CHEMBRIDGE-ZINC04741804 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 59 0 0 1 0 0 0 0 0999 V2000 1.0610 0.3970 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 0.2120 -0.1620 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1300 1.2020 -0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 -0.6070 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5590 -0.0560 -2.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 -0.7980 -3.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7180 -2.0960 -2.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3460 -2.6540 -1.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 -1.9170 -0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8560 -0.5840 -1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1360 -1.3780 -0.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8750 -0.8660 0.1690 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1930 -1.0790 0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2180 -1.7920 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4720 -1.7820 0.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6970 -1.0940 1.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6460 -0.3880 2.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3810 -0.3850 1.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2130 0.2280 2.0630 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3230 -0.0760 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9030 0.3610 1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0050 -1.1590 2.2160 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.4540 -0.5950 3.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7850 -0.0090 4.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.9050 -0.7730 3.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3150 -1.0000 4.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6700 -1.1700 5.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6160 -1.1030 4.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2120 -0.8580 2.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8570 -0.6880 2.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 0.7270 1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5850 1.1650 1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 -0.5300 1.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 0.9560 -2.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 -0.3610 -4.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3160 -2.6710 -3.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6580 -3.6650 -1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -2.3810 0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 -1.1250 -1.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0680 0.4210 -1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7850 -1.3420 -1.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9030 -2.4250 -0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0650 -2.3330 -1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2810 -2.3340 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7640 0.1620 3.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 1.4210 0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 0.2030 2.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6730 -1.6910 1.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5830 -1.0490 5.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9870 -1.3520 6.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6710 -1.2330 4.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9550 -0.7900 2.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5730 -0.4630 1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0650 -0.4100 0.0730 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.9020 -1.3440 0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 54 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 10 54 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 54 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END