/usr/share/avogadro/fragments/cyclic alkanes/norbornane.cml is in avogadro-data 1.0.3-5.
This file is owned by root:root, with mode 0o644.
The actual contents of the file can be viewed below.
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 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 | <?xml version="1.0" encoding="UTF-8"?>
<molecule xmlns="http://www.xml-cml.org/schema"
xmlns:cml="http://www.xml-cml.org/dict/cml"
xmlns:units="http://www.xml-cml.org/units/units"
xmlns:xsd="http://www.w3c.org/2001/XMLSchema"
xmlns:iupac="http://www.iupac.org"
id="CS_bicyclo_2_2_1_heptane">
<formula concise=" C 7 H 12 "/>
<identifier convention="iupac:inchi" value="1/C7H12/c1-2-7-4-3-6(1)5-7/h6-7H,1-5H2/t6-,7+"/>
<name convention="IUPAC">Bicyclo[2.2.1]heptane</name>
<atomArray>
<atom id="a1" elementType="C" x3="0.971963" y3="1.078499" z3="0.508534"/>
<atom id="a2" elementType="C" x3="1.282830" y3="-0.415418" z3="0.740485"/>
<atom id="a3" elementType="C" x3="0.288296" y3="-1.138574" z3="-0.190349"/>
<atom id="a4" elementType="C" x3="-1.124766" y3="-0.968559" z3="0.403851"/>
<atom id="a5" elementType="C" x3="-1.435567" y3="0.525339" z3="0.171844"/>
<atom id="a6" elementType="C" x3="-0.167416" y3="1.051765" z3="-0.530581"/>
<atom id="a7" elementType="C" x3="0.232828" y3="-0.167446" z3="-1.389929"/>
<atom id="a8" elementType="H" x3="1.850851" y3="1.622663" z3="0.120231"/>
<atom id="a9" elementType="H" x3="0.674482" y3="1.596488" z3="1.436999"/>
<atom id="a10" elementType="H" x3="1.155441" y3="-0.713894" z3="1.795703"/>
<atom id="a11" elementType="H" x3="2.326000" y3="-0.661187" z3="0.474618"/>
<atom id="a12" elementType="H" x3="0.560495" y3="-2.183841" z3="-0.420167"/>
<atom id="a13" elementType="H" x3="-1.161931" y3="-1.246268" z3="1.471694"/>
<atom id="a14" elementType="H" x3="-1.852568" y3="-1.621183" z3="-0.109585"/>
<atom id="a15" elementType="H" x3="-1.642591" y3="1.064201" z3="1.112918"/>
<atom id="a16" elementType="H" x3="-2.327725" y3="0.662432" z3="-0.464187"/>
<atom id="a17" elementType="H" x3="-0.310732" y3="2.004163" z3="-1.070825"/>
<atom id="a18" elementType="H" x3="1.196516" y3="-0.047815" z3="-1.911012"/>
<atom id="a19" elementType="H" x3="-0.516407" y3="-0.441366" z3="-2.150243"/>
</atomArray>
<bondArray>
<bond atomRefs2="a1 a2" order="1"/>
<bond atomRefs2="a2 a3" order="1"/>
<bond atomRefs2="a3 a4" order="1"/>
<bond atomRefs2="a4 a5" order="1"/>
<bond atomRefs2="a1 a6" order="1"/>
<bond atomRefs2="a6 a5" order="1"/>
<bond atomRefs2="a6 a7" order="1"/>
<bond atomRefs2="a7 a3" order="1"/>
<bond atomRefs2="a1 a8" order="1"/>
<bond atomRefs2="a1 a9" order="1"/>
<bond atomRefs2="a2 a10" order="1"/>
<bond atomRefs2="a2 a11" order="1"/>
<bond atomRefs2="a3 a12" order="1"/>
<bond atomRefs2="a4 a13" order="1"/>
<bond atomRefs2="a4 a14" order="1"/>
<bond atomRefs2="a5 a15" order="1"/>
<bond atomRefs2="a5 a16" order="1"/>
<bond atomRefs2="a6 a17" order="1"/>
<bond atomRefs2="a7 a18" order="1"/>
<bond atomRefs2="a7 a19" order="1"/>
</bondArray>
<propertyList>
<property dictRef="cml:molwt" title="Molecular weight">
<scalar dataType="xsd:double" dictRef="cml:molwt" units="units:g">96.1702</scalar>
</property>
<property dictRef="cml:monoisotopicwt" title="Monoisotopic weight">
<scalar dataType="xsd:double" dictRef="cml:monoisotopicwt" units="units:g">96.0939004</scalar>
</property>
<property dictRef="cml:mp" title="Melting point">
<scalar dataType="xsd:double" errorValue="1.0" dictRef="cml:mp" units="units:celsius">86</scalar>
</property>
</propertyList>
</molecule>
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