* Input_File: "/opt/eprints3/archives/ecrystals/documents/disk0/00/00/09/88/01/04src0091.mol" Structure: 1 InChI=1/C11H8N2O2.Fe.H2NO3.HNO3.2H2O/c14-11(15)10-6-3-5-9(13-10)8-4-1-2-7-12-8;;2*2-1(3)4;;/h1-7H,(H,14,15);;(H2,2,3,4);2H;2*1H2/q;+3;;-2;;/p-1 AuxInfo=1/1/N:5,3,13,7,11,15,1,9,10,17,18,19,20,21,22;25;34,35,36,37;30,33,31,32;23;24/E:(14,15);;(2,3,4);(3,4);;/CRV:;;1.4;3-1,4-1;;/rA:37nCHCHCHCHCCCHCHCHCCN4N4OOOOFeHHHHNOOON4OOO/rB:s1;d1;s3;s3;s5;d5;s7;s7;s9;d10;s11;s11;s13;d13;s15;s15;s17;s1d9;s10d17;s18;d18;;;s19s20s21;s23;s23;s24;s24;;s25s30;s25s30;s30;;d34;s34;s34;/rC:1.5088,2.3163,.574;1.4143,3.1857,.9452;1.5765,2.1941,-.7949;1.5245,2.9622,-1.3515;1.7211,.938,-1.3452;1.7848,.8285,-2.2867;1.7716,-.1535,-.5107;1.8578,-1.0282,-.8712;1.696,.0321,.8578;1.7091,-1.0713,1.8295;1.7299,-2.4305,1.515;1.7713,-2.7175,.6103;1.6894,-3.3472,2.5403;1.7069,-4.2765,2.3435;1.6234,-2.9245,3.8553;1.6011,-3.55,4.57;1.5908,-1.5617,4.0989;1.4301,-.9348,5.4506;1.5697,1.2672,1.4128;1.643,-.6705,3.1036;1.3604,.3521,5.4136;1.3455,-1.6116,6.4716;-.4563,1.4316,3.515;3.5399,1.4806,3.7016;1.5428,1.3815,3.6304;-.9609,1.2672,4.159;-.7994,2.0478,3.0662;4.1375,.8985,3.6707;3.8299,2.1272,4.1422;1.5246,3.835,4.379;1.5117,2.8506,5.1892;1.5693,3.4879,3.1509;1.4929,4.9819,4.7427;4.8909,-1.0004,2.0199;4.7547,-.1645,1.1217;4.9312,-.6756,3.2328;4.976,-2.2301,1.7225;