IFLAB-ZINC04346961 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 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 0.0220 -0.7200 1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.4290 0.7000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -1.9930 -1.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.6950 -1.1140 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.9470 -2.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -2.4860 -3.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -3.4200 -4.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -4.7670 -4.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -5.1730 -2.9090 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -4.3230 -1.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -0.1620 2.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4110 0.0080 3.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4040 0.5500 4.3800 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7920 1.1830 5.0260 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4700 1.5870 6.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3200 2.0700 4.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9480 -0.1380 5.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9930 -0.8870 6.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8980 -1.9250 6.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7630 -2.2160 5.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7180 -1.4620 4.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8120 -0.4200 4.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5640 -1.7450 3.2200 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4610 -0.9290 2.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6540 -3.2370 5.5340 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6440 -3.9680 6.7620 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 -0.0150 -1.4280 -3.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -3.1010 -5.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -5.4980 -4.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -4.6930 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -0.8480 3.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 0.8050 2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9400 0.6930 2.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 -0.9600 3.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 0.5380 4.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3200 -0.6610 7.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9320 -2.5080 7.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7780 0.1700 3.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6570 0.1100 2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4570 -1.0160 1.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1900 -1.2600 1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6620 -4.4170 6.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8610 -3.2920 7.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4000 -4.7510 6.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 M END