PUBCHEM-ZINC03679044 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6070 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 0.1610 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -0.4540 -3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -1.8350 -3.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 -2.6020 -2.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -1.9910 -1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -2.8280 -0.0260 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1910 -2.3240 0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -3.0340 -0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0270 -4.2280 -0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4170 -4.0380 -0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5160 -4.9030 -0.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7170 -4.3650 -0.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8490 -3.0300 -1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7800 -2.1520 -1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5470 -2.6690 -0.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 -2.0960 -0.7160 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1100 -1.1640 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 -5.4780 0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -5.0640 0.9250 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1480 -4.5650 1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 -6.2880 1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 -6.5680 0.3570 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6080 -2.6050 -4.5600 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 1.2390 -2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 0.1440 -3.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -3.6800 -2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4220 -5.9450 -0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5880 -5.0040 -0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8200 -2.6620 -1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8960 -1.1140 -1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9220 -5.9910 1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 -6.1370 -0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7210 -4.1430 0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 -4.5390 -0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -7.0680 2.2180 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -7.8420 2.3160 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 39 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 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 24 25 2 0 0 0 0 24 41 1 0 0 0 0 39 40 1 0 0 0 0 41 42 1 0 0 0 0 M END