PUBCHEM-ZINC04655699 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 61 0 0 1 0 0 0 0 0999 V2000 -0.5980 1.4350 -0.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 -0.0100 -0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 -0.5300 1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -1.8720 1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 -2.7160 0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 -2.2210 -1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -0.8580 -1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -0.3510 -2.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 0.0280 -3.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 0.6380 -4.3980 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6920 -0.0510 -5.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5740 1.0250 -4.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3970 2.7720 -6.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8100 3.8070 -7.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4180 1.8870 -7.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 1.8430 -4.3410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 1.6120 -3.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -2.9660 -2.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5490 -4.3900 -2.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -4.9650 -3.5060 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5690 -4.6200 -3.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -6.4920 -3.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 -8.3180 -5.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 -8.6240 -6.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5790 -8.5030 -4.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 -4.4850 -4.3180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 -3.5340 -4.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 2.0140 -0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 1.5470 -1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 1.8630 0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 0.1050 1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -2.2620 2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -3.7500 0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7760 0.7720 -2.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0270 -0.8460 -3.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1690 1.6100 -4.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1390 0.1630 -5.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8470 3.2770 -5.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 3.3320 -8.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 4.4390 -7.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5970 4.4610 -8.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2250 2.4930 -7.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8760 1.1760 -6.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9610 1.3160 -8.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -4.7590 -1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 -4.6660 -1.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 -6.9680 -3.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 -6.8450 -2.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5380 -8.9530 -4.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 -7.9640 -7.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 -8.4990 -6.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 -9.6580 -6.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2370 -7.8140 -5.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 -9.5240 -4.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7250 -8.3380 -3.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 1.9320 -6.1580 N 0 3 0 0 0 0 0 0 0 0 0 0 1.8300 1.4010 -6.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 2.5420 -5.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -6.8990 -4.9390 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4280 -6.2240 -5.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 -6.6690 -5.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 18 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 56 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 38 1 0 0 0 0 13 56 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 26 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 22 59 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 49 1 0 0 0 0 23 59 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 56 57 1 0 0 0 0 56 58 1 0 0 0 0 59 60 1 0 0 0 0 59 61 1 0 0 0 0 M CHG 1 56 1 M CHG 1 59 1 M END