CHEMDIV-ZINC06939451 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 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 2.1480 -0.1040 1.1720 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 -0.1820 2.5240 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3970 0.2410 2.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 0.4420 3.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2440 -1.8820 2.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2750 -2.6440 2.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3900 -3.9770 2.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4700 -4.5520 3.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 -3.7840 4.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3300 -2.4500 3.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 -5.9040 4.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7610 -6.5840 4.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2110 -7.8580 4.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3460 -7.9620 4.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5680 -6.7930 3.5490 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8630 -1.3210 -1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1600 -1.7990 -1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0050 -1.4830 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5540 -0.6880 1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 -0.2140 1.0620 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 0.2850 -0.0870 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -1.5980 1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 0.2110 0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9900 -2.1960 1.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1940 -4.5720 2.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7200 -4.2280 4.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5290 -1.8510 4.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8990 -6.1830 5.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7710 -8.6550 5.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9360 -8.8530 3.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -1.5680 -1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5120 -2.4200 -1.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0190 -1.8560 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2150 -0.4410 1.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9020 0.4040 1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 20 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 M END