PUBCHEM-ZINC03872716 MOE2007 3D CORINA 3.40 0006 02.08.2006 66 68 0 0 1 0 0 0 0 0999 V2000 2.3630 -2.0570 0.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 -3.0700 1.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8990 -4.4920 1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 -2.9310 3.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 -1.5410 3.6990 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0470 -0.8030 3.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 -1.1350 3.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3930 0.3550 3.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 1.0550 4.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7990 -1.5450 5.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 -2.5240 5.7600 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6760 -0.3320 5.8170 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 -0.1080 7.2350 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6490 -1.0100 7.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 1.1150 7.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 0.9060 7.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 1.4300 6.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 0.9460 7.3170 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2890 1.1420 6.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3390 0.1520 8.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 0.1120 8.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 -0.6520 9.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5990 -1.3470 10.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 -1.2910 10.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3310 -0.5390 9.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4800 0.0250 7.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9840 0.9410 8.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2060 -1.0570 7.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6430 -1.1780 7.1600 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0620 -0.1650 7.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9960 -1.7520 8.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2340 -2.0090 6.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1440 -1.4270 5.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6920 -2.1730 4.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3340 -3.5090 3.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4290 -4.1020 4.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8810 -3.3570 5.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4190 -2.1140 1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 -2.2410 -0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0150 -1.0350 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 -2.9220 1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9510 -4.7100 1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 -5.2320 1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7380 -4.6280 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 -3.6790 3.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7310 -3.2050 3.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 -1.3770 2.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 -1.6980 4.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 0.4650 5.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 1.3470 8.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 2.0010 7.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 2.0680 6.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 -0.7060 10.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 -1.9400 11.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6810 -1.8430 10.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3710 -0.5010 8.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6870 -1.8060 6.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5420 -2.7360 8.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0800 -1.8570 8.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6330 -1.0960 9.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4270 -0.3820 5.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3970 -1.7110 3.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7580 -4.0880 3.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1440 -5.1420 4.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1600 -3.8320 6.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5740 0.6970 3.4250 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 41 1 0 0 0 0 3 42 1 0 0 0 0 3 43 1 0 0 0 0 3 44 1 0 0 0 0 4 5 1 0 0 0 0 4 45 1 0 0 0 0 4 46 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 7 8 1 0 0 0 0 7 47 1 0 0 0 0 7 48 1 0 0 0 0 8 9 2 0 0 0 0 8 66 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 26 1 0 0 0 0 15 16 1 0 0 0 0 15 50 1 0 0 0 0 15 51 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 52 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 53 1 0 0 0 0 23 24 2 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 55 1 0 0 0 0 25 56 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 33 61 1 0 0 0 0 34 35 1 0 0 0 0 34 62 1 0 0 0 0 35 36 2 0 0 0 0 35 63 1 0 0 0 0 36 37 1 0 0 0 0 36 64 1 0 0 0 0 37 65 1 0 0 0 0 M CHG 1 66 -1 M END