IBS-ZINC05354116 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 63 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7010 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7720 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0750 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6880 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.7500 -2.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -1.9670 -3.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -2.8940 -4.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -2.0920 -6.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 -1.6410 -6.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4600 -1.7950 -6.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3880 -1.2320 -7.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9800 -0.5050 -8.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 -0.3420 -8.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -0.9090 -7.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7880 -0.9260 -7.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1720 -1.6820 -6.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 -1.8720 -6.4110 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3830 -1.3560 -7.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7510 -1.5480 -6.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6810 -1.0140 -7.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2990 -0.2750 -8.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9850 -0.0680 -9.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9940 -0.6040 -8.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6980 -0.4070 -8.6130 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9060 0.0460 -9.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2800 -0.1610 -8.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -4.2790 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 -4.7730 0.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 -4.8080 0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1650 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6260 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1430 -2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 -1.3510 -3.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 -1.3250 -3.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 -3.5100 -4.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -3.5360 -4.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 -2.3570 -5.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4420 -1.3550 -7.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 0.2220 -9.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0630 -2.1180 -6.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7300 -1.1640 -7.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0560 0.1380 -9.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7040 0.5060 -10.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4950 -1.2290 -8.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9120 0.3300 -9.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4820 0.2590 -7.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -4.6400 -1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 -4.4120 1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 -5.8630 0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2040 -4.3960 0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -4.4480 1.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0740 -4.4560 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1580 -5.8980 0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 27 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 28 29 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 M END