PUBCHEM-ZINC05497230 MOE2007 3D CORINA 3.40 0006 02.08.2006 70 74 0 0 1 0 0 0 0 0999 V2000 -0.3770 1.5410 -1.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 0.1110 -1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 0.0320 0.2270 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2790 0.5400 0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 -1.4900 0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 -2.0150 -0.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 -0.7230 -1.7730 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1980 0.1100 -1.3200 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3440 0.9490 -2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7660 0.6350 0.0820 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6530 1.7240 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7580 0.3750 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 0.3140 3.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 1.2660 4.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5390 2.5940 4.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9360 2.2610 2.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3730 -0.7100 -1.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5700 -0.0560 -1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6940 1.1590 -1.3600 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6910 -1.0620 -1.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8430 -1.4110 -3.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3100 -2.6870 -3.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4720 -3.0380 -4.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1750 -2.1180 -5.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7230 -0.8450 -5.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5630 -0.4900 -4.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0030 -0.6490 -1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7380 0.4600 -1.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9390 0.8180 -0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4210 0.0750 0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7040 -1.0270 0.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5030 -1.3870 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9530 -1.0250 -3.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 -0.5350 -1.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 2.1260 -1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 1.5170 -2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1080 2.1110 -1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -1.7640 1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 -1.9200 0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 -2.5330 -0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -2.7430 -1.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0290 -0.6820 1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6770 0.9550 1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0790 0.4300 3.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 -0.7330 3.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 0.9910 5.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3360 1.2800 5.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9450 3.3340 4.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5450 3.0090 3.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 2.4060 2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 2.8250 1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3600 -1.9830 -1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5570 -3.4210 -2.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8340 -4.0290 -5.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3010 -2.3900 -6.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4970 -0.1230 -6.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2220 0.5180 -3.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3820 1.0600 -2.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5000 1.6760 -1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3580 0.3520 0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0820 -1.6090 1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9670 -2.2570 0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -0.1050 -3.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 -1.6250 -3.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -1.5860 -3.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9560 -0.4960 -2.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6940 -1.5830 -1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3780 0.0080 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1830 0.7740 2.5540 N 0 3 0 0 0 0 0 0 0 0 0 0 1.2750 0.3020 2.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 10 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 17 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 12 69 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 13 69 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 14 47 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 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 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 27 1 0 0 0 0 20 52 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 54 1 0 0 0 0 24 25 2 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 25 56 1 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 58 1 0 0 0 0 29 30 1 0 0 0 0 29 59 1 0 0 0 0 30 31 2 0 0 0 0 30 60 1 0 0 0 0 31 32 1 0 0 0 0 31 61 1 0 0 0 0 32 62 1 0 0 0 0 33 63 1 0 0 0 0 33 64 1 0 0 0 0 33 65 1 0 0 0 0 34 66 1 0 0 0 0 34 67 1 0 0 0 0 34 68 1 0 0 0 0 69 70 1 0 0 0 0 M CHG 1 69 1 M END