CHEMDIV-ZINC04686053 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -2.5700 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1190 -0.0610 1.2180 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4620 0.0490 1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1030 -0.2420 0.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1680 0.5350 2.4700 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9520 -0.1390 3.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6780 0.5700 2.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3810 1.1210 3.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8300 2.5130 3.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3830 2.4260 4.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6800 1.9440 2.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8770 3.6380 4.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2990 4.3100 5.4660 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5690 5.4550 5.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5800 6.5260 6.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6900 7.5640 6.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7870 7.5520 5.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 6.4990 4.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6530 5.4460 4.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8720 4.2990 3.8250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 -2.4020 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -3.6600 1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 -2.2190 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 -2.4410 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 0.1720 2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8900 1.2130 1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0360 -0.4390 2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4530 1.1880 3.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2010 0.4570 4.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0240 3.1800 2.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3190 2.9030 4.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6070 1.9190 3.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8830 2.6140 1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2820 6.5400 7.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6970 8.3940 6.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 8.3720 5.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0600 6.4960 3.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 28 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 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 2 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 M END