IFLAB-ZINC02911539 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 0 0 0 0 0999 V2000 -0.0040 1.5070 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 0.0010 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -0.7520 1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -0.3240 2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -1.2370 3.4620 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 -2.5270 3.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 -2.9740 1.9520 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -2.1330 0.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -2.4290 -0.8050 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 -0.7080 -1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -0.1260 -2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 1.0830 -2.6180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -0.9300 -3.5580 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3830 -0.3770 -4.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 0.8680 -5.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 1.4110 -6.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 0.7170 -7.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 -0.5240 -7.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 -1.0760 -5.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 -2.2900 -5.6630 F 0 0 0 0 0 0 0 0 0 0 0 0 0.5470 -3.5190 4.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 1.0200 2.8230 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6050 1.4260 3.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5890 2.9320 3.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 3.2380 4.5340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 2.8570 4.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7830 1.3500 3.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 1.8900 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8670 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5030 1.8550 0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 -1.8910 -3.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 1.4120 -4.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 2.3800 -6.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 1.1440 -8.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 -1.0630 -7.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 -3.7780 4.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 -4.4180 3.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 -3.0790 5.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 0.8870 4.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3920 1.1960 2.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5310 3.2270 4.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 3.4720 2.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 3.0980 4.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 3.3950 3.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7390 1.0650 3.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 0.8100 4.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 10 2 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 M END