IBS-ZINC05235332 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 -0.6130 0.6310 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 0.2950 2.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 2.6210 1.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 3.2430 2.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 4.7600 2.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 5.4060 3.3800 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0410 5.9890 4.6780 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5180 5.2220 5.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3890 6.3260 5.3520 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3560 6.2060 4.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6830 5.5700 3.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2540 5.2350 2.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5500 6.4560 4.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4460 7.6500 6.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0410 8.6240 5.6310 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7420 7.8040 7.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5140 9.1010 7.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8580 9.2590 9.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4260 8.2300 9.8230 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6650 6.9890 9.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3090 6.7220 8.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 7.1580 4.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 7.5130 5.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 8.7410 4.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 9.0580 3.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5510 8.1030 3.5740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 -0.4190 -0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 0.7400 -0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 1.2130 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 0.4000 2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 -0.7420 2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 0.6260 3.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9460 3.0930 0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 2.7190 1.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6200 2.9900 2.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 2.8390 3.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 5.0280 2.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 5.1600 1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6820 5.5140 6.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8370 9.9730 7.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6580 10.2480 9.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3150 6.1810 9.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 5.6900 7.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 6.9590 5.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 9.3250 4.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 9.8830 2.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 1.1470 1.2490 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0540 1.0480 1.2880 H 0 0 0 0 0 0 0 0 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 1 47 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 47 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 47 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 12 2 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 47 1 M END