IBS-ZINC02094032 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 70 0 0 1 0 0 0 0 0999 V2000 -1.6370 2.5090 -0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 1.2050 -0.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 0.9180 -2.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.3860 -2.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 -0.6680 -3.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5270 -0.2890 -3.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1030 -0.5650 -5.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2520 -0.2200 -5.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 -1.1990 -5.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 -1.6030 -5.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -1.3650 -4.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8120 -1.7890 -4.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 -2.4450 -5.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 -2.6800 -6.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -2.2570 -6.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5830 -3.3960 -7.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 -1.5580 -3.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7690 -1.4160 -3.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3730 -1.5950 -4.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5130 -1.0320 -1.9420 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1530 -0.0670 -1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2780 -2.0930 -0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9690 -1.6640 0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8880 -2.8010 1.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2730 -0.4230 0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9460 -0.9410 -2.2330 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6140 0.5140 -2.6540 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.9820 0.2590 -2.9420 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1880 1.4500 -1.6740 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8710 1.0100 -4.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4390 0.6330 -5.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8560 1.0220 -6.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7040 1.7880 -6.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1370 2.1650 -5.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7230 1.7790 -4.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0680 2.2110 -7.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9670 3.3280 -1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 2.4150 -1.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1000 2.7130 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 1.2990 -0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 0.3860 -0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 0.8240 -3.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 1.7370 -2.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -0.2920 -1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 -1.2050 -1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 0.2230 -2.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4960 -2.7740 -5.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 -2.4480 -7.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1040 -2.6670 -8.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 -3.9530 -8.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3070 -4.0850 -7.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6890 -3.0460 -1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 -2.2000 -0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0140 -1.4340 0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8430 -3.0320 1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3800 -2.4960 2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3840 -3.6860 1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3310 0.3860 0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7660 -0.1180 1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 -0.6540 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5030 -1.7340 -2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3380 0.0350 -5.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2990 0.7280 -7.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2380 2.7620 -5.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2810 2.0770 -3.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4840 3.1680 -8.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9910 2.3100 -7.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2690 1.4600 -8.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 3 42 1 0 0 0 0 3 43 1 0 0 0 0 4 5 1 0 0 0 0 4 44 1 0 0 0 0 4 45 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 46 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 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 48 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 26 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 54 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 25 58 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 26 27 1 0 0 0 0 26 61 1 0 0 0 0 27 28 2 0 0 0 0 27 29 2 0 0 0 0 27 30 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 62 1 0 0 0 0 32 33 1 0 0 0 0 32 63 1 0 0 0 0 33 34 2 0 0 0 0 33 36 1 0 0 0 0 34 35 1 0 0 0 0 34 64 1 0 0 0 0 35 65 1 0 0 0 0 36 66 1 0 0 0 0 36 67 1 0 0 0 0 36 68 1 0 0 0 0 M END