PUBCHEM-ZINC02457503 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 0.3670 0.9940 0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 0.6510 2.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 1.1990 3.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3760 1.9320 2.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 1.3840 1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5570 1.5890 4.9400 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3130 0.8970 5.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0510 1.6270 4.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6950 2.8390 4.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0680 2.8760 4.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7960 1.6890 4.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1440 0.4780 4.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7720 0.4480 4.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0770 -0.8480 4.8850 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.7210 -1.8780 4.9740 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8600 -0.8840 4.9330 O 0 5 0 0 0 0 0 0 0 0 0 0 -8.1140 1.9890 4.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1330 3.3370 3.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9300 3.9190 4.2250 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0620 2.9680 5.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6800 3.7180 4.4220 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0440 3.3660 6.5820 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6710 4.7430 6.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1290 4.7900 8.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7390 6.2270 8.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9690 7.1310 8.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5100 7.0840 7.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9000 5.6460 6.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 -0.0550 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4470 1.1100 0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 1.5950 -0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 0.7190 2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 -0.3910 2.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 0.5960 4.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 2.2320 3.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0840 2.9740 2.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4610 1.8640 2.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0550 0.3510 1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0630 1.9870 0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1280 3.7580 4.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7060 -0.4440 4.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1070 3.3390 2.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0120 3.8700 4.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2790 2.7420 7.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 5.0890 6.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 4.4440 9.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 4.1460 8.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 6.2610 9.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 6.5740 8.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7370 6.7840 9.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6900 8.1550 8.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3860 7.7270 7.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 7.4300 6.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2860 5.6130 5.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6690 5.3000 7.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 1.4410 1.3850 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 1.1420 3.6980 N 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 56 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 56 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 57 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 4 57 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 5 56 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 20 1 0 0 0 0 6 57 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 11 12 2 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 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 44 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END