IBS-ZINC01175001 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 2.0180 1.1430 -1.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8940 -0.2770 -0.9280 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 -0.8210 0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -0.0030 1.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5500 -0.5510 2.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4460 -1.9140 2.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 -2.7440 1.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9630 -2.1900 0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 -4.2070 1.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -4.9300 0.9920 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2310 -4.7660 3.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0060 -6.0840 3.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 -6.8400 2.4410 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 -8.2220 2.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -8.9920 1.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 -10.3580 1.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 -10.9590 2.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6440 -10.1950 3.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7730 -8.8290 3.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 -12.7020 3.1360 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 -12.9420 4.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -13.1120 2.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2890 -13.3930 2.5300 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5110 -13.1490 3.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6780 -13.7390 2.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8430 -13.5190 3.1790 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9260 -12.7260 4.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1620 -12.4730 4.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2180 -11.6630 5.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0650 -11.0760 6.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 -11.2990 5.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7540 -12.1290 4.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5720 -12.3600 4.1930 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0190 1.4440 -0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8510 1.4450 -2.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 1.6220 -0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 1.0650 1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7770 0.0900 3.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5920 -2.3390 3.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 -2.8260 -0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5550 -4.1400 4.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2770 -6.5380 4.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -6.4170 1.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 -8.5240 0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -10.9580 0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9970 -10.6670 4.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2270 -8.2340 4.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 -13.9690 1.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6140 -14.3790 1.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0650 -12.9210 4.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1710 -11.4710 6.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1360 -10.4370 7.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9640 -10.8380 6.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 7 2 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 33 2 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 31 2 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 32 33 1 0 0 0 0 M END