PUBCHEM-ZINC03064196 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 0 0 0 0 0 0999 V2000 4.7180 2.0990 4.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9760 3.8790 5.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8490 4.3950 6.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8570 3.3470 6.3370 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4040 2.0830 6.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5050 1.5380 5.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 3.4590 6.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2960 2.5070 6.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 4.7870 5.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 4.9670 4.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4880 6.2170 4.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2820 7.2850 5.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 7.0800 6.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 5.8310 6.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 8.0980 7.4990 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 9.3620 7.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 10.1350 8.4030 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8140 9.7510 6.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5210 10.8630 6.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5640 11.4580 5.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8110 10.8370 5.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7990 11.4230 4.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5480 12.6320 4.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3110 13.2580 4.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3210 12.6750 5.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9930 8.8520 5.0210 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4720 2.8890 4.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3420 1.8440 3.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1360 1.2200 5.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 3.6350 4.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7820 4.6160 5.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2550 4.7240 7.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3890 5.2580 5.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8100 2.2840 7.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 1.3290 6.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9920 0.6670 6.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1160 1.2810 4.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0930 4.1470 4.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1030 6.3510 3.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3320 5.6640 7.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 7.9230 8.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3450 11.4180 7.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0220 9.8960 6.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7650 10.9370 4.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3180 13.0860 3.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1180 14.2020 3.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3610 13.1740 5.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5750 2.6050 5.7220 N 0 3 0 0 0 0 0 0 0 0 0 0 3.9630 2.8320 6.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 48 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 48 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 6 48 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 14 2 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 42 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 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 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 25 47 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 48 1 M END