IFLAB-ZINC02966297 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 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 -0.7010 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0840 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7780 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0810 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.7650 -2.3920 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0790 -3.1200 -3.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5030 -2.8220 -2.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 -3.8710 -3.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1650 -3.9370 -4.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 -4.5440 -4.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 -3.8140 -4.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 -3.6700 -4.4760 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1910 -3.2070 -3.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 -2.6270 -5.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 -2.5760 -6.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9430 -1.5240 -7.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 -0.7200 -7.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 -1.2860 -5.9010 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 -4.9230 -4.8540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.2850 0.0080 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 -0.1620 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6220 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1410 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7910 -1.8270 -2.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5740 -2.8760 -1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4650 -3.5950 -3.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2260 -4.8450 -2.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2030 -2.9310 -5.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9260 -4.5580 -5.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5280 -4.4550 -6.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7830 -5.5940 -4.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6680 -4.0340 -2.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8880 -2.3780 -3.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7400 -3.3010 -6.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7440 -1.3660 -7.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 0.1470 -7.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1580 -4.8800 -5.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 -4.6620 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -4.6430 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -4.6390 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 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 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 22 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 M CHG 1 8 1 M END