CHEMBRIDGE-ZINC04810483 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 35 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.6920 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0970 1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.7430 2.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7180 -0.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -3.6870 -0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -1.9800 -1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.6620 -1.1540 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -2.8000 -2.7540 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -1.3680 -3.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -1.8400 -5.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 -2.0980 -6.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 -2.4870 -7.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -2.4430 -7.1580 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 -2.0690 -6.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.8900 -8.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7830 -3.2690 -9.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5380 -3.6420 -10.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9210 -3.6410 -10.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5520 -3.2660 -9.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8040 -2.8950 -8.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8660 -4.1120 -11.9790 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1640 2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 -0.7790 -3.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 -0.7550 -3.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2950 -3.2700 -9.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0510 -3.9360 -11.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6300 -3.2660 -9.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2970 -2.6060 -7.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 27 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 8 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 11 12 1 0 0 0 0 11 28 1 0 0 0 0 11 29 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 14 17 1 0 0 0 0 15 16 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 32 1 0 0 0 0 22 33 1 0 0 0 0 M END