InChI=1S/C7H7NO2/c1-8-4-2-3-6(5-8)7(9)10/h2-5H,1H3/p+1 AuxInfo=1/1/N:1,2,3,4,5,6,7,8,9,10/E:(9,10)/CRV:8+1,9-1/rA:18nCCCCCCCN+OOHHHHHHHH/rB:;d2;s2;;s3d5;s6;s1d4s5;s7;d7;s1;s1;s1;s2;s3;s4;s5;s9;/rC:-1.7969,1.8908,-.0271;-1.0503,-1.7702,-.0363;.3529,-1.7457,-.0422;-1.7451,-.55,-.0296;.2926,.6623,-.022;1.0667,-.5246,-.0319;2.4554,-.4956,-.0258;-1.0773,.6439,-.0254;3.0786,.4418,.4633;3.1285,-1.401,-.4976;-2.8843,1.782,-.0286;-1.5397,2.4753,.8591;-1.538,2.4729,-.9147;-1.5572,-2.6584,-.0351;.8444,-2.6438,-.0419;-2.768,-.5898,-.0284;.7791,1.566,-.022;3.9586,.4441,.4861;