Files
rdkit/Python/Chem/tests/atom-query.cdxml
Greg Landrum 75a79b6327 initial import
2006-05-06 22:20:08 +00:00

125 lines
2.1 KiB
XML
Executable File

<?xml version="1.0" encoding="UTF-8" ?>
<!DOCTYPE CDXML SYSTEM "http://www.camsoft.com/xml/cdxml.dtd" >
<CDXML
CreationProgram="ChemDraw 6.0.1"
Name="atom-query.cdxml"
BoundingBox="197 187 258 257"
WindowPosition="156 269"
WindowSize="794 567"
WindowIsZoomed="yes"
FractionalWidths="yes"
LabelFont="3"
LabelSize="10"
LabelFace="96"
CaptionFont="4"
CaptionSize="12"
HashSpacing="2.7"
MarginWidth="2"
LineWidth="1"
BoldWidth="4"
BondLength="30"
BondSpacing="12"
ChainAngle="120"
PrintMargins="36 36 36 36"
MacPrintInfo="0003000001220122000000000C150910FFD0FFB80C4609590367052803FC0002000001220122000000000C150910000100640064000000010001010100000001270F000100010000000000000000000000000002001901900000000000600000000000000000000100000000000000000000000000000000"
><colortable>
<color r="1" g="1" b="1"/>
<color r="0" g="0" b="0"/>
<color r="1" g="0" b="0"/>
<color r="1" g="1" b="0"/>
<color r="0" g="1" b="0"/>
<color r="0" g="1" b="1"/>
<color r="0" g="0" b="1"/>
<color r="1" g="0" b="1"/>
</colortable><fonttable>
<font id="3" charset="iso-8859-1" name="Arial"/>
<font id="4" charset="iso-8859-1" name="Times New Roman"/>
</fonttable><page
id="14"
BoundingBox="197 187 258 257"
HeaderPosition="36"
FooterPosition="36"
PrintTrimMarks="yes"
HeightPages="1"
WidthPages="1"
><fragment
id="15"
BoundingBox="199 189 256 255"
><n
id="1"
p="201.02 207"
Z="1"
AS="N"
/><n
id="2"
p="201.02 237"
Z="2"
AS="N"
/><n
id="3"
p="227 252"
Z="3"
AS="N"
/><n
id="4"
p="252.98 237"
Z="4"
AS="N"
/><n
id="5"
p="252.98 207"
Z="5"
AS="N"
/><n
id="6"
p="227 192"
Z="6"
NodeType="ElementList"
AS="N"
ElementList="6 7"
><t
id="13"
p="226.06 195.9"
BoundingBox="227 189 248 198"
Z="13"
LabelAlignment="Above"
><s font="3" size="10" face="96">[N,C]</s></t></n><b
id="7"
Z="7"
B="1"
E="2"
Order="2"
BondCircularOrdering="12 0 0 8"
/><b
id="8"
Z="8"
B="2"
E="3"
BS="N"
/><b
id="9"
Z="9"
B="3"
E="4"
Order="2"
BondCircularOrdering="8 0 0 10"
/><b
id="10"
Z="10"
B="4"
E="5"
BS="N"
/><b
id="11"
Z="11"
B="5"
E="6"
Order="2"
BondCircularOrdering="10 0 0 12"
/><b
id="12"
Z="12"
B="6"
E="1"
BS="N"
/></fragment></page></CDXML>