1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33
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TITLE
Coordinate of a water molecule
END
TIMESTEP
0 0.000000000
END
POSITIONRED
0.1941767 -0.0136074 -0.2917594
-0.4915838 -0.4480844 -1.4087115
0.1349280 1.0427680 -0.4088006
END
GENBOX
1
2.898752912 2.898752912 2.898752912
90.000000000 90.000000000 90.000000000
0.000000000 0.000000000 0.000000000
0.000000000 0.000000000 0.000000000
END
TIMESTEP
500 1.000000000
END
POSITIONRED
0.1941767 -0.0136074 -0.2917594
-0.4915838 -0.4480844 -1.4087115
0.1349280 1.0427680 -0.4088006
END
GENBOX
1
2.898752912 2.898752912 2.898752912
90.000000000 90.000000000 90.000000000
0.000000000 0.000000000 0.000000000
0.000000000 0.000000000 0.000000000
END
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