IBS-ZINC01451552 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.5390 0.7190 0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 0.5640 2.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7670 2.8130 1.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6390 3.5040 2.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 5.0180 2.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3610 5.6750 3.4810 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0030 5.9960 4.8620 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5100 5.1180 5.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3320 6.3300 5.5760 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2600 6.5590 4.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6380 6.0610 3.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2240 5.9770 2.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4010 6.9870 4.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8070 5.1510 6.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6330 4.0020 5.9890 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4830 5.4230 7.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0400 4.5620 8.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5760 5.3640 9.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2590 5.1240 10.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6400 6.2210 11.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3500 7.5290 11.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6710 7.7870 10.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3060 6.6780 9.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6430 6.7140 8.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 7.1850 4.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 7.0830 5.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 8.1950 5.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 9.3730 4.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 9.3890 4.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4760 8.3270 4.3100 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 -0.3290 0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 0.8040 0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.2520 -0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 0.6910 2.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 -0.4890 2.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 0.9400 3.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 3.2260 0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 2.9140 1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 3.2530 2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 3.1570 3.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 5.3060 2.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6870 5.3720 1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2480 7.2370 6.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0590 3.4830 8.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4890 4.1120 11.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1700 6.0500 12.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6580 8.3610 11.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4410 8.7960 9.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 6.1620 6.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9770 8.1450 6.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 10.2550 4.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0080 10.2830 3.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0890 1.3350 1.5190 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.1130 1.2460 1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 53 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 53 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 53 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 12 2 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 44 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 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END