1<?xml version="1.0"?> 2<?xml-stylesheet type="text/xsl" href="http://cdk.svn.sourceforge.net/viewvc/*checkout*/cdk/trunk/cdk/src/org/openscience/cdk/config/data/html.xsl?content-type=text%2Fxml"?> 3<atomTypeList xmlns="http://www.xml-cml.org/schema" 4 xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" 5 xsi:schemaLocation="http://www.xml-cml.org/schema ../../io/cml/data/cml25b1.xsd" 6 7 xmlns:cvs="https://www.cvshome.org/" 8 xmlns:cdk="http://cdk.sf.net/dict/cdk/" 9 10 id="structgen" title="StructGen AtomTypes"> 11 12 <metadataList> 13 <metadata name="cvs:last-change-by" content="$Author$"/> 14 <metadata name="cvs:date" content="$Date$"/> 15 <metadata name="cvs:revision" content="$Revision$"/> 16 </metadataList> 17 18 <atomType id="Na1"> 19 <atom elementType="Na"> 20 <scalar dataType="xsd:double" dictRef="cdk:maxBondOrder">1.0</scalar> 21 <scalar dataType="xsd:double" dictRef="cdk:bondOrderSum">1.0</scalar> 22 </atom> 23 </atomType> 24 <atomType id="H1"> 25 <atom elementType="H"> 26 <scalar dataType="xsd:double" dictRef="cdk:maxBondOrder">1.0</scalar> 27 <scalar dataType="xsd:double" dictRef="cdk:bondOrderSum">1.0</scalar> 28 </atom> 29 </atomType> 30 <atomType id="C4"> 31 <atom elementType="C"> 32 <scalar dataType="xsd:double" dictRef="cdk:maxBondOrder">3.0</scalar> 33 <scalar dataType="xsd:double" dictRef="cdk:bondOrderSum">4.0</scalar> 34 </atom> 35 </atomType> 36 <atomType id="B3"> 37 <atom elementType="B"> 38 <scalar dataType="xsd:double" dictRef="cdk:maxBondOrder">2.0</scalar> 39 <scalar dataType="xsd:double" dictRef="cdk:bondOrderSum">3.0</scalar> 40 </atom> 41 </atomType> 42 <atomType id="Si4"> 43 <atom elementType="Si"> 44 <scalar dataType="xsd:double" dictRef="cdk:maxBondOrder">3.0</scalar> 45 <scalar dataType="xsd:double" dictRef="cdk:bondOrderSum">4.0</scalar> 46 </atom> 47 </atomType> 48 <atomType id="N3"> 49 <atom elementType="N"> 50 <scalar dataType="xsd:double" dictRef="cdk:maxBondOrder">3.0</scalar> 51 <scalar dataType="xsd:double" dictRef="cdk:bondOrderSum">3.0</scalar> 52 </atom> 53 </atomType> 54 <atomType id="N5"> 55 <atom elementType="N"> 56 <scalar dataType="xsd:double" dictRef="cdk:maxBondOrder">2.0</scalar> 57 <scalar dataType="xsd:double" dictRef="cdk:bondOrderSum">5.0</scalar> 58 </atom> 59 </atomType> 60 <atomType id="O2"> 61 <atom elementType="O"> 62 <scalar dataType="xsd:double" dictRef="cdk:maxBondOrder">2.0</scalar> 63 <scalar dataType="xsd:double" dictRef="cdk:bondOrderSum">2.0</scalar> 64 </atom> 65 </atomType> 66 <atomType id="P3"> 67 <atom elementType="P"> 68 <scalar dataType="xsd:double" dictRef="cdk:maxBondOrder">3.0</scalar> 69 <scalar dataType="xsd:double" dictRef="cdk:bondOrderSum">3.0</scalar> 70 </atom> 71 </atomType> 72 <atomType id="P4"> 73 <atom elementType="P"> 74 <scalar dataType="xsd:double" dictRef="cdk:maxBondOrder">3.0</scalar> 75 <scalar dataType="xsd:double" dictRef="cdk:bondOrderSum">5.0</scalar> 76 </atom> 77 </atomType> 78 <atomType id="S2"> 79 <atom elementType="S"> 80 <scalar dataType="xsd:double" dictRef="cdk:maxBondOrder">2.0</scalar> 81 <scalar dataType="xsd:double" dictRef="cdk:bondOrderSum">2.0</scalar> 82 </atom> 83 </atomType> 84 <atomType id="S3"> 85 <atom elementType="S"> 86 <scalar dataType="xsd:double" dictRef="cdk:maxBondOrder">2.0</scalar> 87 <scalar dataType="xsd:double" dictRef="cdk:bondOrderSum">4.0</scalar> 88 </atom> 89 </atomType> 90 <atomType id="S4"> 91 <atom elementType="S"> 92 <scalar dataType="xsd:double" dictRef="cdk:maxBondOrder">2.0</scalar> 93 <scalar dataType="xsd:double" dictRef="cdk:bondOrderSum">6.0</scalar> 94 </atom> 95 </atomType> 96 <atomType id="Se2"> 97 <atom elementType="Se"> 98 <scalar dataType="xsd:double" dictRef="cdk:maxBondOrder">2.0</scalar> 99 <scalar dataType="xsd:double" dictRef="cdk:bondOrderSum">2.0</scalar> 100 </atom> 101 </atomType> 102 <atomType id="F1"> 103 <atom elementType="F"> 104 <scalar dataType="xsd:double" dictRef="cdk:maxBondOrder">1.0</scalar> 105 <scalar dataType="xsd:double" dictRef="cdk:bondOrderSum">1.0</scalar> 106 </atom> 107 </atomType> 108 <atomType id="Cl1"> 109 <atom elementType="Cl"> 110 <scalar dataType="xsd:double" dictRef="cdk:maxBondOrder">1.0</scalar> 111 <scalar dataType="xsd:double" dictRef="cdk:bondOrderSum">1.0</scalar> 112 </atom> 113 </atomType> 114 <atomType id="Br1"> 115 <atom elementType="Br"> 116 <scalar dataType="xsd:double" dictRef="cdk:maxBondOrder">1.0</scalar> 117 <scalar dataType="xsd:double" dictRef="cdk:bondOrderSum">1.0</scalar> 118 </atom> 119 </atomType> 120 <atomType id="I1"> 121 <atom elementType="I"> 122 <scalar dataType="xsd:double" dictRef="cdk:maxBondOrder">1.0</scalar> 123 <scalar dataType="xsd:double" dictRef="cdk:bondOrderSum">1.0</scalar> 124 </atom> 125 </atomType> 126 <atomType id="Li1"> 127 <atom elementType="Li"> 128 <scalar dataType="xsd:double" dictRef="cdk:maxBondOrder">1.0</scalar> 129 <scalar dataType="xsd:double" dictRef="cdk:bondOrderSum">1.0</scalar> 130 </atom> 131 </atomType> 132 133 134 <atomType id="As3"> 135 <atom elementType="As"> 136 <scalar dataType="xsd:double" dictRef="cdk:maxBondOrder">1.0</scalar> 137 <scalar dataType="xsd:double" dictRef="cdk:bondOrderSum">3.0</scalar> 138 </atom> 139 </atomType> 140 141 142 143</atomTypeList> 144