CHEMDIV-ZINC01458584 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 0.3730 1.4600 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -0.0220 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -0.8020 1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3810 -2.1850 0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 -2.8040 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6490 -2.0340 -1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4620 -0.6490 -1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 -4.2740 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 -4.8380 1.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 -5.0460 -1.3740 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6580 -5.5630 -1.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 -7.0510 -1.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5940 -7.7220 -2.2450 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 -7.4510 -1.5620 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -6.3430 -1.1970 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7790 -6.5170 -0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 -6.2960 -2.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0110 -6.0420 -1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2010 -5.9880 -2.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1850 -6.1810 -3.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9800 -6.4210 -4.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -6.4750 -3.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -8.8460 -1.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 -9.4030 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2710 -10.8670 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -12.9790 1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -10.9300 2.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6580 -4.8940 -1.9890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 1.6850 -0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4090 1.9770 -0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3550 1.8630 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 -0.3360 1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -2.7740 1.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1500 -2.4770 -2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 -0.0570 -2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0480 -5.8850 -0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1420 -5.7920 -1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1120 -6.1390 -4.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9690 -6.5650 -5.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 -6.6650 -3.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 -9.4170 -2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0790 -8.9410 -1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 -8.8100 0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 -9.2930 0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 -11.4410 -0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 -10.9990 -0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 -13.2640 1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6690 -13.3310 0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3090 -13.3700 2.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 -9.8670 2.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8040 -11.0940 2.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -11.4570 3.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -4.4340 -2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 -11.4740 1.3130 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.0560 -11.2490 1.5130 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 53 1 0 0 0 0 11 12 1 0 0 0 0 11 28 2 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 16 1 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 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 54 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 54 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 54 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END