* Input_File: "/opt/eprints3/archives/ecrystals/documents/disk0/00/00/10/87/01/02src425.mol"
Structure: 1
InChI=1/C12H15N.C4H6S.C2H6N2.C2H6.C2H4.C2H2.3CH4.ClH.Pd.3H2S.2H2/c1-3-5-8-12-10-6-9-11(13-12)7-4-2;1-2-3-4-5;1-2-4-3-1;3*1-2;;;;;;;;;;/h3-4,6,9-10H,1-2,5,7-8H2;2-4H,1H3;3-4H,1-2H2;1-2H3;1-2H2;1-2H;3*1H4;1H;;3*1H2;2*1H/q;;;;;;;;;;+1;;;;;/p-1/b;3-2-;;;;;;;;;;;;;;
AuxInfo=1/1/N:31,35,19,34,18,12,15,9,7,5,14,4,3;42,43,45,47,49;54,60,55,61;50,56;21,29;26,27;23;37;39;2;1;33;25;41;52;53/E:;;(1,2)(3,4);3*(1,2);;;;;;;;;;/rA:61nPdClN4CCHCHCHHCHCCHHCCHCHCHSCCHCHCHSCCHCHCHSCCHCHCHSCHHHCNCHHHCN/rB:s1;s1;d3;s4;s5;;s7;s4;s9;s9;d5s7;s12;s3d7;s14;s15;s15;s9;s18;;;s21;;s23;;;t26;s25;d21;s29;d19;s31;s20;s15;d34;s35;;s37;;s39;;;s42;s41;d43;s45;s45;s47;d47;;;;;;s54;s50;s56;s50;s56;s51s54;s55s60;/rC:-3.6023,-1.3878,6.3001;-1.8163,-1.3781,4.874;-3.5767,.6568,6.3562;-4.2314,1.3475,5.393;-4.196,2.74,5.3739;-4.6305,3.2166,4.6764;-2.8887,2.708,7.36;-2.4364,3.1659,8.0588;-4.994,.5561,4.3605;-4.3577,-.0024,3.8474;-5.6259,-.0509,4.8213;-3.5302,3.4267,6.3677;-3.5126,4.3765,6.3704;-2.9032,1.3203,7.3389;-2.1841,.485,8.3704;-2.8476,-.0501,8.8739;-1.5738,-.1439,7.9098;-5.7544,1.4211,3.4133;-5.5792,1.9306,2.0652;-4.8207,1.7618,1.5186;-6.722,2.7337,1.6661;-6.7996,3.1984,.8412;-7.6582,2.7231,2.6397;-8.4781,3.1921,2.5386;-7.3526,1.9319,3.9063;-6.0237,1.3361,3.5232;-7.3131,1.9908,3.5413;-7.9418,1.9172,4.2497;-7.531,2.8049,2.292;-8.2975,3.3216,2.073;-6.4122,2.6502,1.5447;-6.3602,3.0537,.6862;-5.2996,1.879,2.0397;-1.3953,1.3174,9.3317;-1.6351,1.7735,10.6234;-2.433,1.5382,11.0821;-.7279,2.5407,11.1963;-.8254,2.9299,12.0574;.3607,2.7057,10.4055;1.1269,3.2094,10.6538;.1869,1.8852,8.8822;-1.2778,1.2409,9.3227;-.0015,1.787,9.1831;.5481,1.555,8.4437;.4185,2.6208,10.0884;1.2307,3.1096,10.0258;-.4439,2.7088,11.1341;-.2573,3.1706,11.9431;-1.9831,1.842,10.7965;-1.308,-.984,1.4207;-.7974,-1.8168,1.3417;-1.1345,-.5762,2.2948;-1.0352,-.3651,.7115;-2.7643,-1.2793,1.29;-3.7139,-1.4354,1.1131;-.7226,-1.5106,1.4695;-.536,-1.8484,2.3703;-.6749,-.5318,1.4713;-.0601,-1.8688,.8425;-2.2158,-1.9814,1.0106;-3.0591,-2.5716,.7468;