PUBCHEM-ZINC04223449 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 0.3350 1.3020 -0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 -0.1940 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 -2.1760 1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 -2.6140 2.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6150 -1.9150 3.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 -0.7680 3.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -0.1520 5.2660 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 -1.3730 5.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 -2.2640 5.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9170 -3.3730 5.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1580 -3.6000 6.6420 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4190 -4.0900 4.4150 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2840 -5.1870 4.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4630 -6.4350 5.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -1.4400 7.3470 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -0.5850 8.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 0.3980 8.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6770 -0.9490 9.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3150 -0.2450 10.7500 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 -0.8040 11.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 -0.3190 13.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 -0.9900 14.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0170 -2.1330 14.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2090 -2.6330 12.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6100 -1.9520 11.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6610 -2.3160 10.0320 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -0.1170 2.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3900 1.5940 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 1.5950 -1.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 1.8730 0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 -0.4860 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -0.7250 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3990 -2.5110 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 -2.5700 1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8310 -3.6990 2.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9670 -2.3970 2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9400 -5.3510 3.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9260 -4.9400 5.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1130 -7.2920 5.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7980 -6.2940 5.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8270 -6.6660 4.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3230 -2.2290 7.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 0.5730 13.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 -0.6150 15.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4710 -2.6440 14.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8060 -3.5250 12.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 -0.3190 2.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 0.9620 2.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -0.6540 1.2200 N 0 3 0 0 0 0 0 0 0 0 0 0 1.8390 -0.2840 1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 49 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 49 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 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 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 26 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END