PUBCHEM-ZINC02939381 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 1.9420 -2.2670 -2.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 -2.0570 -1.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 -2.9470 -0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 -2.7570 0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 -1.6620 0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 -0.7580 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -0.9370 -1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 -0.0060 -2.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 0.9140 -2.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 1.6000 -3.9180 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 1.2250 -4.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 0.2400 -3.3250 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7280 -0.1980 -3.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 1.7610 -5.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5550 1.2930 -5.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3110 1.8120 -6.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7960 2.8120 -7.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 3.2870 -7.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7190 2.7770 -6.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 3.2400 -5.8850 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 4.2640 -6.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5620 3.3190 -8.2720 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8810 2.7870 -8.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 1.0330 -2.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7250 1.2260 -3.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9690 1.3370 -2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1060 1.2600 -1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9950 1.0690 -0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7420 0.9610 -0.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4670 -1.4740 1.9250 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4320 -2.3440 2.9130 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2750 -0.4360 1.9920 O 0 5 0 0 0 0 0 0 0 0 0 0 1.4510 -2.9370 -3.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 -1.3080 -3.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8850 -2.7060 -2.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 -3.8040 -0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 -3.4670 1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 0.0930 -0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9610 0.5220 -4.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3170 1.4500 -6.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 4.0580 -7.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 3.8940 -7.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3450 5.1350 -6.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0150 4.5430 -6.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8230 1.7160 -8.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4410 2.9620 -7.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3860 3.2780 -9.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 1.2870 -4.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8400 1.4850 -3.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0850 1.3470 -0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1120 1.0100 0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8770 0.8170 -0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 M CHG 1 30 1 M CHG 1 32 -1 M END