PUBCHEM-ZINC06624920 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 0.7530 1.7940 -0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 0.5140 -0.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 0.0640 1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2650 0.7220 2.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 0.1400 3.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 -1.1040 3.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4100 -1.7840 2.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 -1.1800 1.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 -3.1340 3.1000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9770 -3.2910 4.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5610 -3.1130 2.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4410 -2.6840 3.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8020 -2.6560 3.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3420 -3.0150 2.3730 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4850 -3.4080 1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1080 -3.4720 1.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9530 -5.6450 3.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 -6.9220 2.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 -6.9070 3.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 -5.7320 2.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 -4.3700 2.7110 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4150 -4.0720 3.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8570 -3.4110 1.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 -3.2450 0.5690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 -1.7470 4.9470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 -1.1090 5.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 2.5770 0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 2.0080 -1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 1.8000 -0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 1.6890 1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 0.6930 4.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1470 -1.6730 0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0830 -2.3700 4.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5130 -2.3330 4.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9490 -3.6790 0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4970 -3.7900 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 -5.5330 4.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0110 -5.6710 2.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 -7.0400 1.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7710 -7.7820 3.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 -7.8430 2.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 -6.8390 4.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 -5.9060 1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9150 -5.7140 2.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3450 -0.9800 5.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 -1.7630 6.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -0.1560 6.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 -4.4130 2.5460 N 0 3 0 0 0 0 0 0 0 0 0 0 1.4890 -4.4350 1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 -2.7770 2.1950 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 -2.1830 1.4760 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 3 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 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 48 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 48 1 0 0 0 0 23 24 2 0 0 0 0 23 50 1 0 0 0 0 25 26 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 48 49 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 48 1 M END