* Input_File: "/opt/eprints3/archives/ecrystals/documents/disk0/00/00/06/95/01/2008lsh024.mol"
Structure: 1
InChI=1/C6H6ClN/c7-5-1-3-6(8)4-2-5/h1-4H,8H2
AuxInfo=1/0/N:4,12,2,10,6,1,8,7/E:(1,2)(3,4)/rA:14nCCHCHCNClHCHCHH/rB:d1;s2;s2;s4;d4;s1;s6;s7;s1;s10;s6d10;s12;s7;/rC:1.04,1.81,3.633;1.589,.603,4.089;1.225,-.221,3.789;2.661,.599,4.977;3.029,-.221,5.284;3.187,1.81,5.409;.009,1.81,2.699;4.563,1.81,6.492;-.454,1.07,2.63;1.589,3.016,4.089;1.225,3.841,3.789;2.661,3.02,4.977;3.029,3.841,5.284;-.454,2.55,2.63;