PUBCHEM-ZINC03731937 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 1.7090 1.1620 -0.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 -0.0510 -0.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8850 -0.7520 0.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -1.9140 0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 -2.3550 -0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 -1.6920 -1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -0.5410 -1.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5970 -2.2840 -2.9430 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 -3.5040 -0.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8140 -3.2100 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 -2.6730 2.0180 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4120 -3.5880 1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 -3.1320 2.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 -3.7980 1.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6930 -4.2270 1.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2160 -4.0050 3.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4180 -3.3850 3.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1120 -2.9620 3.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 -2.2940 4.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 -2.3750 4.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4690 -4.3590 3.4370 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4140 -4.7200 2.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8000 -4.7520 3.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9240 -7.1420 3.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8700 -5.3090 5.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 0.8650 -1.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 1.8540 -1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8440 1.7070 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5520 -0.3970 1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -0.0310 -2.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8980 -2.5590 1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3270 -2.7580 -0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3140 -4.1550 0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 -3.9900 0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2590 -4.7340 0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8260 -3.2290 4.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 -2.7650 5.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 -1.2440 4.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 -3.4010 4.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 -1.7540 5.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1570 -5.7000 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4270 -3.9710 1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5820 -5.0730 2.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0390 -3.7540 3.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8790 -7.2980 3.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0860 -7.3960 3.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8660 -7.7360 4.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6780 -4.2830 5.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8480 -5.3950 4.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7890 -5.9860 6.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 -1.8520 3.1050 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1360 -0.8800 3.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4760 -1.8170 2.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8110 -5.6900 4.2680 N 0 3 0 0 0 0 0 0 0 0 0 0 6.8980 -5.5560 4.7330 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 11 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 30 1 0 0 0 0 9 10 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 51 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 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 21 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 19 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 51 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 23 54 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 54 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 54 1 0 0 0 0 51 52 1 0 0 0 0 51 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 51 1 M CHG 1 54 1 M END