PUBCHEM-ZINC05139362 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 -0.4200 0.9850 3.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 0.5250 2.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 -0.4810 0.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3030 -1.6820 0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 -1.5760 1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8070 -2.3110 1.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -3.3600 2.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1630 -4.0380 3.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5150 -3.6950 3.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -2.6490 2.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 -1.9630 2.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4050 -4.3950 4.5980 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 -5.7070 5.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7660 -6.7310 4.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6850 -7.9940 4.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1230 -8.3060 6.1300 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6690 -7.3360 6.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7960 -6.0030 6.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3540 -5.0450 7.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8030 -5.3910 8.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3640 -4.4410 9.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8050 -4.8110 10.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6900 -6.1340 11.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1340 -7.0870 10.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6860 -6.7280 9.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 -7.6700 8.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 0.2100 4.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 1.8760 3.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4440 1.2410 3.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 1.2750 1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 0.3130 2.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 -0.2400 -0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9050 0.3880 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6440 -1.9170 1.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1870 -1.4660 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8250 -2.5730 0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 -0.8940 0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3830 -2.3100 0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -3.6720 2.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7430 -4.8330 4.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0500 -2.3660 3.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5800 -1.1600 1.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2390 -3.8820 4.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4190 -6.5580 3.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2590 -8.8190 4.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4320 -4.0050 7.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4630 -3.4020 9.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2370 -4.0670 11.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0330 -6.4240 12.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0510 -8.1160 10.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0120 -8.7060 8.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 -0.7500 1.7500 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4920 -1.3180 2.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 52 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 52 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 52 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 26 2 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 26 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END