PUBCHEM-ZINC06193069 MOE2007 3D CORINA 3.40 0006 02.08.2006 65 66 0 0 0 0 0 0 0 0999 V2000 2.2030 -2.3570 -2.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 -2.3380 -1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 -0.6690 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 -0.1980 -1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 -0.7780 0.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4340 0.6960 0.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5310 0.8740 1.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9550 2.2680 1.8840 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9440 2.9290 1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7890 2.1520 -0.0790 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1640 4.2730 1.5610 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3850 4.9510 2.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8540 4.5890 4.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0370 5.3110 5.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4970 4.9340 6.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4010 5.2770 6.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2080 5.1270 0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3640 5.3410 1.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2730 4.3930 2.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3530 4.6290 3.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2760 3.6340 3.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2800 3.8870 4.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3650 5.1360 4.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4490 6.1360 4.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4490 5.8790 3.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5210 6.8740 3.3910 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5900 7.7900 3.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4870 6.6870 2.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6910 7.5900 2.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2870 5.5040 5.9310 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1790 4.4940 6.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1860 -2.1690 -1.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 -3.3370 -2.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 -1.6040 -2.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 -2.5490 -1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 -3.0730 -0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3310 0.1210 0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 -1.5780 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 0.7030 -1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3970 -0.9610 -1.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2790 0.0480 -0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9370 -1.3600 0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6450 -1.1930 1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7750 1.0780 -0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5650 1.3010 0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1520 0.5750 2.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3970 0.2410 1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4580 2.7810 2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4490 6.0350 2.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3240 4.7070 2.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7960 3.5070 4.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9110 4.8370 4.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1210 6.3980 4.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9790 5.0390 5.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5820 4.6970 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7290 6.0650 0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2080 3.4090 1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2250 2.6540 2.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9770 3.0870 4.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5210 7.1070 5.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6350 3.6570 6.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8330 4.1530 5.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8130 4.9340 7.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 -0.9610 -0.5190 N 0 3 0 0 0 0 0 0 0 0 0 0 1.2130 -0.2710 -1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 64 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 64 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 5 64 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 48 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 17 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 51 1 0 0 0 0 13 52 1 0 0 0 0 14 15 1 0 0 0 0 14 53 1 0 0 0 0 14 54 1 0 0 0 0 15 16 1 0 0 0 0 17 18 1 0 0 0 0 17 55 1 0 0 0 0 17 56 1 0 0 0 0 18 19 2 0 0 0 0 18 28 1 0 0 0 0 19 20 1 0 0 0 0 19 57 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 58 1 0 0 0 0 22 23 1 0 0 0 0 22 59 1 0 0 0 0 23 24 2 0 0 0 0 23 30 1 0 0 0 0 24 25 1 0 0 0 0 24 60 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 30 31 1 0 0 0 0 31 61 1 0 0 0 0 31 62 1 0 0 0 0 31 63 1 0 0 0 0 64 65 1 0 0 0 0 M CHG 1 64 1 M END