IFLAB-ZINC04305073 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 1 0 0 0 0 0999 V2000 1.2250 1.5270 -0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1350 0.0250 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 -0.6110 1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 -1.9980 1.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 -2.7720 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 -2.1630 -1.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 -0.7540 -1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -0.0950 -2.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 -2.8500 -2.3350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -4.2720 -2.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 -4.7990 -3.6890 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3430 -4.1460 -4.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 -6.2600 -3.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 -6.2800 -5.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 -6.8800 -7.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 -8.9620 -6.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 -8.3050 -4.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5330 -9.0190 -8.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -4.7530 -4.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4820 -5.4060 -5.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9600 1.8430 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 1.9550 -0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 1.9450 0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 -0.0270 2.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -2.4800 2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 -3.8500 0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 0.0520 -3.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2610 -0.6930 -3.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 0.8730 -2.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5170 -4.7120 -1.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 -4.5210 -1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 -6.8380 -3.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 -6.3410 -3.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 -5.1970 -5.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 -6.4550 -5.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2250 -6.5210 -7.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 -6.6380 -7.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -8.7780 -6.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 -10.0400 -6.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -8.5930 -4.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -8.7110 -4.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 -8.7990 -9.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4060 -8.6010 -9.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6600 -10.0960 -8.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 -6.8330 -5.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 -8.3890 -7.1720 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.3140 -8.6130 -6.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 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 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 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 13 1 0 0 0 0 11 19 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 14 45 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 46 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 45 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END