* Input_File: "/opt/eprints3/archives/ecrystals/documents/disk0/00/00/13/79/01/2008lsh060.mol" Structure: 1 InChI=1/C8H8ClNO/c1-6(11)10-8-4-2-3-7(9)5-8/h2-5,10H,1H3/q-1 AuxInfo=1/0/N:12,7,5,9,2,11,4,1,19,16,17/CRV:11-1.2/rA:19nCCHCCHCHCHCCHHHNO2-HCl/rB:d1;s2;s2;d4;s5;s5;s7;s1d7;s9;;s11;s12;s12;s12;s1s11;d11;s16;s4;/rC:-1.29,-5.996,24.608;-1.409,-4.615,24.824;-2.028,-4.096,24.324;-.602,-4.03,25.781;.318,-4.739,26.525;.865,-4.305,27.171;.422,-6.106,26.3;1.047,-6.619,26.8;-.376,-6.731,25.356;-.298,-7.668,25.22;-2.811,-6.194,22.66;-3.629,-7.198,21.891;-4.575,-6.942,21.924;-3.516,-8.086,22.291;-3.329,-7.22,20.959;-2.097,-6.695,23.688;-2.799,-5.007,22.332;-2.174,-7.545,23.856;-.811,-2.314,26.077;