IBS-ZINC06662542 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -1.1740 -1.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -0.1640 -2.4560 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 -0.6370 -3.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 -0.1300 -4.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 -0.6230 -6.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -0.1240 -7.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 1.0920 -7.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 1.5500 -9.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 0.7920 -9.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 -0.4240 -9.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 -0.8840 -7.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -0.4890 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -0.6340 2.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 -0.3610 2.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7030 -1.0800 3.4470 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -1.2800 4.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -1.7940 5.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4190 -1.8400 4.7370 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 -1.4290 3.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0890 -1.4800 2.6890 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1740 -1.9280 3.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7660 -2.1590 4.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6760 -2.6270 5.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9860 -2.8520 5.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3990 -2.6110 3.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5030 -2.1680 3.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 0.3830 -2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9390 -0.2590 -3.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9310 -1.7260 -3.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8460 -0.5070 -4.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 0.9600 -4.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9150 -0.2460 -6.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 -1.7130 -6.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 1.6840 -7.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 2.5000 -9.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6960 1.1500 -10.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3070 -1.0170 -9.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 -1.8360 -7.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 -0.7070 1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 -0.3380 5.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 -2.0230 4.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 -1.1050 6.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 -2.7900 6.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3600 -2.8150 6.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6950 -3.2170 5.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4270 -2.7910 3.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8310 -1.9880 1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 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 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 14 2 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 30 54 1 0 0 0 0 M END