PUBCHEM-ZINC04931716 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 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 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -1.9020 1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 -2.2930 2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6090 -3.8180 2.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 -4.1920 3.8330 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 -4.3980 5.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 -5.8420 5.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 -6.6220 4.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 -6.2660 6.2700 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -7.5980 6.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -8.1080 7.3580 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 -9.3950 7.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 -10.0020 6.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 -8.8010 5.1980 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.6020 -10.1200 8.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 -4.3480 3.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2710 -4.6580 4.8070 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4230 -4.1360 2.5100 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0260 -3.3590 1.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0480 -5.3650 1.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9400 -4.3300 2.5370 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3950 -4.6100 3.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7720 -3.4320 1.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7250 -2.6030 2.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4870 -1.7800 1.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2980 -1.7850 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3450 -2.6140 -0.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5860 -3.4410 0.2880 C 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 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2370 -2.3180 1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 -2.2920 0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 -1.8760 2.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -1.9020 3.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.2340 2.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -4.2090 1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -4.1430 5.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -3.7620 5.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -5.6420 6.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 -11.0460 5.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6680 -10.0760 8.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 -11.1620 8.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 -9.6490 9.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9160 -6.3260 2.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0630 -5.3960 0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8730 -2.5990 3.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2310 -1.1320 1.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8930 -1.1400 -0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1970 -2.6180 -1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8440 -4.0910 -0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 55 1 0 0 0 0 M END