InChI=1S/C6H13NO2/c1-2-9-6(8)4-3-5-7/h2-5,7H2,1H3 AuxInfo=1/0/N:1,2,3,4,5,6,7,8,9/rA:22nCCCCCCNOOHHHHHHHHHHHHH/rB:s1;;s3;s3;s4;s5;d6;s2s6;s1;s1;s1;s2;s2;s3;s3;s4;s4;s5;s5;s7;s7;/rC:3.2464,1.7313,-.5016;1.7545,2.0747,-.3385;-1.1853,-.7243,.4771;-.9227,-.2348,-.9713;-1.9531,-2.0616,.546;-.266,1.0556,-.9573;-2.2017,-2.4583,1.9351;-.9535,2.0664,-1.027;.9675,1.0941,-.7981;3.8541,2.518,-.0501;3.4874,.7856,-.0126;3.5079,1.659,-1.559;1.5422,2.2097,.7261;1.5613,3.0204,-.853;-.2317,-.8423,1.0019;-1.7662,.0303,1.0179;-.3103,-.9643,-1.5095;-1.8728,-.1698,-1.5107;-1.3804,-2.852,.0568;-2.9187,-1.9679,.0452;-2.6683,-3.367,1.9068;-1.2906,-2.6029,2.3758;