PUBCHEM-ZINC03702955 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 0.9140 -1.1420 0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.3590 -0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7280 -2.2500 -0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 -2.6100 -1.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1560 -0.3580 1.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4780 1.1380 1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2050 1.4000 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7830 2.6360 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5520 3.7270 0.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2070 4.9420 0.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0920 5.0970 -0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3460 3.9830 -1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6720 2.7730 -1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3000 4.0760 -2.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3050 5.2100 -2.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8070 6.4250 -0.8100 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.5820 6.5060 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9020 7.6300 -0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9140 8.6440 0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9000 9.6160 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1470 9.3230 -1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6710 7.8820 -1.8980 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 10.0880 -1.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9360 -0.7590 0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6240 -1.0490 1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 -2.2040 0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 0.7100 0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2950 -0.4720 -1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8120 -2.3930 -0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -2.8620 0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6070 -3.6220 -2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6870 -1.9230 -2.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1810 -2.6000 -1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -0.6410 2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0970 -0.9170 1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0900 1.3740 2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5600 1.7340 1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8660 3.6760 1.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0040 5.7710 1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8500 1.9180 -1.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7120 4.2280 -3.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8510 3.1350 -2.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8720 5.3760 -3.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0040 5.0360 -1.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6090 8.6930 1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7310 10.4880 0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 9.4750 -1.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2230 10.4110 -2.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7930 10.9820 -1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 -0.7880 -0.0400 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9580 -0.2520 -0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5710 6.4690 -2.1090 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.8930 6.6630 -2.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2120 7.2730 -2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 50 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 50 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 50 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 15 52 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 52 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 50 51 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 M CHG 1 50 1 M CHG 1 52 1 M END