IFLAB-ZINC02709227 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 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 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9170 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9300 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -5.0430 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3150 -4.7770 -1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8850 -4.1620 -2.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7470 -5.2440 -1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3890 -4.8430 -2.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6950 -5.1880 -2.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3460 -5.8970 -1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6730 -6.2460 -1.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3540 -5.8900 -2.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7080 -5.1840 -3.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3820 -4.8260 -3.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6800 -4.0510 -4.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7040 -4.8570 -5.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3940 -2.7150 -4.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3800 -7.0170 -0.4780 C 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 -1.8540 -5.5350 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7750 -6.3300 -0.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2670 -4.8000 -0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8150 -6.1760 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3910 -6.1650 -2.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2410 -4.9070 -4.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6470 -3.8670 -4.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7370 -5.0400 -6.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1960 -4.2960 -6.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1950 -5.8090 -5.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3770 -2.1410 -3.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8860 -2.1540 -5.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4270 -2.8980 -5.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8350 -6.3190 0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1550 -7.6420 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6620 -7.6470 0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 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 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 M END