IBS-ZINC04981533 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 63 0 0 1 0 0 0 0 0999 V2000 1.5520 -2.5710 -0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 -2.7540 0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -1.4370 2.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 -1.3150 2.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8270 -0.8500 1.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7830 0.6730 1.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1880 1.2700 1.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1870 2.6960 1.5080 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3170 3.7280 2.5340 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2770 3.5380 3.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4090 5.0190 1.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1550 4.6810 0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0800 3.1900 0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9450 2.5780 -0.8210 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9910 5.4190 -0.6290 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6930 6.2530 2.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7440 7.3380 1.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 6.5510 3.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2060 6.2070 4.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4610 6.4910 5.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4930 7.1270 6.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2640 7.4850 5.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0120 7.1950 4.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2390 8.1140 6.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4470 8.4410 7.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1830 3.6990 3.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4340 3.5090 4.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 3.5030 5.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 3.6750 5.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 3.8480 4.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8510 3.8700 3.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4950 -2.0910 -0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5170 -3.5440 -1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -1.9620 -1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -3.2520 1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2350 -3.3500 1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 -0.5920 3.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 -2.3670 3.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 -2.1490 2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -1.3040 3.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0700 -0.3840 2.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4370 -1.2140 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2330 -1.2530 2.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 1.0100 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 1.0490 2.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6360 1.1000 2.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8310 0.7900 1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9890 8.1300 1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9760 5.7220 3.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4200 6.2230 5.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7330 7.3340 7.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0490 7.4720 3.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5430 8.9370 8.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 7.5390 8.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2810 9.1410 7.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4500 3.3830 5.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 3.3760 6.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2410 3.6830 5.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 4.0290 2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 -1.4030 1.5570 N 0 3 0 0 0 0 0 0 0 0 0 0 0.9150 -0.7500 0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 60 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 60 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 5 60 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 26 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 1 0 0 0 0 12 15 2 0 0 0 0 13 14 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 21 22 2 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 29 30 2 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 31 59 1 0 0 0 0 60 61 1 0 0 0 0 M CHG 1 60 1 M END