CHEMDIV-ZINC04959313 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 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 3 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 0.7420 -0.5110 1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8350 -1.5960 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -0.1300 2.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 -0.9430 3.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4390 -0.3700 4.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 0.9090 4.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 1.4540 3.2440 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8220 -0.3720 2.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1840 0.3250 2.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8890 0.0680 1.3040 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1950 0.5090 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8330 -0.1870 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0510 -0.6430 -1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5230 -0.3410 -2.1950 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4530 -1.1600 -1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9800 -1.4620 -0.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1310 -1.2920 -2.2910 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5060 -1.7990 -2.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0340 -1.8490 -3.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8620 -0.8450 -4.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3460 -0.8900 -5.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0030 -1.9400 -6.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1750 -2.9460 -5.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6830 -2.9000 -4.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8640 -3.8850 -4.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5460 -4.9360 -4.9890 C 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 -1.0040 -1.9700 2.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1150 -0.9160 4.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 1.5160 5.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9680 -1.4510 2.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 -0.1330 3.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0400 1.3990 2.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7610 -0.0590 3.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0500 1.5880 0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7790 0.2580 -0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2770 0.1890 -0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9780 -1.2620 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 -0.7520 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7100 -1.0500 -3.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5200 -2.8010 -1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1320 -1.1380 -1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1310 -0.0250 -3.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9940 -0.1050 -5.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3820 -1.9730 -7.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9080 -3.7650 -6.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0460 -4.5170 -5.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8870 -5.6540 -4.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4630 -5.4360 -5.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 0.0930 1.2940 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 56 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 11 56 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 15 56 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 M END