12 12 1 1
0.2982869E+02 0.7921859E-09 0.4684117E-09 0.9646297E-09 0.5000000E-15
1.000000000000000E-004
CAR
(PbBr2)4 (Pnma) ~ PbBr2.cif (VASP)
112 8 70
0.0000000E+00 0.0000000E+00 0.0000000E+00 0.8333333E-01
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0.5000000E+00 0.0000000E+00 0.0000000E+00 0.8333333E-01
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31 -4.196055683 1.000000
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33 -0.513084097 1.000000
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35 -0.229359160 1.000000
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37 -0.167401718 1.000000
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39 0.333982659 1.000000
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50 1.692817786 1.000020
51 1.869553450 1.001958
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53 1.918968790 1.005109
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55 2.078960881 1.033943
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57 5.459875026 -0.000000
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0.0000000E+00 0.3333333E+00 0.0000000E+00 0.1666667E+00
1 -13.489882833 1.000000
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18 -13.408066333 1.000000
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49 1.673831550 1.000011
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51 1.775659886 1.000213
52 1.782680349 1.000256
53 1.975047744 1.012544
54 2.075197594 1.033419
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56 2.280099911 0.760218
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0.5000000E+00 0.3333333E+00 0.0000000E+00 0.1666667E+00
1 -13.487470760 1.000000
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7 -13.432011081 1.000000
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11 -13.417997080 1.000000
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13 -13.414481976 1.000000
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15 -13.410782730 1.000000
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17 -13.408591473 1.000000
18 -13.408591473 1.000000
19 -13.407656184 1.000000
20 -13.407656184 1.000000
21 -11.325318041 1.000000
22 -11.325318041 1.000000
23 -11.106697599 1.000000
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25 -10.945891092 1.000000
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27 -10.807552032 1.000000
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31 -4.564303786 1.000000
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33 -0.835180185 1.000000
34 -0.835180185 1.000000
35 -0.764042952 1.000000
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51 1.673943169 1.000011
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53 1.696882312 1.000023
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55 2.195841791 0.975271
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57 5.648749627 -0.000000
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61 6.710183762 0.000000
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69 10.552490164 0.000000
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0.0000000E+00 0.0000000E+00 0.5000000E+00 0.8333333E-01
1 -13.492355729 1.000000
2 -13.492355729 1.000000
3 -13.447230904 1.000000
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5 -13.438747577 1.000000
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9 -13.420619157 1.000000
10 -13.420619157 1.000000
11 -13.420575886 1.000000
12 -13.420575885 1.000000
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31 -4.028732302 1.000000
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33 -0.749740778 1.000000
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35 -0.388594094 1.000000
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37 0.175790204 1.000000
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51 1.538408828 1.000000
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53 1.735832661 1.000072
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55 1.983409429 1.014075
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57 5.621649085 -0.000000
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63 6.565730547 0.000000
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65 7.165264510 0.000000
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0.5000000E+00 0.0000000E+00 0.5000000E+00 0.8333333E-01
1 -13.490037972 1.000000
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11 -13.420898372 1.000000
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0.0000000E+00 0.3333333E+00 0.5000000E+00 0.1666667E+00
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