PUBCHEM-ZINC05931787 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 53 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4770 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -0.0300 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -0.8350 1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -0.6000 2.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 -1.7110 3.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3400 -3.0010 2.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -3.2210 1.5250 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -2.2260 0.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -2.1660 -0.6830 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0810 -0.8230 -1.0710 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -0.5110 -1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -3.2420 -1.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 -3.1180 -2.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -4.2150 -3.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -5.4020 -3.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 -5.4550 -1.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 -4.3950 -1.1640 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -4.1620 3.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -5.4560 3.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 -6.3650 4.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 -5.8300 5.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6240 -4.0760 5.4700 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 0.7700 3.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 1.5780 2.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 1.1220 4.0840 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 2.5040 4.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 2.9730 4.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9070 2.0170 5.2330 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9160 0.7200 4.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 0.1380 4.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 1.8600 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8270 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 1.8320 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4690 -1.5880 4.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1550 -2.1800 -3.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 -4.1500 -4.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 -6.2760 -3.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 -6.3780 -1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -5.7530 2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -7.4320 4.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -6.3920 6.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 2.5370 5.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 3.1500 3.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 3.9400 5.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4190 3.0630 3.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 0.0680 5.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2490 0.8030 3.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4730 -0.7830 4.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -0.0720 5.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 18 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 M CHG 1 9 1 M END