PUBCHEM-ZINC04789415 MOE2007 3D CORINA 3.40 0006 02.08.2006 81 85 0 0 1 0 0 0 0 0999 V2000 0.5110 1.9810 0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 0.6680 -0.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7560 -0.1710 0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 -0.1050 -0.1230 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1200 0.0800 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 -1.6240 -0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 -2.0980 -1.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5520 -0.8140 -2.2840 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7580 0.2370 -1.1690 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7450 0.0390 -0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8070 1.6170 -1.7600 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8580 1.8100 -2.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9090 2.6940 -0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2770 2.6310 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3780 2.9510 -1.0220 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1460 3.9650 -1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7170 3.0620 -0.3150 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.5960 3.8170 1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9090 3.0380 2.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0510 1.5590 1.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2030 0.7900 2.2870 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2680 1.0400 1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4940 1.7690 -0.1470 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.5760 2.1050 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4320 0.8910 -1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9940 0.6640 -1.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3340 1.9930 -2.1970 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9370 1.7490 -2.7750 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9830 0.5780 -3.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8150 -0.8010 -3.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6130 2.9990 -3.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1260 2.6150 -3.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4960 1.2570 2.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1040 -0.4710 0.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6270 4.0140 -1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 -0.5480 -3.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4700 2.1790 0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 2.7960 -0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 1.9040 1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 0.8830 -1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 -1.1060 -0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6880 0.3820 0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 -0.3860 1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -1.8040 -0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7320 -2.1530 0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 -2.8460 -2.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2940 -2.4810 -1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1420 2.5390 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7630 3.6780 -1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4300 1.6450 0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2790 3.3990 0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0400 4.7470 0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6050 4.0990 1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8700 3.3220 2.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4110 3.2780 3.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9440 -0.0600 -1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9970 1.3790 -2.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4290 0.1650 -1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0200 0.0270 -2.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9350 0.5890 -4.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2050 0.7340 -4.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7260 -1.5610 -3.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6660 -1.0560 -2.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 2.9290 -4.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3030 3.0460 -4.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7180 3.8990 -3.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8180 3.6520 -3.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9220 2.0520 -4.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1930 2.5790 -3.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6090 2.3210 2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3900 0.8890 1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3560 0.7150 3.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0130 -0.9500 1.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9740 -0.8700 0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2060 -0.6690 0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7570 3.6060 -2.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6000 4.1040 -0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1620 4.9970 -1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 -1.3320 -3.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 0.4180 -3.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 -0.5410 -2.5330 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 4 1 0 0 0 0 2 40 1 0 0 0 0 3 41 1 0 0 0 0 3 42 1 0 0 0 0 3 43 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 28 1 0 0 0 0 13 14 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 14 50 1 0 0 0 0 14 51 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 27 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 33 1 0 0 0 0 22 34 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 56 1 0 0 0 0 25 57 1 0 0 0 0 26 27 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 27 28 1 0 0 0 0 27 32 1 0 0 0 0 28 29 1 0 0 0 0 28 31 1 0 0 0 0 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