95 lines
9.2 KiB
Plaintext
95 lines
9.2 KiB
Plaintext
92
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Ag Ag pos(A), vel, pot-en(eV)
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Ag -38.72818 -42.43091 19.00622 0.0000 0.0000 0.0000 -2.9272
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Ag -40.12630 -43.85210 21.08738 -0.0017 -0.0017 -0.0017 -2.8775
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Ag -42.15400 -41.92099 21.26363 -0.0041 -0.0041 -0.0041 -2.8779
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Ag -39.01616 -40.43568 16.98587 0.0014 0.0014 0.0014 -2.9172
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Ag -36.42431 -41.26778 17.95466 -0.0019 -0.0019 -0.0019 -2.8985
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Ag -37.92762 -43.13905 22.63347 0.0016 0.0016 0.0016 -2.8881
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Ag -41.61133 -43.24409 18.71417 0.0009 0.0009 0.0009 -2.9313
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Ag -34.86691 -43.29281 19.27093 0.0033 0.0033 0.0033 -2.8779
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Ag -40.90835 -40.43998 19.09424 -0.0019 -0.0019 -0.0019 -2.9192
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Ag -38.68955 -45.93798 22.24453 -0.0015 -0.0015 -0.0015 -2.6798
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Ag -39.42903 -45.19323 18.87005 0.0021 0.0021 0.0021 -2.8986
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Ag -36.46608 -41.50255 20.87550 -0.0019 -0.0019 -0.0019 -2.8768
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Ag -37.95835 -39.44485 19.63939 -0.0002 -0.0002 -0.0002 -2.7907
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Ag -41.38079 -45.40148 22.99833 0.0007 0.0007 0.0007 -2.4608
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Ag -41.46147 -39.19076 21.70629 0.0002 0.0002 0.0002 -2.6645
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Ag -39.99252 -41.49193 14.23587 -0.0019 -0.0019 -0.0019 -2.6676
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Ag -35.85741 -42.07873 11.83918 -0.0007 -0.0007 -0.0007 -2.2332
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Ag -36.84465 -43.99042 25.99169 -0.0048 -0.0048 -0.0048 -2.2356
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Ag -45.82439 -42.06348 22.91224 0.0007 0.0007 0.0007 -2.1589
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Ag -38.31349 -47.61311 19.74657 0.0013 0.0013 0.0013 -2.4419
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Ag -44.82299 -40.35830 14.31775 -0.0005 -0.0005 -0.0005 -2.2471
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Ag -40.25395 -47.84343 18.18419 0.0019 0.0019 0.0019 -2.2801
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Ag -42.26615 -39.64344 14.24426 0.0012 0.0012 0.0012 -2.4018
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Ag -34.38114 -40.50529 22.44655 0.0024 0.0024 0.0024 -2.5348
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Ag -40.37080 -37.80218 19.47036 0.0036 0.0036 0.0036 -2.5640
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Ag -40.70631 -42.50819 23.58873 0.0004 0.0004 0.0004 -2.7333
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Ag -41.02200 -46.86599 20.57203 -0.0002 -0.0002 -0.0002 -2.5252
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Ag -38.50184 -41.98452 24.98069 0.0005 0.0005 0.0005 -2.4729
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Ag -45.77690 -39.44239 18.92791 0.0018 0.0018 0.0018 -2.4646
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Ag -42.78319 -44.70809 20.77405 0.0009 0.0009 0.0009 -2.6587
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Ag -40.35353 -45.95620 16.21610 -0.0009 -0.0009 -0.0009 -2.6069
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Ag -36.36444 -45.14330 23.78312 0.0023 0.0023 0.0023 -2.6078
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Ag -42.26310 -45.95350 18.25825 -0.0005 -0.0005 -0.0005 -2.5821
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Ag -43.65954 -41.30114 18.92210 -0.0007 -0.0007 -0.0007 -2.8956
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Ag -35.66182 -45.98418 15.71931 -0.0011 -0.0011 -0.0011 -2.5485
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Ag -37.27886 -40.27778 23.05914 -0.0021 -0.0021 -0.0021 -2.6572
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Ag -34.80208 -43.63313 22.07414 0.0013 0.0013 0.0013 -2.9454
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Ag -35.89948 -38.58831 21.15032 0.0003 0.0003 0.0003 -2.5189
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Ag -38.88064 -38.34522 21.79960 0.0002 0.0002 0.0002 -2.5297
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Ag -31.27795 -44.13252 16.50663 0.0012 0.0012 0.0012 -2.2285
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Ag -35.01985 -43.15120 16.26536 0.0032 0.0032 0.0032 -2.9209
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Ag -37.25984 -44.49135 20.29452 0.0006 0.0006 0.0006 -2.8591
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Ag -35.99988 -46.24200 18.59036 0.0020 0.0020 0.0020 -2.6525
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Ag -37.50704 -40.34062 13.24310 0.0008 0.0008 0.0008 -2.4778
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Ag -36.63441 -39.32040 15.78863 -0.0012 -0.0012 -0.0012 -2.5961
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Ag -36.17911 -46.78566 21.35740 0.0034 0.0034 0.0034 -2.5170
