OTAVA-ZINC05552899 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 52 0 0 1 0 0 0 0 0999 V2000 -0.2470 0.4910 1.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -0.9220 1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 -1.7680 0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 -3.0960 0.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 -3.5970 0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5930 -2.7580 0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3370 -1.4320 1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 -4.9970 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 -5.5630 -1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5750 -4.9270 -2.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 -3.7430 -2.5280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -5.8610 -3.4040 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 -7.1580 -3.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -8.5020 -4.0050 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 -7.2420 -1.2890 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 -5.4210 -4.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8040 -4.9350 -5.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 -4.6230 -6.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 -4.6950 -7.4570 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 -4.2590 -7.4670 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0130 -3.9360 -8.8890 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1080 -3.4460 -9.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3780 -5.1830 -9.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2490 -6.2170 -9.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 -5.6590 -10.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8040 -7.4650 -10.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2270 -2.9730 -9.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0390 -2.9700 -8.0950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 0.5280 2.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 1.1400 1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1080 0.8960 1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0360 -1.3990 0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5870 -3.7320 0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6140 -3.1300 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 -0.7980 1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 -5.5980 1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -6.2430 -5.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 -4.6100 -4.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1550 -4.0320 -4.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5860 -5.6970 -5.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6840 -4.1530 -6.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7280 -4.8770 -10.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 -5.6820 -9.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8780 -6.5340 -8.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 -5.3080 -11.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -6.4280 -10.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 -4.8230 -10.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0240 -8.2250 -10.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1920 -7.2250 -11.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6170 -7.9090 -10.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2490 -2.3160 -10.1500 O 0 5 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 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 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 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 41 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 27 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 M CHG 1 51 -1 M END