PUBCHEM-ZINC06270779 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -0.4650 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -1.8110 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 -2.6680 -0.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -4.0320 -0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 -4.5620 -1.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 -3.6940 -2.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 -2.3220 -2.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 -4.5020 -3.5960 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5310 -4.2040 -4.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8770 -5.7980 -3.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 -5.8310 -2.0740 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8440 -7.0490 -1.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 -7.4800 -1.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -8.3420 -2.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9200 -8.7370 -3.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0440 -8.2700 -2.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9080 -7.4080 -1.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 -7.0170 -1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 -6.9070 -3.9240 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0020 -6.7410 -5.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3410 -8.1170 -5.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0870 -7.9430 -7.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -9.2280 -7.6360 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 -2.2600 0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -4.6920 0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 -1.6530 -3.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 -7.8410 -1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 -6.8520 -0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 -8.7080 -3.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 -9.4100 -4.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0260 -8.5780 -2.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7860 -7.0430 -1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5450 -6.3460 -0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1050 -7.7970 -3.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 -6.1970 -5.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9220 -6.1820 -5.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9720 -8.6610 -5.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 -8.6760 -5.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4560 -7.3990 -7.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0070 -7.3840 -6.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8780 -9.1950 -8.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 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 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 M CHG 1 13 1 M END