IBS-ZINC02213957 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 53 0 0 1 0 0 0 0 0999 V2000 -0.2610 1.5350 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 0.0630 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -0.2630 -1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 -0.2030 1.2000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8180 0.3710 1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -1.6950 1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 -1.9410 2.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1470 -3.6560 3.8820 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8610 -2.8450 4.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2430 -3.7640 5.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8910 -4.9520 3.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2020 -5.0660 4.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8850 -6.2540 3.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2560 -7.3310 3.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9440 -7.2160 2.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2600 -6.0290 3.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1130 -8.8240 3.1140 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 0.2090 2.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 1.1840 3.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 1.5640 4.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 0.9670 4.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0050 -0.0110 3.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2110 -0.3830 2.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3490 1.3390 5.5410 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6110 0.6820 5.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 2.1630 -0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7900 1.7250 -1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 1.7670 0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 -0.5650 -0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 0.2830 -1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 -1.3340 -1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 0.0300 -2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 -2.2630 1.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 -2.0140 0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0170 -1.4110 2.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5410 -1.5790 3.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5290 -4.5750 4.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8520 -3.9680 5.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7050 -2.8270 5.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6930 -4.2260 4.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9090 -6.3430 4.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4520 -8.0560 2.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 -5.9410 2.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 1.6490 3.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 2.3260 4.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9680 -0.4770 3.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5530 -1.1410 1.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1330 1.0710 6.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2110 0.8620 4.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4520 -0.3900 5.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3270 -3.3810 2.6950 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 -3.9010 2.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 18 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 7 51 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 8 51 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 43 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 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 51 52 1 0 0 0 0 M END