InChI=1S/C7H7NO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,8H2,(H,9,10)
AuxInfo=1/1/N:1,2,3,4,5,6,7,8,9,10/E:(1,2)(3,4)(9,10)/rA:17nCCCCCCCNOOHHHHHHH/rB:;d1;s2;s1d2;s3d4;s5;s6;d7;s7;s1;s2;s3;s4;s8;s8;s10;/rC:-.4151,-1.1397,-.0738;-.3904,1.2789,-.0265;.9912,-1.1611,-.0268;1.0165,1.2683,.0326;-1.1436,.0771,-.0601;1.7131,.0447,.0465;-2.5389,.0869,-.0683;3.0234,.0207,.1357;-3.196,1.1185,-.0656;-3.21,-.9422,-.0637;-.8949,-2.0429,-.1121;-.8528,2.1921,-.0381;1.4785,-2.0613,-.0352;1.524,2.1568,.0653;3.4855,-.7869,.0335;3.4998,.8072,.3106;-4.0904,-.9171,-.054;