142.43994 0.00088
2082 32.05107 1201.65309 1122.25000 0.00089
2083 32.06407 1236.07994 1149.21008 0.00087
2084 32.07707 1259.00805 1232.00989 0.00081
2085 32.09007 1268.16277 1204.09009 0.00083
2086 32.10307 1260.18619 1211.03992 0.00083
2087 32.11607 1240.05278 1218.01013 0.00082
2088 32.12907 1222.97830 1218.01013 0.00082
2089 32.14207 1211.42571 1225.00000 0.00082
2090 32.15507 1208.15155 1218.01013 0.00082
2091 32.16807 1210.27621 1281.63989 0.00078
2092 32.18107 1212.17544 1332.25000 0.00075
2093 32.19407 1233.18669 1354.23999 0.00074
2094 32.20707 1299.28533 1444.00000 0.00069
2095 32.22007 1412.43440 1505.43994 0.00066
2096 32.23307 1581.17043 1713.96008 0.00058
2097 32.24607 1817.55877 1962.48999 0.00051
2098 32.25907 2110.65670 2199.61011 0.00045
2099 32.27207 2422.99029 2490.01025 0.00040
2100 32.28507 2724.29784 2840.88989 0.00035
2101 32.29807 2959.32904 3158.44019 0.00032
2102 32.31107 3075.66600 3226.23999 0.00031
2103 32.32407 3063.28535 3192.25000 0.00031
2104 32.33707 2946.39637 3091.35986 0.00032
2105 32.35007 2753.54400 2840.88989 0.00035
2106 32.36307 2593.46463 2672.89014 0.00037
2107 32.37607 2474.54946 2540.16016 0.00039
2108 32.38907 2378.14072 2371.69019 0.00042
2109 32.40207 2270.42799 2265.75977 0.00044
2110 32.41507 2072.91287 2190.23999 0.00046
2111 32.42807 1929.96728 2088.48999 0.00048
2112 32.44107 1830.55419 1962.48999 0.00051
2113 32.45407 1756.88089 1823.29004 0.00055
2114 32.46707 1696.79205 1738.89001 0.00058
2115 32.48007 1634.40003 1697.44006 0.00059
2116 32.49307 1566.39115 1608.00989 0.00062
2117 32.50607 1495.43776 1489.95984 0.00067
2118 32.51907 1422.16234 1398.76013 0.00071
2119 32.53207 1367.21113 1354.23999 0.00074
2120 32.54507 1324.40046 1324.96008 0.00075
2121 32.55807 1288.43306 1288.81006 0.00078
2122 32.57107 1253.13004 1218.01013 0.00082
2123 32.58407 1189.52877 1176.48999 0.00085
2124 32.59707 1138.81133 1142.43994 0.00088
2125 32.61007 1098.18484 1095.60986 0.00091
2126 32.62307 1064.12198 1056.25000 0.00095
2127 32.63607 1038.81104 1049.76013 0.00095
2128 32.64907 1020.49202 1024.00000 0.00098
2129 32.66207 1009.28642 1036.84009 0.00096
2130 32.67507 1005.71612 1030.40991 0.00097
2131 32.68807 1012.94838 979.68994 0.00102
2132 32.70107 1032.89406 1043.28992 0.00096
2133 32.71407 1066.44653 1115.56006 0.00090
2134 32.72707 1114.87923 1176.48999 0.00085
2135 32.74007 1179.82683 1197.15991 0.00084
2136 32.75307 1261.10275 1317.68994 0.00076
2137 32.76607 1344.19370 1444.00000 0.00069
2138 32.77907 1420.09893 1521.00000 0.00066
2139 32.79207 1479.87536 1576.09009 0.00063
2140 32.80507 1504.08204 1648.35986 0.00061
2141 32.81807 1488.80924 1640.25000 0.00061
2142 32.83107 1447.15544 1513.21008 0.00066
2143 32.84407 1391.88065 1474.56006 0.00068
2144 32.85707 1344.14410 1421.29004 0.00070
2145 32.87007 1305.34354 1354.23999 0.00074
2146 32.88307 1267.59982 1310.44006 0.00076
2147 32.89607 1223.56017 1211.03992 0.00083
2148 32.90907 1168.00597 1156.00000 0.00087
2149 32.92207 1116.85028 1122.25000 0.00089
2150 32.93507 1072.81831 1049.76013 0.00095
2151 32.94807 1035.05465 1024.00000 0.00098
2152 32.96107 1003.57827 1024.00000 0.00098
2153 32.97407 979.63452 1030.40991 0.00097
2154 32.98707 963.26375 942.49005 0.00106
2155 33.00007 951.49552 918.08997 0.00109
2156 33.01307 943.38612 882.09003 0.00113
2157 33.02607 938.00025 930.25000 0.00107
2158 33.03907 934.72974 961.00000 0.00104
2159 33.05207 932.32371 876.16003 0.00114
2160 33.06507 930.50143 918.08997 0.00109
2161 33.07807 929.07790 894.00995 0.00112
2162 33.09107 927.97648 846.81000 0.00118
2163 33.10407 927.10317 912.04004 0.00110
2164 33.11707 926.42240 900.00000 0.00111
2165 33.13007 925.95001 900.00000 0.00111
2166 33.14307 925.89538 942.49005 0.00106
2167 33.15607 926.58065 912.04004 0.00110
2168 33.16907 928.33357 894.00995 0.00112
2169 33.18207 931.58437 942.49005 0.00106
2170 33.19507 937.59624 936.36005 0.00107
2171 33.20807 947.62088 900.00000 0.00111
2172 33.22107 961.33582 948.63995 0.00105
2173 33.23407 978.58202 942.49005 0.00106
2174 33.24707 999.13144 954.81000 0.00105
2175 33.26007 1020.09254 1004.89008 0.00100
2176 33.27307 1037.94973 1049.76013 0.00095
2177 33.28607 1050.74420 1017.60999 0.00098
2178 33.29907 1056.54640 1082.41016 0.00092
2179 33.31207 1049.85754 1062.75989 0.00094
2180 33.32507 1037.36479 1082.41016 0.00092
2181 33.33807 1023.26248 942.49005 0.00106
2182 33.35107 1010.92371 992.25000 0.00101
2183 33.36407 1000.88489 967.21002 0.00103
2184 33.37707 991.05135 936.36005 0.00107
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