PUBCHEM-ZINC04213402 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 68 0 0 0 0 0 0 0 0999 V2000 0.0700 -0.3840 0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 -1.6990 -0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 -1.7200 -1.6410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -2.8260 -2.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 -3.8690 -1.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7880 -4.9930 -2.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 -5.0820 -3.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 -4.0460 -4.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -2.9120 -3.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 -1.8600 -4.1490 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 -1.3110 -5.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -0.0530 -5.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2190 -0.3900 -5.8410 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8180 -1.0680 -4.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9570 -2.2860 -4.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9600 -0.0850 -6.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 0.3580 -7.9230 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4170 -0.2890 -6.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2320 -0.3000 -5.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5310 -0.5300 -6.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4490 -0.6390 -7.5830 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2330 -0.5100 -7.9770 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8060 -0.5810 -9.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5300 0.0580 -10.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1070 -0.0150 -11.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9630 -0.7230 -11.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2390 -1.3600 -10.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6600 -1.2960 -9.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5120 -0.7980 -13.3470 N 0 3 0 0 0 0 0 0 0 0 0 0 5.1480 -0.2380 -14.2210 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5040 -1.4210 -13.6310 O 0 5 0 0 0 0 0 0 0 0 0 0 8.7690 -0.6300 -5.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9950 -0.8600 -6.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1440 -0.9520 -5.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0800 -0.8150 -3.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8650 -0.5860 -3.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7110 -0.4870 -4.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 -0.3010 0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 0.4520 -0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -0.3690 1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -2.5360 0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 -1.7820 -0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 -3.8030 -0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 -5.8050 -2.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 -5.9620 -4.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 -4.1180 -5.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 -2.0530 -6.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -1.0550 -5.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 0.2930 -6.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6230 0.7280 -5.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8280 -1.3930 -4.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8490 -0.3850 -3.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3230 -2.7370 -3.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0110 -3.0150 -5.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9360 -0.1620 -4.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4240 0.6110 -10.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6690 0.4820 -12.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3460 -1.9110 -11.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0980 -1.7970 -8.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0470 -0.9680 -7.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0950 -1.1310 -5.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9810 -0.8880 -3.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8200 -0.4800 -2.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7640 -0.3030 -3.5920 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 1 0 0 0 0 2 41 1 0 0 0 0 2 42 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 7 8 2 0 0 0 0 7 45 1 0 0 0 0 8 9 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 12 49 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 15 53 1 0 0 0 0 15 54 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 55 1 0 0 0 0 20 21 2 0 0 0 0 20 32 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 56 1 0 0 0 0 25 26 1 0 0 0 0 25 57 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 58 1 0 0 0 0 28 59 1 0 0 0 0 29 30 2 0 0 0 0 29 31 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 60 1 0 0 0 0 34 35 1 0 0 0 0 34 61 1 0 0 0 0 35 36 2 0 0 0 0 35 62 1 0 0 0 0 36 37 1 0 0 0 0 36 63 1 0 0 0 0 37 64 1 0 0 0 0 M CHG 1 29 1 M CHG 1 31 -1 M END