CHEMDIV-ZINC04971653 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 0.3090 1.9100 -1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4630 0.4370 -1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8340 0.0830 -0.1550 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -0.4100 -2.3280 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 0.0060 -3.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 -1.2610 -4.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 -2.3410 -3.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -1.8160 -2.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -2.6500 -1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 -4.0330 -1.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 -4.5490 -2.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 -3.7090 -3.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -6.3050 -2.9440 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -6.5520 -4.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8200 -6.9230 -1.8310 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6100 -6.6690 -2.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8910 -8.1530 -2.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3810 -8.4280 -2.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1850 -7.5180 -2.7110 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6580 -9.7800 -2.9970 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9280 -10.4010 -2.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9590 -11.7950 -3.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1720 -12.4860 -3.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3690 -11.7900 -2.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3710 -10.3950 -2.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1360 -9.7140 -2.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6710 -9.6380 -2.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5900 -8.3750 -2.4920 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9920 2.2080 -2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 2.1340 -1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 2.4910 -0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 0.5700 -3.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 0.6680 -4.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 -1.3440 -4.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 -1.2770 -5.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 -2.2600 -0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 -4.6940 -0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 -4.1060 -4.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 -6.3200 -1.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1310 -6.0870 -3.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5300 -8.5060 -3.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3770 -8.7290 -2.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8690 -10.4030 -3.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0420 -12.3640 -3.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1870 -13.5660 -3.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3110 -12.3350 -2.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1560 -8.6330 -2.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7430 -10.3220 -2.6010 O 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 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 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 2 0 0 0 0 M CHG 1 28 -1 M END