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3 mol 0 unq 3 iso 0 dist 7.15528 8.81979 5.52201 7.40865 9.46298 6.11501 numMergedOcc 0
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10 mol 19 unq 1 iso 0 dist 7.20519 8.23643 11.0832 7.75618 4.96411 14.4867 numMergedOcc 0
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14 mol 19 unq 5 iso 0 dist 4.54938 8.23643 6.55187 7.75618 9.74255 14.4867 numMergedOcc 0
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20 mol 19 unq 11 iso 0 dist 6.864 7.82528 4.69858 7.75618 7.08342 11.4087 numMergedOcc 0
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58 mol 100 unq 6 iso 0 dist 7.47343 7.75343 15.209 8.76378 15.5385 4.44538 numMergedOcc 0
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