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QuantumPackage/tests/input/h2o2.zmt

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2019-01-25 11:39:31 +01:00
o
o 1 oo
h 1 ho 2 hoo
h 2 ho 1 hoo 3 dih
oo 1.475
ho 0.95
hoo 94.8
dih 119.8