ASINEX-ZINC04848374 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 54 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1490 -0.0400 1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 -0.0270 -1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -1.9980 0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5710 -2.6880 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6300 -2.0960 0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 -4.1950 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9250 -4.7020 0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6250 -4.9490 -1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3690 -6.3880 -1.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9540 -7.2930 -0.7620 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7710 -8.6710 -1.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5460 -4.9420 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9670 -4.7370 2.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9600 -5.4630 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4250 -5.6480 2.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8390 -6.1690 2.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4180 -6.3730 1.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4600 -6.4090 3.8260 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7640 -6.8900 3.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4500 -7.1520 4.9030 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.6780 -7.6040 4.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0470 -7.7280 3.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6980 -7.2140 2.4410 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1640 1.0500 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1720 -0.4180 1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6220 -0.4010 2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6630 -0.3780 -2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1960 -0.4040 -1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1880 1.0630 -1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5670 -2.4720 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0410 -4.5460 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0240 -4.5560 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6950 -4.7970 -1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2570 -4.2590 -2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8150 -6.5450 -2.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2950 -6.5660 -1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2430 -9.2930 -0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2250 -8.8760 -2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7050 -8.8970 -1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6140 -4.7510 0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9980 -6.4210 0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7710 -6.3600 3.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3870 -4.6900 3.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9970 -6.2450 4.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3320 -7.8520 5.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0060 -8.0790 3.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 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 15 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 54 1 0 0 0 0 M END