IFLAB-ZINC02457854 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 0.0310 2.2920 -3.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 1.0210 -3.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 0.3960 -2.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7920 1.0460 -1.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 2.3280 -2.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 2.9460 -3.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8970 0.2670 -0.6540 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6410 1.3220 0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1150 -0.6760 0.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9650 -0.6060 -1.6640 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8940 0.1920 -2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0220 -0.7060 -3.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4910 -1.8740 -3.7440 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5250 -2.6650 -2.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3980 -1.7770 -2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9100 -2.1300 -5.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5470 -1.3240 -5.7240 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5870 -3.4260 -5.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9880 -3.4240 -6.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7340 -4.6340 -7.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0900 -5.8400 -6.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7110 -5.8570 -5.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9630 -4.6290 -5.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1020 -7.1620 -5.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4170 -7.0990 -3.8270 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.6550 2.7770 -4.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 0.5210 -3.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 -0.5880 -1.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9850 2.8500 -1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 3.9400 -3.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3380 0.6150 -3.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3340 1.0110 -1.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6930 -0.1260 -3.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6170 -1.0840 -2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0770 -3.4550 -3.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0810 -3.1330 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7730 -2.3810 -1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 -1.4120 -3.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7290 -2.4870 -7.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2700 -4.6450 -8.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8910 -6.7800 -7.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4670 -4.6250 -4.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0780 -8.2100 -5.7770 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 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 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 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 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 2 0 0 0 0 M CHG 1 25 -1 M END