IBS-ZINC02130405 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 -0.0220 1.8100 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8770 -0.3920 -1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -1.9100 -1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7200 -2.2370 -2.9980 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6850 -1.7310 -3.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 -3.7260 -3.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 -4.3460 -4.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6430 -4.3680 -2.1460 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0180 -3.8720 -1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8490 -5.8150 -2.2390 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9500 -6.1010 -3.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1210 -6.1990 -1.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3340 -5.5720 -2.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5880 -5.9500 -1.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5180 -6.6500 -0.4420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6690 -6.5310 -1.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -5.8970 -1.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 -1.7830 -4.1390 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -2.2840 -4.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 -1.9320 -5.3170 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 -1.0230 -6.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -0.6440 -7.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0700 0.2830 -8.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 0.8480 -8.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0250 0.4890 -7.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -0.4470 -6.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 -0.8630 -4.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5480 -0.4010 -4.8280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1870 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1710 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1610 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3270 0.0240 -2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8770 0.0400 -1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 -2.3260 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -2.3420 -1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0570 -5.8350 -0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2270 -7.2840 -1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3980 -5.9370 -3.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2290 -4.4870 -2.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 -3.0130 -3.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5020 -1.0760 -7.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7100 0.5750 -9.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 1.5730 -8.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0070 0.9320 -6.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7820 -5.5100 -1.8510 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 -7.8730 -1.6090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 -8.2870 -1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5570 -5.7790 -1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 19 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 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 46 1 0 0 0 0 17 18 2 0 0 0 0 17 47 1 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 46 49 1 0 0 0 0 47 48 1 0 0 0 0 M END