PUBCHEM-ZINC03874331 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 57 0 0 1 0 0 0 0 0999 V2000 4.2800 1.1460 -2.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2910 0.3220 -2.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6650 -0.8140 -1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0170 -1.0980 -1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0050 -0.2650 -1.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6410 0.8550 -2.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6310 1.7890 -2.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2630 2.9220 -3.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9060 1.3150 -3.1730 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9900 2.0690 -3.8320 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8130 3.1420 -3.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0770 1.7010 -5.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9230 2.2610 -6.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9560 1.6220 -7.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5990 2.2600 -8.4250 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3810 1.6870 -3.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4030 0.5470 -2.6660 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4120 -1.8400 -0.5560 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0700 -2.6100 0.4790 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 -0.9740 -0.2370 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9530 -2.8810 -1.8060 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 -2.3790 -2.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9400 -2.8130 -4.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5130 -4.1500 -3.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9130 -3.9130 -2.2870 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9380 -3.5310 -2.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8180 -5.2100 -1.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9220 -5.4480 -0.6910 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8230 -6.1110 -1.8110 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9080 -7.4330 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8220 -7.4170 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0540 -8.8130 0.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4170 -9.7580 0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9830 2.0250 -3.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 0.5830 -2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3160 -1.9560 -0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0450 -0.4980 -1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2090 0.3920 -2.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0180 2.0750 -5.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1140 0.6080 -5.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9520 2.0330 -5.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9990 3.3510 -6.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -2.8590 -2.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0080 -1.2980 -2.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 -2.8850 -5.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7510 -2.1040 -4.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7490 -4.9330 -3.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -4.4500 -4.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5450 -5.8510 -2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9020 -7.7740 -0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2950 -8.1000 -1.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7950 -6.9900 -0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3980 -6.7830 0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3110 0.5360 -7.6400 O 0 5 0 0 0 0 0 0 0 0 0 0 11.2940 2.5510 -3.3500 O 0 5 0 0 0 0 0 0 0 0 0 0 5.8840 -8.8530 1.5160 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 38 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 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 54 1 0 0 0 0 16 17 2 0 0 0 0 16 55 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 32 33 2 0 0 0 0 32 56 1 0 0 0 0 M CHG 1 54 -1 M CHG 1 55 -1 M CHG 1 56 -1 M END