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Ag -31.61681 -44.18032 19.40436 -0.0015 -0.0015 -0.0015 -2.3995
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Ag -40.59542 -44.09492 14.05572 0.0017 0.0017 0.0017 -2.4539
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Ag -39.96983 -43.29331 16.43293 0.0013 0.0013 0.0013 -2.8313
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Ag -37.50360 -44.33713 17.13302 -0.0008 -0.0008 -0.0008 -2.8608
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Ag -34.30754 -40.46476 19.50246 -0.0030 -0.0030 -0.0030 -2.6793
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Ag -35.92628 -38.50238 18.16741 0.0028 0.0028 0.0028 -2.5353
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Ag -41.27850 -38.66964 16.78196 0.0002 0.0002 0.0002 -2.6426
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Ag -37.96764 -47.06871 16.95033 -0.0010 -0.0010 -0.0010 -2.5351
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Ag -43.17619 -38.70637 19.15988 -0.0017 -0.0017 -0.0017 -2.5105
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Ag -38.51123 -37.80431 17.12820 -0.0016 -0.0016 -0.0016 -2.5333
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Ag -38.19640 -45.21364 14.63778 0.0010 0.0010 0.0010 -2.6023
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Ag -39.09737 -44.60538 24.71534 0.0002 0.0002 0.0002 -2.4681
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Ag -35.12175 -41.29046 14.18070 0.0000 0.0000 0.0000 -2.5962
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Ag -37.44608 -42.13311 15.37641 0.0009 0.0009 0.0009 -2.9138
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Ag -35.70613 -42.23133 24.22562 0.0004 0.0004 0.0004 -2.6676
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Ag -46.98647 -40.97882 20.78432 -0.0007 -0.0007 -0.0007 -2.2238
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Ag -33.35230 -44.68481 14.65415 -0.0009 -0.0009 -0.0009 -2.4525
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Ag -39.55799 -38.97293 14.50126 -0.0004 -0.0004 -0.0004 -2.4031
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Ag -41.88926 -41.30434 16.60946 -0.0029 -0.0029 -0.0029 -2.8803
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Ag -34.22315 -40.28561 16.61228 0.0003 0.0003 0.0003 -2.5665
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Ag -46.42205 -42.18780 18.40621 -0.0014 -0.0014 -0.0014 -2.4708
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Ag -38.26535 -43.09130 12.81387 -0.0010 -0.0010 -0.0010 -2.4917
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Ag -44.73676 -42.37126 16.17829 0.0003 0.0003 0.0003 -2.6222
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Ag -39.42913 -41.08305 21.45659 0.0047 0.0047 0.0047 -2.9270
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Ag -39.76894 -39.69783 24.01896 -0.0012 -0.0012 -0.0012 -2.3832
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Ag -37.66286 -36.79013 19.63652 0.0000 0.0000 0.0000 -2.3075
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Ag -34.01291 -46.29494 22.99000 0.0040 0.0040 0.0040 -2.3567
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Ag -42.95909 -40.88232 23.58731 0.0018 0.0018 0.0018 -2.3663
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Ag -32.82919 -42.35612 23.72721 0.0001 0.0001 0.0001 -2.3458
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Ag -32.47913 -41.95837 21.06930 -0.0002 -0.0002 -0.0002 -2.5000
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Ag -44.48784 -44.26296 18.19200 -0.0015 -0.0015 -0.0015 -2.5014
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Ag -33.84643 -45.70336 20.23852 -0.0028 -0.0028 -0.0028 -2.6103
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Ag -34.12185 -44.33526 24.96419 -0.0003 -0.0003 -0.0003 -2.3624
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Ag -33.46718 -45.10286 17.60679 -0.0017 -0.0017 -0.0017 -2.6140
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Ag -43.50389 -43.56676 23.12370 -0.0003 -0.0003 -0.0003 -2.4698
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Ag -33.31177 -42.70109 12.82282 0.0012 0.0012 0.0012 -2.2100
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Ag -42.70997 -44.29649 15.99855 -0.0047 -0.0047 -0.0047 -2.6304
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Ag -32.76435 -42.26895 17.92479 -0.0014 -0.0014 -0.0014 -2.6190
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Ag -32.12919 -44.48219 22.15169 0.0005 0.0005 0.0005 -2.4155
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Ag -42.67581 -42.17738 14.22176 0.0003 0.0003 0.0003 -2.4575
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Ag -44.98714 -43.03193 20.63989 -0.0017 -0.0017 -0.0017 -2.6067
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Ag -32.33081 -41.79503 15.36200 0.0035 0.0035 0.0035 -2.3820
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Ag -46.51772 -40.29614 16.43371 0.0014 0.0014 0.0014 -2.2551
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Ag -44.24007 -39.97760 21.42463 -0.0031 -0.0031 -0.0031 -2.6065
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Ag -35.92489 -44.18283 13.57058 -0.0010 -0.0010 -0.0010 -2.6082
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Ag -43.88344 -39.37891 16.77775 0.0016 0.0016 0.0016 -2.6139
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