IFLAB-ZINC01321147 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 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 0.7420 -0.5110 1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2850 -0.0870 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -2.0370 1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -0.1080 1.1720 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7670 0.1040 2.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 -0.0430 3.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2140 0.5250 2.3440 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3200 1.4700 1.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0600 -0.5470 1.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6680 0.6900 3.7280 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1260 1.8860 4.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1700 2.8440 3.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5720 2.0000 5.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0830 3.1060 6.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4010 2.8920 7.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0700 1.2280 7.9700 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4890 0.8570 6.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0160 -0.2920 5.8290 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6230 -0.3910 4.6140 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9550 3.9150 8.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2540 3.5860 9.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7710 4.5450 10.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9920 5.8310 10.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6980 6.1640 8.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1870 5.2130 7.9760 C 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 -1.0200 -0.3810 0.0100 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 1.1120 -2.4610 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 -2.3980 2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -2.3400 1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7220 -0.6690 0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1070 -0.2420 1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9540 -1.4920 2.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2120 4.0690 5.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0810 2.5830 10.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0030 4.2920 11.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3960 6.5790 10.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8730 7.1700 8.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9620 5.4720 6.9520 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 31 1 0 0 0 0 2 32 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 5 33 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 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 11 1 0 0 0 0 9 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 19 2 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 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 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 M END