CHEMSTAR-ZINC04091128 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 62 0 0 0 0 0 0 0 0999 V2000 1.2980 1.2560 -0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 -0.1210 -0.1110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 -0.8770 1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4740 -0.4950 2.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5090 -1.3710 3.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9910 -2.6500 3.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 -3.0470 2.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -2.1690 0.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 -2.3330 -0.7060 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 -0.6890 -1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.1010 -2.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 1.2630 -2.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 2.1100 -1.8710 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 1.5960 -3.9960 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 0.5900 -4.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 0.7150 -6.2020 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.3850 -6.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 -1.4110 -6.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 -2.5290 -7.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5130 -2.6700 -8.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 -1.6750 -9.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 -0.5120 -8.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 0.4840 -8.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 0.2910 -10.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 -0.8700 -10.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 -1.8060 -10.3040 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -0.9180 -3.9860 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 3.0010 -4.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 3.4760 -4.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 4.9220 -5.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 5.9230 -4.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 7.2490 -4.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9190 7.5750 -5.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 6.5750 -6.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 5.2480 -6.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2120 -0.8670 4.8350 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 1.3890 0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7140 1.4590 -1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 1.9460 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 0.4980 2.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -3.3310 4.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -4.0430 1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1230 -1.3360 -5.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6150 -3.3120 -6.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 -3.5570 -9.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 1.3790 -8.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 1.0390 -10.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 -1.0090 -11.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 3.1040 -5.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 3.6060 -3.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 3.3730 -3.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 2.8720 -5.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 5.6680 -3.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 8.0300 -3.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 8.6110 -6.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 6.8290 -7.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 4.4670 -7.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 10 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 40 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 27 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 28 1 0 0 0 0 15 16 2 0 0 0 0 15 27 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 53 1 0 0 0 0 32 33 1 0 0 0 0 32 54 1 0 0 0 0 33 34 2 0 0 0 0 33 55 1 0 0 0 0 34 35 1 0 0 0 0 34 56 1 0 0 0 0 35 57 1 0 0 0 0 M END