IBS-ZINC02093710 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 58 0 0 1 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 0.7420 -0.5110 1.2420 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 -2.1350 -0.1310 -1.2860 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0720 0.9490 -1.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5830 -0.5450 -1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0260 -1.3160 -2.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3800 -0.0580 -0.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7620 -0.5000 -0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5090 0.1570 0.9020 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.3990 1.2400 0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9940 -0.2110 0.8280 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.1020 -1.2950 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7230 0.4010 2.0280 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.7700 0.0960 2.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0650 -0.0960 3.3190 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.1740 -1.1780 3.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5780 0.2670 3.2970 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.0950 -0.1210 4.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9660 -0.3060 2.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4350 1.6880 3.2560 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6920 0.5240 4.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6380 1.8260 1.9640 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5530 0.3010 -0.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 -0.7960 -2.4180 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8400 -1.6320 -2.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 -0.2440 -2.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 0.8040 -2.5630 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 -0.8550 -4.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 -0.2040 -4.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4510 -0.0750 -3.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9070 -1.0400 -5.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 1.1870 -5.0990 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 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -1.6200 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 -0.1110 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2340 -0.2160 -1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7970 -1.5840 -0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5160 1.9910 3.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3240 0.2540 5.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0800 2.2790 2.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4930 0.1050 -0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7250 -1.0660 -3.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3280 0.4130 -3.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 0.5200 -2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 -1.1320 -6.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7850 -0.5510 -6.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 -2.0310 -5.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 1.7820 -4.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 1.6760 -5.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 1.0950 -5.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 38 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 26 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 44 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 25 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 24 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 32 50 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 33 53 1 0 0 0 0 33 54 1 0 0 0 0 33 55 1 0 0 0 0 34 56 1 0 0 0 0 34 57 1 0 0 0 0 34 58 1 0 0 0 0 M END