File: test0.xyz

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rdkit 202209.3-1
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file content (22 lines) | stat: -rw-r--r-- 820 bytes parent folder | download | duplicates (10)
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C[C-](c1ccccc1)C
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C      0.824867    1.209444   -0.237213
C     -2.157301    1.260480    0.011469
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H     -1.908591   -2.008422   -0.478887
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H      2.833863   -2.093569    0.045212
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H      2.737506    2.153999   -0.531231
H      0.302800    2.152361   -0.322248
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H     -1.993201    1.721252   -0.985019
H     -3.246246    1.082038    0.129404