InChI=1S/C9H9NO3/c11-8(12)6-10-9(13)7-4-2-1-3-5-7/h1-5H,6H2,(H,10,13)(H,11,12)
AuxInfo=1/1/N:1,2,3,4,5,6,7,8,9,10,11,12,13/E:(2,3)(4,5)(11,12)/rA:22nCCCCCCCCCNOOOHHHHHHHHH/rB:d1;s1;s2;d3;;d4s5;s6;s7;s6s9;s8;d8;d9;s1;s2;s3;s4;s5;s6;s6;s10;s11;/rC:1.2114,3.3825,-.4105;1.8966,2.1569,-.4173;-.1928,3.3963,-.4218;1.1731,.9498,-.4399;-.9047,2.1829,-.4471;-.8302,-2.6134,.2069;-.2482,.923,-.4598;.0576,-3.0505,1.2662;-.9764,-.2746,-.4593;-.394,-1.4375,-.4111;-.2223,-4.034,1.9393;1.1023,-2.4836,1.5548;-2.2021,-.2603,-.4908;1.7326,4.2619,-.3953;2.9193,2.1453,-.4033;-.6946,4.2872,-.4091;1.7237,.0879,-.436;-1.9261,2.2478,-.4487;-.8796,-3.3935,-.5556;-1.8319,-2.5111,.6362;.4572,-1.4883,-.7945;-.9709,-4.4746,1.7967;