CHEMDIV-ZINC04971519 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 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 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -2.5700 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1420 -0.0480 -1.1740 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7530 0.3230 -1.0820 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.1310 0.7910 -2.3700 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3820 -0.7760 -0.4390 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9100 1.6960 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8520 2.9860 -0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9740 4.0620 0.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1580 3.8580 1.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2160 2.5610 2.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0980 1.4860 1.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4180 2.6160 3.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4720 4.1170 4.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3030 4.7980 2.7640 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2880 6.1350 2.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1400 6.6030 1.4850 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4540 7.0480 3.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4140 8.5420 3.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5500 8.7380 4.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9210 7.2660 4.1900 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 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 -2.4020 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -3.6600 1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 -2.2190 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 -2.4410 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6670 0.0550 -2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7090 3.1520 -1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9280 5.0670 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1480 0.4780 1.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3560 2.1320 3.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5810 2.1440 4.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4360 4.3730 4.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6630 4.3850 4.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8030 6.7820 4.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4840 9.0350 3.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7090 8.7510 2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1990 8.9340 5.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3140 9.4420 4.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6270 7.1260 3.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2070 6.7290 5.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 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 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 28 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 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 27 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 M END