IFLAB-ZINC02451826 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 1.0000 1.5670 -0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 0.1090 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 -0.4770 1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 -1.8430 1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 -2.6460 0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 -2.0720 -1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -0.6990 -1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 -2.9090 -2.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -3.9920 0.1980 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 -4.6080 1.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4930 -6.0770 1.2430 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3950 -6.1580 0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6520 -6.8600 2.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -9.1320 3.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 -10.5440 2.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 -11.2390 2.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 -10.3650 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 -8.9570 1.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 -12.6440 1.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6750 -13.4740 1.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9990 -13.6840 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1200 -14.4400 -0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9250 -14.9950 0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6090 -14.7980 2.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4900 -14.0400 2.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 -6.7170 0.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 -6.1120 -0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0770 1.7100 -0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 1.9800 -1.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 2.1390 0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 0.1280 1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4510 -2.2430 2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4690 -0.2530 -2.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0610 -3.3570 -2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -2.3100 -3.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -3.7010 -2.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 -4.5290 1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 -4.1390 2.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 -6.6100 3.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6150 -6.7010 3.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 -9.1250 4.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 -8.6320 3.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 -10.5060 2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -11.1290 3.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5560 -11.3400 3.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8170 -10.3150 0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4210 -10.8090 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1410 -8.3340 0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4940 -8.9560 2.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -12.5610 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -13.1930 2.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 -13.2600 -0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3640 -14.5990 -1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7960 -15.5860 0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2340 -15.2370 2.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 -13.8980 3.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 -8.3360 2.2090 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1840 -8.2910 1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 26 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 57 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 14 57 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 18 57 1 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 53 1 0 0 0 0 23 24 2 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 55 1 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END