PUBCHEM-ZINC05554760 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 71 0 0 1 0 0 0 0 0999 V2000 -0.2260 2.6520 1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 1.1410 1.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 0.4440 2.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 -1.0760 2.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 -1.7740 3.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 -2.0280 4.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 -2.6580 5.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3480 -3.0410 5.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9830 -2.7830 4.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 -2.1510 3.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0770 -3.7340 6.7390 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5220 -3.5930 7.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2560 -5.2330 6.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9990 -5.8980 7.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3300 -7.9280 8.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5910 -9.4050 7.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3120 -9.6980 7.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9860 -8.2240 7.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6760 -11.6460 7.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5940 -12.6610 8.2150 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6310 -12.4430 7.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3980 -12.6440 9.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3260 -11.9360 10.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1420 -11.9050 11.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0300 -12.5780 12.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1030 -13.2790 11.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2880 -13.3110 10.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0060 -13.9850 7.8300 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4760 -14.3930 6.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3610 -3.1500 6.9420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 2.9480 1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 3.1300 0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6290 3.0370 2.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 0.8810 1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 0.7930 0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 0.7150 2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 0.8040 3.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 -1.3530 2.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -1.4400 1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 -1.7310 4.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 -2.8440 6.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0220 -3.0690 4.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8130 -1.9520 2.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 -5.6940 6.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8320 -5.3870 5.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9870 -5.4440 7.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4470 -5.8280 8.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -7.7980 9.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2330 -7.3340 8.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0080 -9.4830 6.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3550 -9.7710 8.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 -10.2690 7.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6020 -9.7940 6.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 -7.8500 6.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 -8.1000 8.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6120 -11.9210 8.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8840 -11.7840 6.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6230 -11.4020 9.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 -11.3600 12.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8830 -12.5600 13.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7940 -13.8080 12.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1260 -13.8700 10.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 -14.4620 6.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7720 -13.7010 5.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8750 -15.3840 6.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2730 -2.1920 6.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2370 -7.3690 7.3430 N 0 3 0 0 0 0 0 0 0 0 0 0 4.5830 -7.4450 6.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3720 -10.2250 8.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 30 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 14 67 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 15 67 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 16 69 1 0 0 0 0 17 18 1 0 0 0 0 17 52 1 0 0 0 0 17 53 1 0 0 0 0 17 69 1 0 0 0 0 18 54 1 0 0 0 0 18 55 1 0 0 0 0 18 67 1 0 0 0 0 19 20 1 0 0 0 0 19 56 1 0 0 0 0 19 57 1 0 0 0 0 19 69 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 28 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 58 1 0 0 0 0 24 25 1 0 0 0 0 24 59 1 0 0 0 0 25 26 2 0 0 0 0 25 60 1 0 0 0 0 26 27 1 0 0 0 0 26 61 1 0 0 0 0 27 62 1 0 0 0 0 28 29 1 0 0 0 0 29 63 1 0 0 0 0 29 64 1 0 0 0 0 29 65 1 0 0 0 0 30 66 1 0 0 0 0 67 68 1 0 0 0 0 M CHG 1 67 1 M END