PUBCHEM-ZINC06363179 MOE2007 3D CORINA 3.40 0006 02.08.2006 84 87 0 0 1 0 0 0 0 0999 V2000 3.5490 -1.5000 2.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 -0.9650 3.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9350 -0.1000 4.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 0.2660 3.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 -0.0250 4.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 0.3470 3.6140 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8270 -0.3630 2.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0310 -0.0830 4.4220 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9530 -1.1530 4.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3460 0.1590 3.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2800 0.9270 4.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2570 1.7720 5.3950 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1860 0.7060 5.7180 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6120 -0.0120 6.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 1.3430 6.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4270 2.0420 7.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9220 1.8280 7.8350 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0770 0.7210 7.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7490 2.4010 6.6980 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.2290 2.1220 6.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7220 2.4210 8.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6540 3.0620 9.1800 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3770 4.0310 8.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4010 2.2100 9.2320 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3100 2.9680 9.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7980 3.2740 11.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0540 4.1320 11.3780 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8040 5.1170 10.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1740 3.5220 10.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9050 2.4360 11.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1930 4.6620 10.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5310 4.3200 12.7160 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6510 0.8740 9.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5080 3.9070 6.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7180 2.8870 4.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 1.7610 3.4110 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9660 -1.4240 4.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4630 -0.6690 1.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3900 -2.1310 2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6310 -2.0880 2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1430 0.3500 5.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7020 1.3270 3.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6180 -0.3220 2.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 -1.0860 4.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 0.5630 5.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -1.4410 2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7000 -0.0450 1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -0.1080 1.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1580 0.7550 2.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8010 -0.7940 3.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9760 1.5570 4.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7900 0.2240 5.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 0.5690 6.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 2.0680 5.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 1.5890 8.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1840 3.0990 7.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8090 2.7230 6.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4330 1.0660 6.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5970 3.0790 8.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0650 1.4820 8.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 2.3560 10.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0860 3.9000 9.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9690 2.3600 11.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0050 3.8340 11.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1850 1.7050 11.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4300 2.8860 12.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6240 1.9420 10.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0120 4.2880 9.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5860 5.0150 11.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6980 5.4840 9.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8980 4.7590 13.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7610 0.2490 9.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8770 1.0660 11.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4930 0.3610 9.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1710 4.2870 5.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7120 4.4260 7.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 4.0760 6.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4440 3.7000 4.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7790 3.2610 4.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5500 2.4950 3.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 2.2780 4.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8110 -0.7640 4.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7220 -1.3990 5.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2270 -2.4430 4.2430 H 0 0 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 2 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 44 1 0 0 0 0 5 45 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 36 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 7 48 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 10 11 1 0 0 0 0 10 49 1 0 0 0 0 10 50 1 0 0 0 0 11 12 1 0 0 0 0 11 51 1 0 0 0 0 11 52 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 53 1 0 0 0 0 15 54 1 0 0 0 0 16 17 1 0 0 0 0 16 55 1 0 0 0 0 16 56 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 24 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 57 1 0 0 0 0 20 58 1 0 0 0 0 21 22 1 0 0 0 0 21 59 1 0 0 0 0 21 60 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 29 1 0 0 0 0 24 25 1 0 0 0 0 24 33 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