13 12 0 0001 0 0 0 0 0999 V2000 6.8671 -0.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.0950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 2.5369 0.4050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 5.6719 -1.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 2.5369 1.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 2 8 2 0 3 9 2 0 6 4 1 1 4 10 1 0 4 11 1 0 5 9 1 0 5 12 1 0 5 13 1 0 6 7 1 0 6 8 1 0 7 9 1 0 M END > InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1/i5+1 > DCXYFEDJOCDNAF-KPHKZEKTSA-N > 1/1/N:7,6,9,8,4,5,3,1,2/E:(8,9)/it:im/I:/E:m/rA:17cOOON.i15NCCCCHHHHHHHH/rB:;;;;p4;s6;s1d2s6;d3s5s7;s6;s7;s7;s4;s4;s5;s5;s1;/rC:6.8671,-.095,0;6.001,1.405,0;3.403,-1.095,0;5.135,-1.095,0;2.5369,.405,0;5.135,-.095,0;4.269,.405,0;6.001,.405,0;3.403,-.095,0;5.6719,-.405,0;4.6675,.8799,0;3.8705,.8799,0;4.5981,-1.405,0;5.6719,-1.405,0;2,.095,0;2.5369,1.025,0;7.404,.215,0; > C4 H8 N2 O3 > 133.1113 > O([H])C([C@]([H])(C([H])([H])C(N([H])[H])=O)[15N]([H])[H])=O > 17341161 $$$$