PUBCHEM-ZINC06263669 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 52 0 0 1 0 0 0 0 0999 V2000 -3.2850 -0.8860 -2.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 -1.0510 -1.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 -1.2820 -2.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 -1.0810 -3.6730 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 -1.7580 -1.7570 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 -2.0290 -0.2620 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3420 -2.8970 -0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6850 -2.3600 0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4990 -3.2060 -0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4610 -4.2160 -0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9920 -4.7940 0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9610 -5.7990 0.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4010 -6.2290 -0.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8890 -5.6700 -1.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9220 -4.6650 -1.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2600 -3.9440 -2.4530 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -4.0600 -3.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 -3.0560 -1.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 -2.0980 -2.5940 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1060 -2.6330 -3.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 -0.8950 -3.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5720 0.2310 -2.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3350 1.3030 -2.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8120 1.2280 -4.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5480 0.1440 -4.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7970 -0.9250 -4.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1100 0.2600 -6.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7590 1.5430 -6.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5720 2.1650 -4.7160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 -0.8930 0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 0.2660 0.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1720 -0.0180 -3.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4280 -1.7700 -3.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1890 -0.7430 -1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1390 -1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2550 -1.8980 -0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2640 -1.4510 0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 -2.8650 1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6550 -4.4620 1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3730 -6.2450 1.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1560 -7.0090 -0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2350 -6.0040 -2.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1890 0.2790 -1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5420 2.1620 -2.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6050 -1.7640 -5.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8340 1.4100 -6.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3590 2.2100 -6.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 -1.2710 1.6140 O 0 5 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 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 30 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 30 31 2 0 0 0 0 30 48 1 0 0 0 0 M CHG 1 48 -1 M END