PUBCHEM-ZINC03746124 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 0 0 0 0 0999 V2000 -0.2810 1.2320 -0.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -0.2020 -0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 -0.3930 1.0530 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4150 0.0130 1.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 0.3800 1.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 -1.8720 1.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5750 -2.6620 0.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6930 -4.0250 1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 -4.5820 2.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 -3.8410 2.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 -2.4680 2.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0290 -4.7270 3.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 -5.9810 3.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -5.8710 2.4540 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -6.6410 2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7930 -7.2680 3.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0130 -7.8470 3.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3980 -9.0880 4.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 -9.7710 4.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 -9.2180 5.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -7.9450 4.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 -7.4190 5.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 -8.1270 6.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 -9.3800 6.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 -9.9200 6.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2210 -4.3440 4.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4390 -4.0840 3.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0700 -5.1150 2.9760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 1.9070 -0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 1.2870 -1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1050 1.5940 -0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -0.8480 -0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -0.5180 -1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 1.4600 1.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 0.1670 2.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5440 0.1210 0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2950 -2.2200 0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4820 -4.6230 0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 -1.8850 2.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6740 -7.3230 2.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3470 -9.5190 3.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8870 -10.7420 5.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6170 -6.4330 5.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0160 -7.6910 6.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -9.9330 7.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 -10.8980 6.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4690 -5.1250 4.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9890 -3.4450 4.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6970 -2.8640 3.1320 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 M CHG 1 49 -1 M END