IBS-ZINC00174822 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 0.1630 0.3830 1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 -0.7830 0.4570 N 0 3 0 0 0 0 0 0 0 0 0 0 1.5460 -1.5360 0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9290 -2.6450 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 -2.9590 -1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -2.1430 -1.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 -1.0540 -0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 -2.4430 -2.6780 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2610 -1.6100 -2.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -2.6530 -3.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 -3.0930 -5.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 -4.4200 -4.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1040 -4.2300 -3.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 -3.6680 -2.4870 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 -4.2670 -1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -3.7340 -0.3130 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1190 -5.5720 -1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9130 -5.8270 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5450 -7.0460 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3920 -8.0160 -0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6060 -7.7690 -1.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9730 -6.5520 -2.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 1.2560 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 0.5680 1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 0.1940 2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0780 -1.2850 1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 -3.2580 0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5160 -3.8190 -1.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 -0.4160 -0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8940 -1.7200 -4.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 -3.4230 -3.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -2.3340 -5.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -3.2190 -5.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6610 -4.7450 -5.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 -5.1740 -4.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8960 -3.5450 -3.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5360 -5.1930 -3.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0330 -5.0710 0.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1600 -7.2450 0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8880 -8.9690 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4900 -8.5300 -2.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 -6.3590 -2.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 M CHG 1 2 1 M END