CHEMBRIDGE-ZINC01069224 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.6960 -0.6310 0.0150 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 -2.3640 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 -2.7940 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -4.0850 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 -5.0030 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2040 -4.5190 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4050 -3.2040 0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3520 -5.4570 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1580 -6.6570 -0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6120 -4.9790 0.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6850 -5.8550 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9990 -5.4750 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9220 -6.5950 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2910 -7.7760 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5500 -7.5520 0.0070 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.9930 -9.1200 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4480 -8.9150 0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0600 -7.7830 -0.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4350 -6.4520 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4320 -4.0750 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6220 -3.4880 -0.9980 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6200 -3.4370 1.2240 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.0520 -2.0380 1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1890 -1.5580 2.6820 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.2320 -1.6540 3.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6520 -0.0890 2.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9760 -0.1200 3.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8460 -1.4480 4.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1890 -2.3350 3.3620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 -6.7100 -0.0290 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 -4.4230 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7680 -4.0220 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9660 -9.5460 -0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4960 -9.7920 0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0100 -9.8340 0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4800 -8.6520 1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8610 -7.9570 -1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1370 -7.7500 -0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7670 -6.1990 1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7360 -5.6680 -0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4680 -3.9050 2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3150 -1.4250 0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0150 -1.9510 0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9150 0.5350 3.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8270 0.2720 1.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0410 0.7300 4.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8350 -0.1480 2.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2320 -1.3080 5.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8300 -1.8330 4.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 16 2 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 31 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 M END