CHEMBRIDGE-ZINC04820788 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 -0.0050 1.3330 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 1.5180 1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1090 0.8520 1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4180 -0.0030 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5090 -0.1870 -1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 0.4810 -1.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6460 -0.6800 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7400 -2.0120 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8050 -2.7770 0.1770 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1980 -2.4130 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9380 -1.0670 -0.1130 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5960 -0.9020 0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8200 -0.0480 -0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9650 1.1520 -0.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8800 -1.0110 -1.6630 S 0 0 0 0 0 0 0 0 0 0 0 0 7.7730 0.5630 -1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6280 0.7620 -2.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3700 2.0700 -2.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2290 2.7740 -1.7150 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1910 2.4580 -3.6900 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9650 3.6150 -3.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4780 3.9610 -2.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2420 5.1030 -2.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4960 5.9020 -3.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9870 5.5600 -4.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2270 4.4160 -4.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3150 7.1260 -3.1180 N 0 3 0 0 0 0 0 0 0 0 0 0 13.7640 7.4290 -2.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5400 7.8310 -4.0850 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9520 1.8510 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 2.1840 1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8140 0.9970 1.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7470 -0.8520 -1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 0.3390 -1.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4880 -2.9180 0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3930 -3.0480 -0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0580 1.3810 -1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4160 0.5490 -0.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3430 -0.0560 -2.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9850 0.7760 -3.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2450 1.9350 -4.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2800 3.3370 -1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6410 5.3730 -1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1870 6.1870 -5.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8340 4.1470 -5.6200 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 15 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 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 41 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 42 1 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 27 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END