PUBCHEM-ZINC05985940 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.0140 1.2100 -0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5810 0.5470 1.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 2.9910 1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5770 3.4440 2.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 4.9320 2.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4440 5.4140 3.5530 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2130 5.7100 4.9600 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4840 6.5290 4.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5680 6.2100 5.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9160 6.5740 6.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9170 7.2990 7.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6930 6.8830 8.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7450 7.5670 9.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 8.6180 9.1320 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 9.0150 7.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2270 8.3940 7.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9690 6.2300 7.2750 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4490 6.1890 4.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7590 6.5520 4.3560 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7420 5.6770 3.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2710 5.5360 2.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7170 4.5260 5.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 3.3400 5.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9920 2.2620 6.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 2.3570 7.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 3.5310 7.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 4.6110 6.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 3.5860 7.8700 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 0.1980 -0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 1.2710 -0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 1.9200 -1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4440 0.6490 2.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7480 -0.4490 1.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 0.7240 2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 3.6100 0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 3.0400 1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5890 3.2510 1.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 2.8660 3.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 5.1420 3.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5070 5.5100 1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2350 6.0480 9.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 7.2830 10.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 9.8800 7.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4040 8.7760 6.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0850 6.3960 3.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4280 3.2440 5.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5810 1.3520 6.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 1.5250 7.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 5.5200 6.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 4.5020 7.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 1.5600 0.8630 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8010 1.4960 0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 51 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 51 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 51 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 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 17 2 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 44 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 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 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END