IBS-ZINC04980907 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 62 0 0 1 0 0 0 0 0999 V2000 -0.5820 0.6530 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 0.5120 2.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 2.7480 1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6900 3.4180 2.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 4.9350 2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4540 5.5790 3.3300 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1590 5.8650 4.7290 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7540 4.9390 5.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5020 6.2740 5.3790 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.4050 6.4200 4.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7270 5.9350 2.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2620 5.8610 1.8650 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5540 6.8330 4.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9850 5.1910 6.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8780 3.9990 6.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5850 5.5780 7.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3460 6.7380 7.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8780 7.0660 8.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6510 6.2400 10.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8990 5.0730 9.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3750 4.7410 8.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6050 4.1820 10.9590 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0930 4.4850 12.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 6.9600 4.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9430 8.0060 4.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 9.0080 4.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 8.9930 5.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 7.9710 6.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 6.9600 6.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 7.8400 7.5560 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 8.8870 7.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8570 -0.4050 0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 0.7780 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0650 1.1660 -0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 0.6770 2.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 -0.5500 2.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 0.8750 3.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 3.1500 0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 2.8850 1.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7430 3.1670 2.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 3.0500 3.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 5.2170 2.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7000 5.3080 1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4180 7.2350 5.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5590 7.3920 6.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4790 7.9660 9.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0820 6.5350 11.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7940 3.8270 8.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6750 5.4270 12.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1880 4.5040 12.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7640 3.6890 12.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5250 8.0580 3.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 9.8100 3.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 9.7950 5.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 6.1710 6.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5400 8.6530 8.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9640 8.9490 7.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 9.8460 7.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 1.2580 1.3540 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.1150 1.1320 1.3440 H 0 0 0 0 0 0 0 0 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 1 59 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 2 59 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 3 59 1 0 0 0 0 4 5 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 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 24 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 44 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 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 59 60 1 0 0 0 0 M CHG 1 59 1 M END