IBS-ZINC05342284 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 60 0 0 0 0 0 0 0 0999 V2000 -0.3980 1.7330 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 0.2310 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 -1.7430 1.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 -2.2170 2.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8320 -0.2900 2.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0690 0.1920 1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4160 -2.2930 3.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9110 -2.2830 3.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6810 -1.1890 4.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0870 -1.1770 4.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7700 -2.2750 3.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0120 -3.3480 3.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6170 -3.3600 3.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0740 -4.5460 2.8590 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1530 -5.3420 2.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1130 -6.5950 2.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9280 -7.4370 1.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8160 -7.4020 2.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7340 -8.2760 2.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7950 -9.1820 1.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8760 -9.2330 0.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9540 -8.3820 0.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7520 -10.2060 -0.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4850 -10.7880 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8550 -10.1180 1.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4260 -4.6180 2.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5610 -4.9910 2.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0250 -0.1040 4.7710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5380 2.2840 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 2.0310 -0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 2.0470 1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 -0.2770 0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 -0.0870 -0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 -2.2080 0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 -1.9750 1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 -1.7880 3.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -3.3100 2.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8960 -0.0720 2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 0.1950 3.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 1.2830 1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5030 -0.2310 0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0750 -3.3220 4.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0530 -1.7000 4.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6630 -0.3170 4.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8530 -2.2860 3.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0560 -7.0760 1.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7960 -6.7170 3.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8870 -8.2600 3.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7980 -8.4660 0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 -10.7410 -0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6450 -11.8390 0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6800 0.5070 5.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -0.2320 1.2740 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1540 0.2180 2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6880 -1.7940 2.6760 N 0 3 0 0 0 0 0 0 0 0 0 0 3.1490 -2.2700 1.8870 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 32 1 0 0 0 0 2 33 1 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 53 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 4 55 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 5 55 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 6 53 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 7 55 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 11 12 2 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 16 46 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 47 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 26 27 2 0 0 0 0 28 52 1 0 0 0 0 53 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 53 1 M CHG 1 55 1 M END