IBS-ZINC05025701 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -4.2750 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 -4.7830 -0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 -6.1470 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 -6.9780 -0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 -8.2960 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 -8.7970 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0580 -7.8930 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7960 -6.5880 0.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3680 -8.3460 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4750 -7.3860 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7110 -8.0420 0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8660 -7.0400 0.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1840 -6.6030 -0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9480 -5.9460 -1.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7930 -6.9490 -1.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2500 -10.2560 -0.0300 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.3420 -10.8620 1.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 -10.8500 -1.0870 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3840 -9.1590 -0.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -4.6260 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -4.6360 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 -4.1640 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5520 -9.2980 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1920 -6.5150 0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9940 -8.9130 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4840 -8.3540 1.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7460 -7.5080 1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5830 -6.1690 1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4670 -7.4740 -1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0070 -5.8890 -0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1750 -5.6350 -2.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6650 -5.0760 -0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9120 -6.4810 -1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0760 -7.8200 -2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 -8.8030 -0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 -10.1180 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 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 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END