PUBCHEM-ZINC00631245 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 0.2250 0.0940 -1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -0.8910 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 -1.1660 2.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 -0.6350 3.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4450 -0.7340 3.5400 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9830 0.0060 2.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3020 -0.4840 1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1830 -1.5480 4.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5550 -1.4390 4.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2060 -2.3320 5.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5650 -3.2840 6.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 -3.3260 5.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5270 -2.4940 5.0780 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 -4.3550 6.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1570 -5.3290 7.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4530 -6.3050 8.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 -6.3390 8.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -5.3850 7.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 -4.4090 6.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 -7.3410 8.8290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -7.4100 8.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9850 -2.2060 5.4640 S 0 0 0 0 0 0 0 0 0 0 0 0 7.3350 -3.5960 6.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8290 -3.6850 6.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 0.1360 -1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3980 -0.2110 -2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 1.1030 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 -0.9730 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -1.8840 -0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5040 -2.2280 2.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 -1.0080 2.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7290 0.4200 3.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -1.1660 4.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7890 1.0760 2.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0630 -0.1090 2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6010 0.1480 0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5530 -1.5300 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1200 -0.6730 3.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2440 -5.3400 7.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0010 -7.0430 8.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 -5.3680 7.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -3.6790 6.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2100 -8.2540 9.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3590 -6.5030 9.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3260 -7.5990 7.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8090 -3.4440 7.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9870 -4.5310 6.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3890 -3.8590 5.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2110 -2.7730 7.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0410 -4.5200 7.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 -0.4070 1.2260 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5260 0.5810 1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 51 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 51 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 8 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 7 51 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 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 22 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 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 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 21 43 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 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END