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Exo-29.xyz 653 Bytes
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Gao, Xiang's avatar
Add xyz files to be used in future tests (#164)  
Gao, Xiang committed
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 comment:c
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C -1.2781540 -0.6560270 0.6644750
C 1.9082940 -0.6298250 1.5266550
C 2.0485599 -1.6977100 0.7372240
C 2.0485620 -1.6977100 -0.7372200
C 1.9082950 -0.6298260 -1.5266520
H 1.8028630 0.3785220 1.1301810
H 2.1689720 -2.6740041 1.2055060
H 2.1689770 -2.6740050 -1.2055020
H 1.8028620 0.3785200 -1.1301790
H 1.9145440 -0.7215190 2.6086960
H 1.9145490 -0.7215200 -2.6086929
H -1.3884370 -1.4763310 1.3611270
H -1.3884360 -1.4763319 -1.3611280
C -1.0735660 0.7473380 -1.1256750
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C -1.0735660 0.7473390 1.1256731
O -1.0126719 1.1887209 2.2325909
O -0.9499490 1.5442040 -0.0000010