PUBCHEM-ZINC05795573 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 54 0 0 1 0 0 0 0 0999 V2000 0.8120 1.6670 -0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 0.2670 -0.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -0.2640 0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -0.1550 2.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 -0.6650 3.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7850 -1.2880 3.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2120 -1.4160 1.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 -0.9190 0.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7780 -1.0770 -0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9470 -1.4510 -1.3030 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7680 -1.6920 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7460 -1.4230 -2.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5860 -1.6850 -3.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0400 -1.5570 -5.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7210 -1.1860 -5.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 -0.9210 -4.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 -1.0430 -2.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8490 -0.8640 -1.6520 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4710 -0.5160 -1.2880 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1060 -1.4300 -1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 0.2940 -2.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 1.3620 -2.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 2.1070 -3.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 1.7860 -4.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9740 0.7110 -3.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 -0.0360 -2.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2110 0.3910 -4.3600 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8660 -0.7240 -3.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8340 2.5180 -5.4410 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 3.6070 -5.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8100 1.7090 -0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 2.1090 -0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 2.2220 0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 0.3300 2.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 -0.5770 4.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3920 -1.6730 3.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1520 -1.9010 1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6160 -1.9760 -3.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6630 -1.7530 -5.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3480 -1.1010 -6.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -0.6310 -4.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 1.6140 -2.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 2.9410 -4.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9380 -0.8730 -2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2600 -1.6200 -3.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9950 -0.5330 -2.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8410 -0.8700 -4.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 4.3160 -5.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 3.2290 -6.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6210 4.1060 -6.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 29 30 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 M CHG 1 18 1 M END