PUBCHEM-ZINC05408614 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -0.7660 1.8180 -3.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0210 0.3750 -3.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -0.3370 -3.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -1.6710 -3.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9160 -2.4030 -2.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 -3.7720 -2.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 -4.4230 -2.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 -3.6940 -2.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4160 -2.3200 -3.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8450 -4.3320 -3.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8710 -5.7030 -3.8250 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5110 -5.7230 -5.3340 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4920 -6.1210 -5.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -6.7150 -5.9360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4420 -7.0790 -5.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3800 -7.8170 -5.3600 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2090 -6.3920 -3.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9880 -6.4840 -2.8730 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2220 -7.2550 -7.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1460 -6.5870 -8.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5890 -6.3610 -10.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7870 -8.5960 -9.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6010 -4.4050 -6.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 -3.8850 -6.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 -2.6860 -7.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 -1.9830 -7.5120 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7990 -2.4890 -6.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7960 -3.6790 -6.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8670 -3.6920 -2.9690 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 2.2670 -2.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 1.8750 -4.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6830 2.4100 -3.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3780 0.3470 -2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7750 -0.0530 -3.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8850 -1.9370 -2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6600 -4.3320 -1.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 -5.4830 -2.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2770 -1.7450 -3.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4460 -8.3250 -7.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1710 -7.1530 -7.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8370 -5.5490 -8.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -6.5930 -7.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6390 -6.1340 -10.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9820 -5.4510 -10.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4750 -6.8780 -11.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3030 -9.2710 -8.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8370 -8.4360 -9.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6940 -9.0050 -10.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5040 -4.3900 -6.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 -2.2470 -7.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7030 -1.8920 -6.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7130 -4.0120 -5.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2120 -6.3870 -3.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0740 -7.2690 -9.6660 N 0 3 0 0 0 0 0 0 0 0 0 0 3.0840 -7.4440 -9.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 29 2 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 11 53 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 23 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 54 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 54 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 22 54 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END