PUBCHEM-ZINC04760709 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 54 0 0 1 0 0 0 0 0999 V2000 -1.0750 -0.3410 -1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 -0.2910 0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3010 -1.3310 0.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 -0.5110 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -0.3340 2.7160 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6630 -0.9400 3.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 -0.8340 3.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 0.1100 3.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 1.0780 3.1020 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 1.7010 3.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 1.1380 3.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 3.2100 3.6150 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3110 3.3930 4.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 3.9690 2.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 5.4700 2.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 6.2870 0.8650 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 7.9830 1.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3880 3.5820 4.3380 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 4.6060 5.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5790 5.3610 5.5510 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7540 4.6680 5.7030 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9790 5.7160 6.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4180 5.6430 7.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7730 4.9950 8.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1110 4.9070 8.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1070 5.4590 7.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7680 6.0990 6.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4300 6.1880 6.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 -1.3170 -1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0240 -0.1570 -1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 0.4240 -1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 0.7070 0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9530 -2.3470 0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5290 -1.2670 1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2410 -1.1780 0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -1.5180 0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 0.1860 0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 1.5610 3.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1850 3.5430 1.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9250 3.8010 1.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6870 5.9340 2.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 5.6470 3.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 8.6430 0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2260 8.3210 1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5330 8.0460 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2230 3.0250 4.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3130 5.5930 7.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7790 6.6920 6.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0080 4.5490 8.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3780 4.4030 9.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1490 5.3870 8.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5450 6.5250 6.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1790 6.6790 5.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7030 -2.0840 3.1580 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 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 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 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 54 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 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 53 1 0 0 0 0 M CHG 1 54 -1 M END