From: Christoph S. <ste...@us...> - 2003-09-29 16:43:02
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Update of /cvsroot/cdk/cdk/data In directory sc8-pr-cvs1:/tmp/cvs-serv19354 Added Files: overlaptest2.cml overlaptest.cml Log Message: test files for test case for new OverlapResolver --- NEW FILE: overlaptest2.cml --- <?xml version="1.0"?> <molecule> <atomArray> <atom x2="11.2" elementType="C" y2="5.85" id="a27271771"/> <atom x2="9.900962" elementType="C" y2="6.6" id="a13594894"/> <atom x2="12.499038" elementType="C" y2="6.6" id="a26285376"/> <atom x2="9.900962" elementType="C" y2="8.1" id="a5253145"/> <atom x2="12.499038" elementType="C" y2="8.1" id="a2355643"/> <atom x2="11.2" elementType="C" y2="8.85" id="a6526955"/> </atomArray> <bondArray> <bond order="S" atomRefs2="a27271771 a13594894" id="b19141351"/> <bond order="S" atomRefs2="a26285376 a27271771" id="b14434757"/> <bond order="S" atomRefs2="a13594894 a5253145" id="b14779369"/> <bond order="S" atomRefs2="a2355643 a26285376" id="b9144903"/> <bond order="S" atomRefs2="a5253145 a6526955" id="b6146452"/> <bond order="S" atomRefs2="a6526955 a2355643" id="b29706134"/> </bondArray> </molecule> --- NEW FILE: overlaptest.cml --- <?xml version="1.0"?> <molecule> <atomArray> <atom x2="11.013641" elementType="C" y2="7.530257" id="a24518695"/> <atom x2="9.682745" elementType="C" y2="8.298651" id="a6196605"/> <atom x2="12.344538" elementType="C" y2="8.298651" id="a22896671"/> <atom x2="9.682745" elementType="C" y2="9.835438" id="a23603795"/> <atom x2="12.344538" elementType="C" y2="9.835438" id="a12129459"/> <atom x2="11.013641" elementType="C" y2="10.603831" id="a32319460"/> <atom x2="11.064867" elementType="C" y2="10.142796" id="a24137973"/> </atomArray> <bondArray> <bond order="S" atomRefs2="a24518695 a6196605" id="b29856972"/> <bond order="S" atomRefs2="a22896671 a24518695" id="b24678922"/> <bond order="S" atomRefs2="a6196605 a23603795" id="b15999328"/> <bond order="S" atomRefs2="a12129459 a22896671" id="b9170930"/> <bond order="S" atomRefs2="a23603795 a32319460" id="b23119024"/> <bond order="S" atomRefs2="a12129459 a24137973" id="b15947055"/> </bondArray> </molecule> |