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2.1023 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8330 -3.5921 1.1596 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0051 3.9480 2.2722 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6268 -1.9165 -3.4029 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7065 -3.1450 -2.7716 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0236 0.0405 -2.3598 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3471 -1.6570 -2.0215 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5932 4.7660 0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1708 5.0851 2.3179 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2339 5.1288 0.9165 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8781 -3.3221 -5.1226 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8933 -1.5793 -5.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3783 -1.2692 -4.1032 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0366 -0.3117 -4.7235 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9926 -3.1794 -4.0974 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1889 -0.3807 2.9604 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3791 4.0644 2.6693 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5669 5.2135 1.6017 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7217 4.5313 2.9916 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3032 0.3526 -2.3017 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0589 -1.8360 0.0453 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1292 0.9251 -0.3177 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 2 0 0 0 0 2 22 2 0 0 0 0 3 10 1 0 0 0 0 3 15 1 0 0 0 0 3 16 1 0 0 0 0 4 15 2 0 0 0 0 4 25 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 5 28 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 6 55 1 0 0 0 0 7 20 1 0 0 0 0 7 25 2 0 0 0 0 8 25 1 0 0 0 0 8 30 1 0 0 0 0 8 56 1 0 0 0 0 9 30 2 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 34 1 0 0 0 0 11 13 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 14 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 2 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 21 1 0 0 0 0 20 43 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 29 1 0 0 0 0 23 26 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 27 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 31 1 0 0 0 0 28 32 2 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 30 33 1 0 0 0 0 31 33 2 0 0 0 0 31 60 1 0 0 0 0 32 61 1 0 0 0 0 33 62 1 0 0 0 0 M END > 15 17 8 16 18 8 17 19 8 17 20 8 18 19 8 28 31 8 28 32 8 3 15 8 3 16 8 30 33 8 31 33 8 4 15 8 4 25 8 7 20 8 7 25 8 9 30 8 9 32 8 > InChI=1S/C24H29N7O2/c1-15-19-14-27-24(28-20-8-7-18(13-26-20)30-11-9-25-10-12-30)29-22(19)31(17-5-3-4-6-17)23(33)21(15)16(2)32/h7-8,13-14,17,25H,3-6,9-12H2,1-2H3,(H,26,27,28,29) > AHJRHEGDXFFMBM-UHFFFAOYSA-N > 1/1/N:21,29,13,14,11,12,31,33,26,27,23,24,32,20,19,22,10,28,17,30,18,15,16,25,6,9,7,8,4,5,3,2,1/E:(3,4)(5,6)(9,10)(11,12)/rA:62nOONNNNNNNCCCCCCCCCCCCCCCCCCCCCCCCHHHHHHHHHHHHHHHHHHHHHHHHHHHHH/rB:;;;;;;;;s3;s10;s10;s11;s12s13;s3d4;d1s3;s15;s16;s17d18;s7d17;s19;d2s18;s5;s5;s4d7s8;s6s23;s6s24;s5;s22;s8d9;s28;s9d28;s30d31;s10;s11;s11;s12;s12;s13;s13;s14;s14;s20;s23;s23;s24;s24;s21;s21;s21;s26;s26;s27;s27;s6;s8;s29;s29;s29;s31;s32;s33;/rC:4.8833,.5407,1.2136;5.7815,2.929,.4401;2.7338,.3234,1.6509;.4044,.2786,2.1145;-4.3963,-1.2599,-2.4661;-5.7175,-2.4015,-4.7025;-.9154,2.1691,2.3949;-1.8567,.0593,2.2043;-3.5443,-.9041,1.0414;2.7478,-1.125,1.531;2.7897,-1.6697,.0816;3.7693,-2.0328,2.2735;2.9004,-3.199,.2554;3.8135,-3.3706,1.4878;1.5561,.9727,1.9098;3.817,1.0985,1.4528;1.4502,2.3958,1.9063;3.8059,2.5048,1.4602;2.6055,3.1433,1.5888;.173,2.946,2.2098;2.4078,4.5896,1.3736;4.9894,3.2133,1.3298;-3.6844,-2.1771,-3.282;-5.7714,-.9822,-2.6616;-.8065,.8281,2.3196;-4.2422,-2.3782,-4.7115;-6.2901,-1.1782,-4.1066;-3.7896,-.8356,-1.3494;5.4283,4.3034,2.1915;-2.4246,-.1432,1.0204;-2.6521,-.0018,-1.4064;-4.2315,-1.251,-.0718;-1.9644,.3395,-.2336;1.8227,-1.56,1.9276;1.8916,-1.4024,-.4826;3.6595,-1.2926,-.4633;3.4743,-2.1959,3.3149;4.7746,-1.6149,2.3063;3.2907,-3.6959,-.6362;1.9102,-3.6196,.4633;3.4762,-4.2103,2.1023;4.833,-3.5921,1.1596;-.0051,3.948,2.2722;-2.6268,-1.9165,-3.4029;-3.7065,-3.145,-2.7716;-6.0236,.0405,-2.3598;-6.3471,-1.657,-2.0215;1.5932,4.766,.667;2.1708,5.0851,2.3179;3.2339,5.1288,.9165;-3.8781,-3.3221,-5.1226;-3.8933,-1.5793,-5.372;-7.3783,-1.2692,-4.1032;-6.0366,-.3117,-4.7235;-5.9926,-3.1794,-4.0974;-2.1889,-.3807,2.9604;6.3791,4.0644,2.6693;5.5669,5.2135,1.6017;4.7217,4.5313,2.9916;-2.3032,.3526,-2.3017;-5.0589,-1.836,.0453;-1.1292,.9251,-.3177; > C24 H29 N7 O2 > 447.5328 > O=C1C(C(C([H])([H])[H])=O)=C(C([H])([H])[H])C2=C([H])N=C(N([H])C3C([H])=C([H])C(=C([H])N=3)N3C([H])([H])C([H])([H])N([H])C([H])([H])C3([H])[H])N=C2N1C1([H])C([H])([H])C([H])([H])C([H])([H])C1([H])[H] > 4487437 $$$$