CHEMBRIDGE-ZINC02895376 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 -0.0450 1.5020 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -0.0040 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 -0.7020 -0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 -2.0830 -0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -2.7710 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -2.0670 0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -0.6860 0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.1700 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -4.8390 -1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -4.2300 -2.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 -6.3430 -1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -6.8480 -2.6260 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5750 -6.4640 -3.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 -8.3600 -2.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 -9.0580 -2.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3970 -8.8390 -3.1790 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3680 -8.0070 -3.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5460 -8.3840 -4.1500 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3990 -7.4910 -4.5240 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5690 -7.8660 -5.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4820 -6.9100 -5.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7520 -7.1610 -6.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3250 -5.9480 -6.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4190 -4.9640 -5.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3260 -5.5710 -5.3650 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6320 -3.5150 -5.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8250 -3.0030 -6.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0160 -1.6410 -6.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0350 -0.7760 -6.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8540 -1.2720 -5.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6480 -2.6310 -5.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8140 -0.3380 -5.0590 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.0120 0.9620 -5.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6910 -0.8060 -4.5560 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.8530 -6.3800 -3.3530 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 1.8470 0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 1.8810 0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 1.8690 -0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3560 -0.1670 -1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3150 -2.6280 -1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 -2.5990 1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -0.1380 1.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -4.6580 0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -6.7620 -0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -6.6520 -0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 -9.7990 -3.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7970 -8.9150 -5.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1830 -8.1290 -6.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2970 -5.7760 -6.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5900 -3.6750 -6.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9330 -1.2450 -6.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1920 0.2910 -6.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7290 -3.0160 -5.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 43 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 44 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 35 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 17 35 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 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 25 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 49 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 30 2 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 31 53 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 M CHG 1 32 1 M CHG 1 34 -1 M END