CHEMBRIDGE-ZINC02826793 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 0.2800 0.8270 1.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 0.0030 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 -0.1260 -1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0980 0.5660 -1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 1.3990 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 1.5250 1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6650 2.1430 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7200 1.5470 -0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6600 3.4820 0.2240 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8560 4.1800 0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9600 5.5320 0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3400 6.0080 0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2190 5.0190 0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3950 3.4660 0.1410 S 0 0 0 0 0 0 0 0 0 0 0 0 8.6420 5.5650 0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5180 6.9750 0.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0660 7.3450 0.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8010 6.4200 0.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3540 6.6720 1.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2300 6.9570 -0.5500 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0720 7.8430 -0.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6230 8.3110 -1.7990 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4570 8.7630 -2.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 9.3160 -1.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 8.9780 -2.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 7.8080 -3.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0810 7.2040 -2.5530 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0680 0.4250 -2.1580 N 0 3 0 0 0 0 0 0 0 0 0 0 2.8690 -0.3900 -3.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0640 1.1250 -2.1890 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.4340 0.9280 1.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9340 -0.5410 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -0.7720 -1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 2.1680 1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8180 3.9580 0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2820 4.9370 0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0360 5.6240 -0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6560 6.9460 1.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2240 7.6650 0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0370 7.8820 -0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6190 7.9460 1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5870 6.7560 -1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 7.3050 0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3460 8.7080 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 9.1700 -0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 10.3400 -1.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4440 8.6650 -2.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 9.8340 -3.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 7.0890 -3.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 8.1820 -4.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 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 35 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 27 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 M CHG 1 28 1 M CHG 1 30 -1 M END