CHEMDIV-ZINC02958096 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 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 -0.7000 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0820 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7700 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0690 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6880 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.1720 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9270 -4.9790 0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -6.2610 0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 -6.2360 -0.4780 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7810 -4.9890 -0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0880 -4.4580 -1.7740 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 -6.0620 -2.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8830 -5.8510 -3.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2430 -4.7260 -3.5330 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5190 -6.9110 -3.7950 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6450 -6.7050 -4.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1830 -8.0620 -5.1690 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.3800 -8.6620 -5.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3160 -7.8690 -6.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3220 -8.9930 -5.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6780 -9.7320 -4.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8000 -8.7590 -4.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 -7.4770 0.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 -8.7400 0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4420 -9.8680 1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 -9.7460 1.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9500 -8.4950 2.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3370 -7.3600 1.7910 C 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 0.0240 -0.1640 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6250 2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.6020 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1410 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7200 -4.6540 1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9340 -6.6100 -2.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0580 -6.6340 -1.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2300 -7.8110 -3.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4350 -6.1570 -4.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3110 -6.1340 -5.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7820 -6.8910 -6.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9340 -7.9860 -7.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2860 -8.5710 -5.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4380 -9.6660 -6.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4430 -10.0500 -3.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1050 -10.5910 -5.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -8.8370 -0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 -10.8480 0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9910 -10.6320 2.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7800 -8.4050 2.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6870 -6.3830 2.0900 H 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 24 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 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 30 54 1 0 0 0 0 M END