IFLAB-ZINC04519649 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3800 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 1.2190 -0.5500 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4350 0.7210 -0.0170 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 1.9580 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -2.0290 -0.0220 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5700 -2.5820 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3020 -2.3850 -1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 -3.8220 -1.2910 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2750 -4.3670 -2.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6650 -3.6670 -3.2210 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5640 -5.8460 -2.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3540 -6.4040 -3.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 -6.6970 -3.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 -2.4650 1.4470 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 -3.8760 1.5630 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6140 -1.6200 1.5640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 -2.0040 2.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 -2.9160 3.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -2.5560 4.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 -1.2820 4.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -0.3700 4.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 -0.7330 3.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9440 -0.9290 5.9730 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 1.9480 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 -0.5970 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 3.0240 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7190 -2.1220 -2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2400 -1.8310 -1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 -4.3820 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7360 -6.2980 -1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6640 -5.7000 -4.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0460 -7.2220 -3.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5650 -7.7080 -3.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1840 -6.1870 -4.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4900 -3.9100 2.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9440 -3.2680 4.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 0.6250 4.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -0.0230 2.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 15 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 M END