* Input_File: "/opt/eprints3/archives/ecrystals/documents/disk0/00/00/09/43/01/02src725.mol"
Structure: 1
InChI=1/C11H11N2O5/c14-10-5-6-12(10)7-18-11(15)8-1-3-9(4-2-8)13(16)17/h1-4H,5-7H2,(H,16,17)
AuxInfo=1/1/N:14,18,15,17,9,10,11,13,16,8,12,6,7,1,3,4,5,2/E:(1,2)(3,4)(16,17)/CRV:13.4/rA:28nOOOOONN4CCCCCCCCCCCHHHHHHHHHH/rB:;;;;;d4s5;d1s6;s8;s6s9;s2s6;s2d3;s12;d13;s14;s7d15;s16;s13d17;s9;s9;s10;s10;s11;s11;s14;s15;s17;s18;/rC:3.9672,.2565,3.7737;3.5877,-.2005,7.6034;1.8711,.5358,8.8595;6.4807,2.3867,13.6662;8.0951,1.818,12.3398;3.3036,-1.1824,5.5198;6.9044,1.9016,12.6213;3.9126,-.8059,4.3553;4.4,-2.2311,4.096;3.7207,-2.5919,5.4478;2.6335,-.4369,6.5265;3.0564,.3107,8.7242;4.0822,.6087,9.7655;5.4502,.3874,9.5421;6.3828,.7981,10.4846;5.9195,1.3982,11.6408;4.5659,1.5845,11.9096;3.6481,1.1989,10.951;5.4093,-2.2663,4.0594;4.0041,-2.8067,3.2932;4.2893,-2.8223,6.311;2.9434,-3.242,5.3696;2.2994,.4391,6.1599;1.887,-.9927,6.8963;5.7616,.0638,8.743;7.2786,.653,10.3369;4.3374,2.0339,12.7116;2.6897,1.3472,11.0926;