PUBCHEM-ZINC03636138 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 47 0 0 1 0 0 0 0 0999 V2000 0.4570 1.2160 0.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3400 -0.3060 0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1290 -0.6940 0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 -2.2160 0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7140 -2.6040 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8210 -4.1170 -0.1140 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3230 -4.6290 0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1530 -4.5060 -1.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1360 -6.0300 -1.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2740 -4.5180 -0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1120 -3.9940 -1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4450 -4.3610 -1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9420 -5.2530 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1070 -5.7800 0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7680 -5.4180 0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9440 -5.9390 1.7300 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8420 -5.2640 2.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4720 -4.2380 3.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0430 -5.7260 3.8690 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9820 -4.9470 5.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6400 -6.7350 1.7500 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.8140 -7.0560 1.7200 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9030 -7.1990 2.6020 O 0 5 0 0 0 0 0 0 0 0 0 0 -7.3420 -3.7970 -2.1810 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.9050 -3.0110 -3.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5160 -4.1200 -2.2100 O 0 5 0 0 0 0 0 0 0 0 0 0 1.5030 1.4930 0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 1.6730 -0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 1.5670 1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -0.6560 -0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7290 -0.7630 1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7040 -0.3440 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -0.2370 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 -2.5670 -0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -2.6730 1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2770 -2.3150 0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1220 -2.0930 -0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7120 -4.0740 -2.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1310 -4.1280 -1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7340 -6.3040 -2.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 -6.4560 -0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1510 -6.4140 -1.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7270 -3.2960 -1.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9830 -5.5380 -0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9780 -4.8830 5.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 -5.4280 5.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6200 -3.9440 4.8680 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 2 30 1 0 0 0 0 2 31 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 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 13 14 2 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M CHG 1 24 1 M CHG 1 26 -1 M END