PUBCHEM-ZINC06523997 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 0 0 1 0 0 0 0 0999 V2000 -0.3560 1.3290 -0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 0.0440 -0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 -0.9580 -0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -2.1510 -0.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5860 -0.4610 0.2720 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 -1.1270 0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8900 0.8640 0.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0110 1.1360 0.9450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 1.7690 0.2190 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 3.2170 0.4110 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6320 3.7310 -0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 3.6940 1.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 4.3320 2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5760 4.2740 1.8230 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9700 5.2730 1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 3.6100 0.5470 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5510 3.4900 2.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6200 2.9470 1.9410 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1670 2.3000 1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9630 -0.4530 -0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8810 -0.7350 -2.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3330 0.0490 -3.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -1.9240 -2.7930 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 -2.4030 -4.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 -3.1550 -4.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 -3.6420 -6.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4860 -4.3940 -6.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 -4.8360 -7.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5990 -5.5860 -8.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1030 2.0960 -0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 3.5820 1.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 4.8010 3.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9690 4.1380 3.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0580 2.6510 3.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2770 -1.3570 -0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7530 0.2910 -0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8470 -2.4750 -2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 -1.5490 -4.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 -3.0610 -4.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5500 -4.0080 -3.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2520 -2.5030 -4.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 -2.7840 -6.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 -4.2990 -6.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6450 -5.2710 -5.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3660 -3.7480 -6.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1990 -3.9560 -8.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 -5.4760 -8.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7460 -6.5180 -7.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5010 -4.9700 -8.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4320 -5.9520 -9.8510 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.2490 -6.4670 -10.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6050 -6.5460 -9.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3160 -5.1140 -10.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 9 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 50 51 1 0 0 0 0 50 52 1 0 0 0 0 50 53 1 0 0 0 0 M CHG 1 50 1 M END