IBS-ZINC02394985 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 1.1540 -1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 0.4840 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0340 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7440 0.2640 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5380 0.9340 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 -0.6860 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7780 -0.2210 -0.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6770 0.9270 -1.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7500 1.3290 -2.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9440 0.6130 -2.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0750 -0.5100 -1.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9920 -0.9510 -0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0700 -2.0470 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0320 -2.4360 0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8760 -1.7790 0.6920 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1870 -3.8850 1.6740 S 0 0 0 0 0 0 0 0 0 0 0 0 6.8960 -4.3440 1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2610 -5.5940 2.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4450 -6.1220 2.7800 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4940 -6.1240 1.9270 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8480 -7.3390 2.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2930 -7.7260 2.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6630 -8.9950 3.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3680 -10.7020 3.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8000 -11.0740 2.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6980 -10.0720 3.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4180 -8.7600 2.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9920 -8.3640 3.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9070 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 1.5020 -2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3430 0.3090 -2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1770 -0.0830 2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 1.1130 2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7560 1.4910 -1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6730 2.2150 -2.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7790 0.9520 -2.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0070 -1.0550 -1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9950 -4.5270 0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5640 -3.5330 1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1460 -5.7010 1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7490 -7.1560 3.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1810 -8.1500 2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 -7.9090 1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9600 -6.9160 2.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5650 -8.8120 4.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9960 -9.8060 2.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6740 -11.4330 2.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2790 -10.6940 4.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0590 -12.0380 3.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8750 -11.1350 1.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1240 -8.0500 3.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5110 -8.7540 1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9140 -8.3180 4.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7550 -7.3890 2.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0510 -9.3680 2.8080 N 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 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 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 16 2 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 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 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 56 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 M END