IBS-ZINC02197907 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3850 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 -0.6930 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0110 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4230 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 2.1010 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 2.1340 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7140 3.3500 -0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7900 1.3840 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7170 0.0270 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 -0.6280 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1000 2.0410 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5690 2.2620 1.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9880 2.8330 1.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4580 3.0550 2.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5160 4.0380 3.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0970 3.4670 3.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6280 3.2460 2.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5250 5.3520 2.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2160 5.4880 1.7970 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7650 6.3750 3.2210 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7730 7.6520 2.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8310 8.6360 3.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8400 9.9700 2.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8990 10.9530 3.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9070 12.2870 2.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9800 13.2560 3.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3740 12.9140 4.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.9070 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -0.5500 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -1.7730 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 3.1810 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6390 -0.5350 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8180 1.4110 -0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0210 3.0020 -0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5630 1.3120 1.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6590 2.1320 0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9940 3.7830 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4520 2.1050 3.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4690 3.4620 2.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8510 4.1960 4.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0910 2.5170 4.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4260 4.1680 4.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6340 4.1960 1.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6160 2.8390 2.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2120 6.2670 4.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7840 8.0590 2.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4380 7.4950 1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8200 8.2290 3.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1660 8.7940 4.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8510 10.3760 2.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5060 9.8120 1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8870 10.5460 3.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2330 11.1110 4.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9180 12.6940 2.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5730 12.1290 1.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8270 14.4980 2.6010 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2210 15.0830 3.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 26 27 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 27 28 2 0 0 0 0 27 57 1 0 0 0 0 57 58 1 0 0 0 0 M END