topical media & game development
springgraph-sample-MoleculeViewer-cmlfiles-baclofen.xml
<molecule convention="MDLMol" id="baclofen" title="BACLOFEN">
<date day="27" month="11" year="1995">
</date>
<atomArray>
<atom id="a1">
<string builtin="elementType">C</string>
<float builtin="x2">-0.6152</float>
<float builtin="y2">-0.3286</float>
</atom>
<atom id="a2">
<string builtin="elementType">C</string>
<float builtin="x2">0.7221</float>
<float builtin="y2">0.4623</float>
</atom>
<atom id="a3">
<string builtin="elementType">C</string>
<float builtin="x2">-0.596</float>
<float builtin="y2">-1.8531</float>
</atom>
<atom id="a4">
<string builtin="elementType">C</string>
<float builtin="x2">-1.9372</float>
<float builtin="y2">0.4318</float>
</atom>
<atom id="a5">
<string builtin="elementType">C</string>
<float builtin="x2">2.0441</float>
<float builtin="y2">-0.298</float>
</atom>
<atom id="a6">
<string builtin="elementType">C</string>
<float builtin="x2">0.7221</float>
<float builtin="y2">2.0136</float>
</atom>
<atom id="a7">
<string builtin="elementType">C</string>
<float builtin="x2">-1.9372</float>
<float builtin="y2">-2.6134</float>
</atom>
<atom id="a8">
<string builtin="elementType">C</string>
<float builtin="x2">-3.2783</float>
<float builtin="y2">-0.3286</float>
</atom>
<atom id="a9">
<string builtin="elementType">C</string>
<float builtin="x2">3.3852</float>
<float builtin="y2">0.4929</float>
</atom>
<atom id="a10">
<string builtin="elementType">N</string>
<float builtin="x2">-0.596</float>
<float builtin="y2">2.7777</float>
</atom>
<atom id="a11">
<string builtin="elementType">C</string>
<float builtin="x2">-3.2783</float>
<float builtin="y2">-1.8837</float>
</atom>
<atom id="a12">
<string builtin="elementType">O</string>
<float builtin="x2">4.7034</float>
<float builtin="y2">-0.2675</float>
</atom>
<atom id="a13">
<string builtin="elementType">O</string>
<float builtin="x2">3.3852</float>
<float builtin="y2">2.0136</float>
</atom>
<atom id="a14">
<string builtin="elementType">Cl</string>
<float builtin="x2">-4.6155</float>
<float builtin="y2">-2.6746</float>
</atom>
</atomArray>
<bondArray>
<bond id="b1">
<string builtin="atomRef">a1</string>
<string builtin="atomRef">a2</string>
<string builtin="order">1</string>
</bond>
<bond id="b2">
<string builtin="atomRef">a1</string>
<string builtin="atomRef">a3</string>
<string builtin="order">1</string>
</bond>
<bond id="b3">
<string builtin="atomRef">a1</string>
<string builtin="atomRef">a4</string>
<string builtin="order">2</string>
</bond>
<bond id="b4">
<string builtin="atomRef">a2</string>
<string builtin="atomRef">a5</string>
<string builtin="order">1</string>
</bond>
<bond id="b5">
<string builtin="atomRef">a2</string>
<string builtin="atomRef">a6</string>
<string builtin="order">1</string>
</bond>
<bond id="b6">
<string builtin="atomRef">a3</string>
<string builtin="atomRef">a7</string>
<string builtin="order">2</string>
</bond>
<bond id="b7">
<string builtin="atomRef">a4</string>
<string builtin="atomRef">a8</string>
<string builtin="order">1</string>
</bond>
<bond id="b8">
<string builtin="atomRef">a5</string>
<string builtin="atomRef">a9</string>
<string builtin="order">1</string>
</bond>
<bond id="b9">
<string builtin="atomRef">a6</string>
<string builtin="atomRef">a10</string>
<string builtin="order">1</string>
</bond>
<bond id="b10">
<string builtin="atomRef">a7</string>
<string builtin="atomRef">a11</string>
<string builtin="order">1</string>
</bond>
<bond id="b11">
<string builtin="atomRef">a9</string>
<string builtin="atomRef">a12</string>
<string builtin="order">1</string>
</bond>
<bond id="b12">
<string builtin="atomRef">a9</string>
<string builtin="atomRef">a13</string>
<string builtin="order">2</string>
</bond>
<bond id="b13">
<string builtin="atomRef">a11</string>
<string builtin="atomRef">a14</string>
<string builtin="order">1</string>
</bond>
<bond id="b14">
<string builtin="atomRef">a8</string>
<string builtin="atomRef">a11</string>
<string builtin="order">2</string>
</bond>
</bondArray>
</molecule>
(C) Æliens
20/2/2008
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