IFLAB-ZINC05145462 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 47 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 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -2.5850 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7590 -1.8100 0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0550 -3.9130 0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3500 -4.3910 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6970 -5.7270 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0670 -5.9510 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8020 -4.8190 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7480 -3.4140 0.0460 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.2640 -4.7700 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9070 -5.8030 0.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8990 -3.5800 0.0710 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.3280 -3.6070 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8650 -2.1740 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6760 -7.3290 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7080 -6.8110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2870 -7.2670 1.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2660 -7.3020 -1.1750 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3580 -8.2980 -1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9380 -8.7530 -0.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 -8.7890 -2.3630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 -9.8600 -2.3040 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 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 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3090 -4.5340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6900 -4.1220 -0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6720 -4.1320 0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9540 -2.1950 0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5020 -1.6580 0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5200 -1.6490 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8130 -7.6670 1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6420 -7.2980 -0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0140 -8.0180 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6010 -6.9390 -2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 -10.7110 -1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 -10.1620 -3.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 -9.5120 -1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 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 35 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 19 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 13 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 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 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 44 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 M END