CHEMBRIDGE-ZINC04757764 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 -0.0840 0.5180 -0.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 -0.4700 0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 -0.3980 1.4050 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 -1.2200 1.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 -0.8820 2.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8230 0.2520 3.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 0.5130 2.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 1.5500 2.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 2.3100 3.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 2.0530 4.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 1.0260 4.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7540 -1.5270 2.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0720 -1.8980 4.1790 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2440 -2.4260 4.1860 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7470 -2.4240 2.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8150 -1.8560 2.1490 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9260 -1.6420 0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4640 -0.2350 0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3260 -3.0440 2.4980 S 0 0 0 0 0 0 0 0 0 0 0 0 7.9350 -3.6200 4.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3130 -4.2080 3.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8320 -4.2340 2.8390 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9680 -4.7030 5.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3070 -5.2740 4.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8140 -5.7540 6.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6380 -6.9850 6.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2740 -6.9980 7.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8000 -5.7740 8.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5240 -5.0260 7.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 0.2640 -1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 0.4640 -1.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 1.5280 -0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 -0.2160 0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 -1.4810 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 -2.0190 0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 1.7590 2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 3.1130 4.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 2.6570 5.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9980 0.8290 4.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6070 -2.3790 0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9430 -1.7480 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5460 -0.0750 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7830 0.5020 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4470 -0.1290 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9800 -2.7810 4.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2610 -4.3810 4.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5530 -4.6820 5.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2630 -6.1140 4.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9820 -4.5140 4.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1120 -7.8060 6.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3260 -7.8310 8.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3540 -5.4480 9.0030 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 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 M END