PUBCHEM-ZINC03785475 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.7640 1.2940 -0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 -0.1540 -0.2780 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3250 -0.7300 -0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 -0.8040 -1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5040 -2.3230 -1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3050 -2.9070 -2.3240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 -3.4430 -3.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7770 -3.8910 -4.2540 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9390 -3.6400 -3.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 -3.0230 -2.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6840 -2.6600 -1.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0030 -2.9420 -1.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2930 -3.5580 -3.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2680 -3.9130 -3.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 0.1230 2.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -0.6130 3.3650 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3630 -0.0180 3.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3480 -0.9410 4.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 -1.9580 4.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1030 -2.2450 5.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 -1.5160 6.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 -0.5000 6.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 -0.2130 5.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8970 0.1230 8.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 1.1310 8.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6980 -1.8130 7.8900 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0080 -1.8100 2.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 1.8990 -0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 1.3450 -1.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 1.7560 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -0.5920 -2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3790 -0.3480 -1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 -2.6090 -0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 -2.7940 -1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 -3.4810 -3.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4700 -2.1840 -0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8180 -2.6780 -1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3260 -3.7660 -3.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4880 -4.3930 -4.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 -0.2750 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 1.2060 2.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4710 -2.5370 3.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8530 -3.0300 5.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 0.5730 5.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 1.9720 7.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 1.5070 9.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 0.7210 8.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4030 -1.2050 8.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 -2.4230 3.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 -0.1700 0.9710 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8060 -1.1180 1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 0.4390 0.8790 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 3 1 0 0 0 0 2 4 1 0 0 0 0 2 50 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 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 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 15 50 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 27 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 50 51 1 0 0 0 0 50 52 1 0 0 0 0 M CHG 1 50 1 M END