* Input_File: "/opt/eprints3/archives/ecrystals/documents/disk0/00/00/06/64/01/2009src0268.mol"
Structure: 1
InChI=1/C18H15P.C9H6NS.C6H14.C2H4O2.Pd/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2-6-10-8(4-1)9-5-3-7-11-9;1-3-5-6-4-2;1-2(3)4;/h1-15H;1-4,6-7H;3-6H2,1-2H3;3H,1H3;/q;-1;;-1;+1/b;9-8+;;;
AuxInfo=1/1/N:26,37,48,24,28,35,39,46,50,22,30,33,41,44,52,21,32,43,57;5,3,13,7,15,1,11,9,10,54,58;60,70,64,74,67,77;17,16,55,56;59/E:(1,2,3)(4,5,6,7,8,9)(10,11,12,13,14,15)(16,17,18);;(1,2)(3,4)(5,6);;/CRV:;5.2,10-1;;4-1.2;/rA:79nCHCHCHCHCCCHCHCCCHHHCCHCHCHCHCHCCHCHCHCHCHCCHCHCHCHCHNOO2-PSPdCHHHCHHCHHCHHHCHHCHH/rB:s1;d1;s3;s3;s5;d5;s7;s7;d9;;s11;d11;s13;s10s13;;s16;s17;s17;s17;;d21;s22;s22;s24;d24;s26;s26;s28;s21d28;s30;;d32;s33;s33;s35;d35;s37;s37;s39;s32d39;s41;;d43;s44;s44;s46;d46;s48;s48;s50;s43d50;s52;s1s9;s16;d16;s21s32s43;s10s11;d15s54s55s57;;s60;s60;s60;s60;s64;s64;s64;s67;s67;;s70;s70;s70;s70;s74;s74;s67s74;s77;s77;/rC:-2.438,2.366,2.241;-2.715,2.45,3.145;-3.245,2.559,1.278;-4.154,2.797,1.418;-2.681,2.391,-.052;-3.279,2.522,-.779;-1.328,2.049,-.4;-1.031,1.955,-1.298;-.558,1.883,.61;.874,1.559,.448;3.293,1.068,-.249;4.158,.899,-.602;2.922,1.137,1.119;3.585,.998,1.786;1.516,1.422,1.539;-1.883,.66,5.256;-2.896,.641,6.545;-3.566,-.064,6.423;-3.345,1.509,6.621;-2.383,.466,7.361;2.897,2.671,4.544;3.833,2.723,5.571;3.817,2.072,6.262;4.794,3.728,5.585;5.433,3.764,6.286;4.818,4.68,4.573;5.474,5.367,4.582;3.882,4.628,3.546;3.899,5.279,2.855;2.922,3.623,3.532;2.282,3.587,2.831;2.77,-.245,4.159;2.111,-1.404,3.85;1.162,-1.415,3.816;2.839,-2.586,3.582;2.364,-3.384,3.383;4.224,-2.616,3.6;4.696,-3.421,3.418;4.891,-1.465,3.883;5.841,-1.456,3.894;4.17,-.282,4.162;4.65,.514,4.359;.935,1.008,6.418;.71,2.127,7.212;.956,2.989,6.898;.127,1.984,8.465;-.027,2.749,9.008;-.232,.722,8.925;-.631,.625,9.782;-.008,-.396,8.131;-.253,-1.259,8.445;.576,-.253,6.878;.729,-1.018,6.335;-1.13,2.027,1.912;-1.365,1.807,4.903;-1.577,-.392,4.632;1.733,1.251,4.58;1.951,1.336,-1.067;.2,1.607,3.254;2.995,4.872,-.117;2.851,5.005,-1.077;3.251,3.941,.049;3.709,5.467,.192;1.677,5.195,.656;1.453,4.458,1.278;1.779,6.03,1.178;.65,5.345,-.331;.548,4.499,-.836;.904,6.057,-.969;-2.995,6.171,.117;-2.851,6.038,1.077;-3.251,7.102,-.049;-3.709,5.575,-.192;-1.677,5.848,-.656;-1.453,6.585,-1.278;-1.779,5.013,-1.178;-.65,5.698,.331;-.548,6.543,.836;-.904,4.985,.969;