PUBCHEM-ZINC04165310 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 1.4970 1.8530 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 0.3800 -0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 -0.3550 0.8990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -1.7190 0.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0020 -2.4470 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 -3.8430 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 -4.5260 1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 -3.8140 2.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -2.4180 1.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 -1.5850 3.1260 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 -6.0080 1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 -6.6060 0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6150 -6.5640 2.3700 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6640 -7.9410 2.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7420 -8.2840 4.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8000 -9.6240 4.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 -10.6510 3.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -10.3080 2.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 -8.9670 1.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 -12.0930 3.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7470 -13.9480 5.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 -14.4450 5.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5390 -14.6110 4.6770 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7980 -13.3700 4.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 -12.8030 3.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8670 2.1770 1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9670 2.4650 -0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 2.0380 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 0.0790 -1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8740 0.2220 -0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 -1.9640 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6380 -4.3900 -0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -4.3250 2.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 -5.9310 3.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -7.5130 4.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 -9.8480 5.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6940 -11.0770 1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5810 -8.7580 0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1630 -12.7470 3.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5960 -12.1950 4.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 -13.7630 6.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 -14.6540 4.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 -15.4200 6.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 -13.7580 6.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5400 -13.5600 3.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2380 -12.6620 4.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 -13.4900 2.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 -11.8230 2.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 -12.6330 4.4590 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1940 -11.9410 5.1350 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 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END