PUBCHEM-ZINC06545150 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 0.1150 1.3940 0.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.0030 0.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -0.5720 0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 0.1410 0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6370 -0.5270 0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7260 -1.9020 0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5350 -2.6480 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2760 -1.9740 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -2.7340 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 -3.1550 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 -3.8670 -0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8770 -4.5270 -1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8860 -5.1370 -0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8530 -5.0970 0.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8160 -4.4470 1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 -3.8420 0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 -3.1400 1.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -2.9470 1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2610 -2.9070 -2.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 -1.6240 -3.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -1.3890 -4.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 -0.1070 -5.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6880 -4.0470 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9490 -4.6310 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0400 -3.8000 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9500 -2.4600 0.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 1.6640 0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3590 1.9690 -0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 1.6470 1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4270 1.2180 0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5540 0.0490 0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 -4.5680 -2.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7020 -5.6480 -1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6450 -5.5780 1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7940 -4.4160 2.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 -3.7620 -3.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 -2.8470 -2.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -0.7650 -2.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 -1.6790 -3.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 -2.2420 -5.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 -1.3320 -4.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 0.7760 -4.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 -0.1410 -5.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8200 -4.6950 -0.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0730 -5.7040 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0500 -4.1980 0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 0.0710 -6.5880 N 0 3 0 0 0 0 0 0 0 0 0 0 1.1780 0.9310 -6.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 0.1370 -6.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 -0.7120 -7.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 26 2 0 0 0 0 7 8 1 0 0 0 0 7 23 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 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 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 47 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 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 47 48 1 0 0 0 0 47 49 1 0 0 0 0 47 50 1 0 0 0 0 M CHG 1 47 1 M END