CHEMBRIDGE-ZINC01216811 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 53 0 0 0 0 0 0 0 0999 V2000 1.1140 2.1660 -0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 0.7280 -0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 -0.2150 0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 -1.6640 0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -2.0000 -0.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 -2.4840 1.2270 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 -3.8820 1.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 -4.6950 0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 -6.0740 0.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 -6.6730 1.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1910 -5.8450 2.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 -4.4550 2.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1410 -3.5930 3.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1460 -2.3420 3.0330 O 0 5 0 0 0 0 0 0 0 0 0 0 1.3080 -8.1250 2.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 -8.6350 3.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 -10.0120 3.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 -10.9110 2.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 -10.4300 1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -9.0410 1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -11.3860 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 -12.6320 0.3670 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0860 -12.3120 2.7190 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -13.0530 3.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 -12.6240 4.9920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 -14.5430 3.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -15.4030 4.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7030 -16.8860 4.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1940 2.2630 -0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 2.8240 -0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8770 2.5160 0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 0.6700 -0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 0.4190 -1.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 -0.1640 0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1210 0.0870 1.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2390 -2.0560 1.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -4.2850 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -6.6800 0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8030 -6.2810 3.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 -7.9590 4.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8470 -10.3510 4.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6330 -8.6770 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 -12.8130 1.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -14.7540 2.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8680 -14.7820 3.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 -15.1840 5.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 -15.1580 5.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5380 -17.4820 5.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -17.1430 3.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6730 -17.1700 4.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8030 -4.1520 4.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7000 -10.9030 -1.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 51 2 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 52 2 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 M CHG 1 14 -1 M CHG 1 22 -1 M END