InChI=1S/C7H12O4/c8-6(9)4-2-1-3-5-7(10)11/h1-5H2,(H,8,9)(H,10,11)
AuxInfo=1/1/N:1,2,3,4,5,6,7,8,9,10,11/E:(2,3)(4,5)(6,7)(8,9,10,11)/gE:(1,2)/rA:23nCCCCCCCOOOOHHHHHHHHHHHH/rB:s1;s1;s2;s3;s4;s5;s6;d6;s7;d7;s1;s1;s2;s2;s3;s3;s4;s4;s5;s5;s8;s10;/rC:-.2398,-.3391,0;1.3067,-.3615,0;-.7764,1.1115,0;1.9125,-1.7849,0;-2.3203,1.2081,0;3.3604,-1.848,0;-2.8624,2.5522,0;3.9254,-2.9319,0;4.082,-.8602,0;-4.0727,2.7236,0;-2.1716,3.5619,0;-.612,-.8655,.8838;-.612,-.8655,-.8838;1.6654,.1742,-.8845;1.6654,.1742,.8845;-.3909,1.6283,.8845;-.3909,1.6283,-.8845;1.5466,-2.3169,-.8828;1.5466,-2.3169,.8828;-2.6999,.6858,-.8828;-2.6999,.6858,.8828;3.4555,-3.676,0;-4.6176,2.0326,0;