* Input_File: "/opt/eprints3/archives/ecrystals/documents/disk0/00/00/06/00/01/2008src0988.mol" Structure: 1 InChI=1/C23H26N2O2/c26-22-17-24(15-18-9-3-1-4-10-18)23(27)20-13-7-8-14-21(20)25(22)16-19-11-5-2-6-12-19/h2,5-8,11-14,18H,1,3-4,9-10,15-17H2 AuxInfo=1/0/N:41,24,38,44,22,26,4,6,35,47,20,28,2,8,30,16,12,33,19,1,10,11,15,51,50,53,52/E:(3,4)(5,6)(9,10)(11,12)/rA:53nCCHCHCHCHCCCHHCCHHCCHCHCHCHCHCHHCHCHHCHHCHHCHHCHHNNOO/rB:d1;s2;s2;s4;d4;s6;s6;s8;s1d8;;s11;s12;s12;s1;;s16;s16;s16;d19;s20;s20;s22;d22;s24;s24;s26;s19d26;s28;;s30;s30;s30;s33;s33;s35;s35;s35;s38;s38;s38;s41;s41;s41;s44;s44;s33s44;s47;s47;s10s11s16;s12s15s30;d15;d11;/rC:.7539,-1.4339,1.565;1.3888,-1.0956,.3612;1.4571,-.1797,.1171;1.9168,-2.0541,-.4789;2.3303,-1.8041,-1.2965;1.8331,-3.3883,-.1089;2.2181,-4.0569,-.6623;1.1916,-3.7498,1.0627;1.1289,-4.669,1.2935;.6341,-2.7889,1.9136;-1.1324,-2.6918,3.6518;-1.6524,-1.4402,2.9825;-1.7882,-1.6181,2.0181;-2.5298,-1.2019,3.3738;.4294,-.2784,2.466;.4445,-4.513,3.7097;.3643,-4.4574,4.6955;1.399,-4.6618,3.4939;-.3601,-5.7026,3.22;-1.356,-5.5884,2.2559;-1.5378,-4.7397,1.8684;-2.0872,-6.6943,1.8518;-2.7553,-6.5976,1.1839;-1.8544,-7.9356,2.4115;-2.3673,-8.6882,2.1425;-.8637,-8.068,3.3688;-.6957,-8.9181,3.7606;-.1136,-6.9691,3.7607;.5762,-7.0784,4.4051;-1.1036,.7619,4.0565;-2.0482,1.0089,3.8909;-.5472,1.5547,3.8495;-.9404,.4237,5.5373;-1.6021,-.2885,5.7727;.4579,-.0865,5.8852;1.1315,.5827,5.6053;.6344,-.9254,5.3904;.5913,-.3447,7.3904;-.0228,-1.0753,7.653;1.5159,-.6358,7.5922;.2675,.9028,8.1997;.9454,1.5995,8.0145;.3065,.6871,9.1658;-1.1183,1.4402,7.8566;-1.2687,2.2926,8.3375;-1.8053,.7941,8.1568;-1.2664,1.6742,6.3552;-.6626,2.4089,6.0794;-2.1958,1.9562,6.1609;.0203,-3.2325,3.1261;-.7364,-.319,3.1393;1.2257,.6645,2.5546;-1.704,-3.1941,4.6057;