IBS-ZINC02195851 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 1 0 0 0 0 0999 V2000 1.2890 1.7730 0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 0.5050 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -0.3770 -0.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 -0.1290 -2.1310 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5790 0.9510 -2.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 -0.6300 -3.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 -0.5170 -3.6340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6450 -1.1970 -4.3260 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9800 -1.4690 -4.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5930 -1.9200 -5.1720 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5450 -1.2200 -2.9640 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8820 -0.6450 -1.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4410 -0.4740 -0.7900 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9470 -1.5900 -2.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8170 -0.4400 -3.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5420 0.3100 -2.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 -1.5160 -0.9280 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 -2.4590 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 -3.2790 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 -4.2000 1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 -4.3250 2.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 -3.5050 2.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -2.5830 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2230 -5.3150 3.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 -6.0170 3.1630 O 0 5 0 0 0 0 0 0 0 0 0 0 2.0480 1.9550 -0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 2.6230 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7970 1.7450 1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 0.2870 0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.4510 -5.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1370 -1.8640 -1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1890 -2.4670 -3.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8650 -0.2330 -4.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1620 1.1200 -2.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5260 0.1390 -1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 -1.6850 -1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2440 -3.2020 -0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6980 -4.8220 1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8890 -3.5840 3.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 -1.9740 1.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 -5.3730 4.2240 O 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 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 12 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 2 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 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 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 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 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 2 0 0 0 0 M CHG 1 25 -1 M END