CHEMBRIDGE-ZINC00991865 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 0.0100 1.4060 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.0230 0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1790 -0.6530 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3510 0.0910 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5800 -0.5430 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6510 -1.9200 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 -2.6800 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 -2.0360 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 -4.1500 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 -4.8050 -0.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8860 -4.8400 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6890 -6.2790 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7960 -7.0480 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8950 -6.5300 0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6720 -8.5160 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4160 -9.1150 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3080 -10.4890 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4390 -11.2810 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6870 -10.7040 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8150 -9.3220 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0720 -8.7380 0.2460 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.0120 -9.3270 1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7340 -10.3150 1.6630 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.3810 -8.7720 1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7030 -7.6380 0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9820 -7.1220 0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9480 -7.7260 1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6370 -8.8540 1.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3580 -9.3830 1.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5900 -9.4440 2.6570 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.8890 -8.8480 2.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 1.7800 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 1.7710 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 1.7560 0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3030 1.1700 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4880 0.0420 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6120 -2.4120 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 -2.6150 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4330 -4.5570 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4560 -4.5430 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 -8.5020 -0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3360 -10.9500 -0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3440 -12.3570 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5640 -11.3290 0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2710 -7.9070 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9520 -7.1630 -0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2300 -6.2450 -0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9470 -7.3180 1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1160 -10.2630 2.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2860 -8.8560 1.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5520 -9.4150 3.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8200 -7.8200 3.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 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 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 M END